USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1145 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 104 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 106 HIS :FLIP no HD1:sc= -0.176 F(o=-0.8,f=-0.18) USER MOD Set 2.1: A 79 CYS SG : rot -86:sc= 0.477 USER MOD Set 2.2: A 80 GLN : amide:sc= 0.152 K(o=0.63,f=-0.15) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0605 USER MOD Single : A 6 SER OG : rot 20:sc= 0.994 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= -0.17 X(o=-0.17,f=-0.26) USER MOD Single : A 26 LYS NZ :NH3+ 172:sc=-0.00339 (180deg=-0.0884) USER MOD Single : A 27 GLN : amide:sc=-0.00936 X(o=-0.0094,f=-0.0094) USER MOD Single : A 31 MET CE :methyl -142:sc= 0 (180deg=-0.00297) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 42 GLN : amide:sc= -0.422 X(o=-0.42,f=-0.47) USER MOD Single : A 56 ASN : amide:sc= 0.624 K(o=0.62,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 165:sc= 2.02 (180deg=1.53) USER MOD Single : A 67 THR OG1 : rot -51:sc= 1.41 USER MOD Single : A 68 MET CE :methyl -175:sc= -0.368 (180deg=-0.385) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 172:sc= -0.0116 (180deg=-0.127) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl 155:sc= 0 (180deg=-0.728) USER MOD Single : A 90 LYS NZ :NH3+ 178:sc= 1.17 (180deg=1.17) USER MOD Single : A 91 HIS : no HD1:sc=-0.00197 X(o=-0.002,f=-0.42) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -176:sc= -0.341 (180deg=-0.357) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 HIS : no HD1:sc= -0.662 X(o=-0.66,f=-0.17) USER MOD Single : A 132 HIS : no HD1:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 134 HIS : no HD1:sc= -0.382 X(o=-0.38,f=-0.026) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 35.911 -63.154 -23.998 1.00 0.00 N ATOM 2 CA PRO A 1 35.594 -62.007 -23.131 1.00 0.00 C ATOM 3 C PRO A 1 34.132 -61.587 -23.304 1.00 0.00 C ATOM 4 O PRO A 1 33.682 -61.404 -24.433 1.00 0.00 O ATOM 5 CB PRO A 1 36.556 -60.884 -23.551 1.00 0.00 C ATOM 6 CG PRO A 1 36.859 -61.191 -25.025 1.00 0.00 C ATOM 7 CD PRO A 1 36.813 -62.720 -25.077 1.00 0.00 C ATOM 0 H2 PRO A 1 35.054 -63.542 -24.393 1.00 0.00 H new ATOM 0 H3 PRO A 1 36.350 -63.895 -23.452 1.00 0.00 H new ATOM 0 HA PRO A 1 35.717 -62.251 -22.076 1.00 0.00 H new ATOM 0 HB2 PRO A 1 36.099 -59.901 -23.433 1.00 0.00 H new ATOM 0 HB3 PRO A 1 37.463 -60.888 -22.947 1.00 0.00 H new ATOM 0 HG2 PRO A 1 36.121 -60.743 -25.690 1.00 0.00 H new ATOM 0 HG3 PRO A 1 37.834 -60.806 -25.325 1.00 0.00 H new ATOM 0 HD2 PRO A 1 36.450 -63.063 -26.046 1.00 0.00 H new ATOM 0 HD3 PRO A 1 37.809 -63.142 -24.942 1.00 0.00 H new ATOM 15 N ALA A 2 33.387 -61.470 -22.203 1.00 0.00 N ATOM 16 CA ALA A 2 31.986 -61.070 -22.167 1.00 0.00 C ATOM 17 C ALA A 2 31.742 -60.375 -20.824 1.00 0.00 C ATOM 18 O ALA A 2 32.606 -60.423 -19.947 1.00 0.00 O ATOM 19 CB ALA A 2 31.089 -62.307 -22.312 1.00 0.00 C ATOM 0 H ALA A 2 33.763 -61.660 -21.274 1.00 0.00 H new ATOM 0 HA ALA A 2 31.750 -60.392 -22.987 1.00 0.00 H new ATOM 0 HB1 ALA A 2 30.043 -62.003 -22.284 1.00 0.00 H new ATOM 0 HB2 ALA A 2 31.299 -62.799 -23.262 1.00 0.00 H new ATOM 0 HB3 ALA A 2 31.288 -62.998 -21.493 1.00 0.00 H new ATOM 25 N ALA A 3 30.595 -59.714 -20.677 1.00 0.00 N ATOM 26 CA ALA A 3 30.177 -59.006 -19.477 1.00 0.00 C ATOM 27 C ALA A 3 28.649 -58.937 -19.489 1.00 0.00 C ATOM 28 O ALA A 3 28.028 -59.153 -20.533 1.00 0.00 O ATOM 29 CB ALA A 3 30.773 -57.591 -19.469 1.00 0.00 C ATOM 0 H ALA A 3 29.905 -59.657 -21.426 1.00 0.00 H new ATOM 0 HA ALA A 3 30.526 -59.524 -18.584 1.00 0.00 H new ATOM 0 HB1 ALA A 3 30.455 -57.067 -18.567 1.00 0.00 H new ATOM 0 HB2 ALA A 3 31.861 -57.654 -19.488 1.00 0.00 H new ATOM 0 HB3 ALA A 3 30.426 -57.045 -20.347 1.00 0.00 H new ATOM 35 N SER A 4 28.036 -58.617 -18.351 1.00 0.00 N ATOM 36 CA SER A 4 26.587 -58.504 -18.220 1.00 0.00 C ATOM 37 C SER A 4 26.270 -57.444 -17.154 1.00 0.00 C ATOM 38 O SER A 4 25.940 -57.793 -16.023 1.00 0.00 O ATOM 39 CB SER A 4 25.982 -59.881 -17.900 1.00 0.00 C ATOM 40 OG SER A 4 26.403 -60.846 -18.852 1.00 0.00 O ATOM 0 H SER A 4 28.539 -58.427 -17.484 1.00 0.00 H new ATOM 0 HA SER A 4 26.134 -58.178 -19.156 1.00 0.00 H new ATOM 0 HB2 SER A 4 26.284 -60.193 -16.900 1.00 0.00 H new ATOM 0 HB3 SER A 4 24.894 -59.815 -17.898 1.00 0.00 H new ATOM 0 HG SER A 4 26.010 -61.716 -18.632 1.00 0.00 H new ATOM 46 N PRO A 5 26.451 -56.146 -17.460 1.00 0.00 N ATOM 47 CA PRO A 5 26.166 -55.079 -16.510 1.00 0.00 C ATOM 48 C PRO A 5 24.650 -54.889 -16.360 1.00 0.00 C ATOM 49 O PRO A 5 23.860 -55.388 -17.162 1.00 0.00 O ATOM 50 CB PRO A 5 26.833 -53.839 -17.113 1.00 0.00 C ATOM 51 CG PRO A 5 26.698 -54.076 -18.618 1.00 0.00 C ATOM 52 CD PRO A 5 26.849 -55.593 -18.748 1.00 0.00 C ATOM 0 HA PRO A 5 26.542 -55.291 -15.509 1.00 0.00 H new ATOM 0 HB2 PRO A 5 26.335 -52.921 -16.802 1.00 0.00 H new ATOM 0 HB3 PRO A 5 27.876 -53.754 -16.809 1.00 0.00 H new ATOM 0 HG2 PRO A 5 25.734 -53.734 -18.995 1.00 0.00 H new ATOM 0 HG3 PRO A 5 27.467 -53.545 -19.180 1.00 0.00 H new ATOM 0 HD2 PRO A 5 26.221 -55.981 -19.550 1.00 0.00 H new ATOM 0 HD3 PRO A 5 27.877 -55.864 -18.989 1.00 0.00 H new ATOM 60 N SER A 6 24.233 -54.156 -15.330 1.00 0.00 N ATOM 61 CA SER A 6 22.849 -53.831 -15.010 1.00 0.00 C ATOM 62 C SER A 6 22.873 -52.655 -14.029 1.00 0.00 C ATOM 63 O SER A 6 23.908 -52.385 -13.417 1.00 0.00 O ATOM 64 CB SER A 6 22.151 -55.054 -14.400 1.00 0.00 C ATOM 65 OG SER A 6 21.850 -55.995 -15.410 1.00 0.00 O ATOM 0 H SER A 6 24.889 -53.752 -14.661 1.00 0.00 H new ATOM 0 HA SER A 6 22.291 -53.555 -15.905 1.00 0.00 H new ATOM 0 HB2 SER A 6 22.793 -55.510 -13.646 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.236 -54.746 -13.895 1.00 0.00 H new ATOM 0 HG SER A 6 22.414 -55.826 -16.194 1.00 0.00 H new ATOM 71 N ALA A 7 21.761 -51.927 -13.905 1.00 0.00 N ATOM 72 CA ALA A 7 21.613 -50.783 -13.015 1.00 0.00 C ATOM 73 C ALA A 7 20.123 -50.560 -12.747 1.00 0.00 C ATOM 74 O ALA A 7 19.272 -51.144 -13.419 1.00 0.00 O ATOM 75 CB ALA A 7 22.230 -49.532 -13.661 1.00 0.00 C ATOM 0 H ALA A 7 20.915 -52.127 -14.439 1.00 0.00 H new ATOM 0 HA ALA A 7 22.130 -50.975 -12.075 1.00 0.00 H new ATOM 0 HB1 ALA A 7 22.115 -48.681 -12.989 1.00 0.00 H new ATOM 0 HB2 ALA A 7 23.290 -49.705 -13.850 1.00 0.00 H new ATOM 0 HB3 ALA A 7 21.723 -49.321 -14.603 1.00 0.00 H new ATOM 81 N LEU A 8 19.804 -49.705 -11.775 1.00 0.00 N ATOM 82 CA LEU A 8 18.444 -49.352 -11.375 1.00 0.00 C ATOM 83 C LEU A 8 18.348 -47.839 -11.177 1.00 0.00 C ATOM 84 O LEU A 8 19.306 -47.111 -11.430 1.00 0.00 O ATOM 85 CB LEU A 8 17.996 -50.179 -10.148 1.00 0.00 C ATOM 86 CG LEU A 8 18.837 -50.068 -8.855 1.00 0.00 C ATOM 87 CD1 LEU A 8 18.744 -48.702 -8.160 1.00 0.00 C ATOM 88 CD2 LEU A 8 18.364 -51.142 -7.869 1.00 0.00 C ATOM 0 H LEU A 8 20.514 -49.222 -11.225 1.00 0.00 H new ATOM 0 HA LEU A 8 17.740 -49.611 -12.166 1.00 0.00 H new ATOM 0 HB2 LEU A 8 16.972 -49.892 -9.907 1.00 0.00 H new ATOM 0 HB3 LEU A 8 17.972 -51.228 -10.442 1.00 0.00 H new ATOM 0 HG LEU A 8 19.877 -50.202 -9.151 1.00 0.00 H new ATOM 0 HD11 LEU A 8 19.362 -48.708 -7.262 1.00 0.00 H new ATOM 0 HD12 LEU A 8 19.096 -47.924 -8.838 1.00 0.00 H new ATOM 0 HD13 LEU A 8 17.708 -48.503 -7.886 1.00 0.00 H new ATOM 0 HD21 LEU A 8 18.948 -51.076 -6.951 1.00 0.00 H new ATOM 0 HD22 LEU A 8 17.310 -50.987 -7.640 1.00 0.00 H new ATOM 0 HD23 LEU A 8 18.497 -52.128 -8.314 1.00 0.00 H new ATOM 100 N LYS A 9 17.166 -47.341 -10.817 1.00 0.00 N ATOM 101 CA LYS A 9 16.867 -45.943 -10.562 1.00 0.00 C ATOM 102 C LYS A 9 15.728 -45.881 -9.549 1.00 0.00 C ATOM 103 O LYS A 9 15.012 -46.870 -9.410 1.00 0.00 O ATOM 104 CB LYS A 9 16.577 -45.169 -11.858 1.00 0.00 C ATOM 105 CG LYS A 9 15.273 -45.494 -12.610 1.00 0.00 C ATOM 106 CD LYS A 9 15.261 -46.868 -13.297 1.00 0.00 C ATOM 107 CE LYS A 9 16.332 -47.049 -14.388 1.00 0.00 C ATOM 108 NZ LYS A 9 16.126 -46.147 -15.548 1.00 0.00 N ATOM 0 H LYS A 9 16.350 -47.940 -10.690 1.00 0.00 H new ATOM 0 HA LYS A 9 17.738 -45.443 -10.138 1.00 0.00 H new ATOM 0 HB2 LYS A 9 16.570 -44.106 -11.619 1.00 0.00 H new ATOM 0 HB3 LYS A 9 17.409 -45.337 -12.542 1.00 0.00 H new ATOM 0 HG2 LYS A 9 14.441 -45.446 -11.907 1.00 0.00 H new ATOM 0 HG3 LYS A 9 15.100 -44.724 -13.362 1.00 0.00 H new ATOM 0 HD2 LYS A 9 15.399 -47.639 -12.539 1.00 0.00 H new ATOM 0 HD3 LYS A 9 14.278 -47.029 -13.741 1.00 0.00 H new ATOM 0 HE2 LYS A 9 17.317 -46.863 -13.959 1.00 0.00 H new ATOM 0 HE3 LYS A 9 16.324 -48.083 -14.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 16.874 -46.310 -16.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.199 -46.340 -15.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 16.161 -45.158 -15.229 1.00 0.00 H new ATOM 122 N GLY A 10 15.519 -44.716 -8.936 1.00 0.00 N ATOM 123 CA GLY A 10 14.487 -44.499 -7.930 1.00 0.00 C ATOM 124 C GLY A 10 15.167 -44.555 -6.570 1.00 0.00 C ATOM 125 O GLY A 10 15.048 -45.541 -5.852 1.00 0.00 O ATOM 0 H GLY A 10 16.074 -43.883 -9.131 1.00 0.00 H new ATOM 0 HA2 GLY A 10 14.002 -43.534 -8.078 1.00 0.00 H new ATOM 0 HA3 GLY A 10 13.711 -45.261 -8.004 1.00 0.00 H new ATOM 129 N VAL A 11 15.976 -43.541 -6.262 1.00 0.00 N ATOM 130 CA VAL A 11 16.722 -43.414 -5.017 1.00 0.00 C ATOM 131 C VAL A 11 16.981 -41.915 -4.798 1.00 0.00 C ATOM 132 O VAL A 11 16.841 -41.122 -5.731 1.00 0.00 O ATOM 133 CB VAL A 11 18.000 -44.291 -5.108 1.00 0.00 C ATOM 134 CG1 VAL A 11 18.990 -43.822 -6.188 1.00 0.00 C ATOM 135 CG2 VAL A 11 18.728 -44.422 -3.764 1.00 0.00 C ATOM 0 H VAL A 11 16.133 -42.759 -6.898 1.00 0.00 H new ATOM 0 HA VAL A 11 16.179 -43.780 -4.145 1.00 0.00 H new ATOM 0 HB VAL A 11 17.630 -45.274 -5.400 1.00 0.00 H new ATOM 0 HG11 VAL A 11 19.859 -44.480 -6.196 1.00 0.00 H new ATOM 0 HG12 VAL A 11 18.505 -43.851 -7.164 1.00 0.00 H new ATOM 0 HG13 VAL A 11 19.309 -42.802 -5.971 1.00 0.00 H new ATOM 0 HG21 VAL A 11 19.613 -45.046 -3.889 1.00 0.00 H new ATOM 0 HG22 VAL A 11 19.027 -43.434 -3.414 1.00 0.00 H new ATOM 0 HG23 VAL A 11 18.062 -44.880 -3.033 1.00 0.00 H new ATOM 145 N SER A 12 17.295 -41.522 -3.562 1.00 0.00 N ATOM 146 CA SER A 12 17.605 -40.172 -3.081 1.00 0.00 C ATOM 147 C SER A 12 16.621 -39.037 -3.401 1.00 0.00 C ATOM 148 O SER A 12 16.845 -37.903 -2.997 1.00 0.00 O ATOM 149 CB SER A 12 19.047 -39.820 -3.465 1.00 0.00 C ATOM 150 OG SER A 12 19.921 -40.852 -3.046 1.00 0.00 O ATOM 0 H SER A 12 17.343 -42.201 -2.803 1.00 0.00 H new ATOM 0 HA SER A 12 17.484 -40.238 -2.000 1.00 0.00 H new ATOM 0 HB2 SER A 12 19.122 -39.683 -4.544 1.00 0.00 H new ATOM 0 HB3 SER A 12 19.336 -38.876 -3.003 1.00 0.00 H new ATOM 0 HG SER A 12 20.841 -40.623 -3.295 1.00 0.00 H new ATOM 156 N GLN A 13 15.489 -39.335 -4.017 1.00 0.00 N ATOM 157 CA GLN A 13 14.461 -38.362 -4.389 1.00 0.00 C ATOM 158 C GLN A 13 13.946 -37.648 -3.131 1.00 0.00 C ATOM 159 O GLN A 13 14.127 -36.443 -2.973 1.00 0.00 O ATOM 160 CB GLN A 13 13.388 -39.026 -5.274 1.00 0.00 C ATOM 161 CG GLN A 13 12.689 -40.268 -4.688 1.00 0.00 C ATOM 162 CD GLN A 13 12.122 -41.149 -5.801 1.00 0.00 C ATOM 163 OE1 GLN A 13 12.800 -42.046 -6.289 1.00 0.00 O ATOM 164 NE2 GLN A 13 10.893 -40.914 -6.232 1.00 0.00 N ATOM 0 H GLN A 13 15.247 -40.290 -4.283 1.00 0.00 H new ATOM 0 HA GLN A 13 14.874 -37.571 -5.015 1.00 0.00 H new ATOM 0 HB2 GLN A 13 12.626 -38.281 -5.503 1.00 0.00 H new ATOM 0 HB3 GLN A 13 13.852 -39.309 -6.219 1.00 0.00 H new ATOM 0 HG2 GLN A 13 13.398 -40.841 -4.090 1.00 0.00 H new ATOM 0 HG3 GLN A 13 11.886 -39.957 -4.020 1.00 0.00 H new ATOM 0 HE21 GLN A 13 10.341 -40.164 -5.816 1.00 0.00 H new ATOM 0 HE22 GLN A 13 10.497 -41.483 -6.980 1.00 0.00 H new ATOM 173 N ALA A 14 13.386 -38.410 -2.186 1.00 0.00 N ATOM 174 CA ALA A 14 12.871 -37.889 -0.919 1.00 0.00 C ATOM 175 C ALA A 14 14.005 -37.423 0.012 1.00 0.00 C ATOM 176 O ALA A 14 13.748 -36.946 1.117 1.00 0.00 O ATOM 177 CB ALA A 14 11.999 -38.952 -0.238 1.00 0.00 C ATOM 0 H ALA A 14 13.277 -39.420 -2.283 1.00 0.00 H new ATOM 0 HA ALA A 14 12.260 -37.012 -1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 14 11.618 -38.560 0.705 1.00 0.00 H new ATOM 0 HB2 ALA A 14 11.163 -39.209 -0.889 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.596 -39.843 -0.045 1.00 0.00 H new ATOM 183 N LEU A 15 15.264 -37.691 -0.346 1.00 0.00 N ATOM 184 CA LEU A 15 16.433 -37.303 0.426 1.00 0.00 C ATOM 185 C LEU A 15 16.812 -35.863 0.069 1.00 0.00 C ATOM 186 O LEU A 15 17.143 -35.096 0.969 1.00 0.00 O ATOM 187 CB LEU A 15 17.578 -38.284 0.134 1.00 0.00 C ATOM 188 CG LEU A 15 18.811 -38.152 1.040 1.00 0.00 C ATOM 189 CD1 LEU A 15 18.495 -38.512 2.496 1.00 0.00 C ATOM 190 CD2 LEU A 15 19.877 -39.107 0.487 1.00 0.00 C ATOM 0 H LEU A 15 15.497 -38.196 -1.201 1.00 0.00 H new ATOM 0 HA LEU A 15 16.222 -37.342 1.495 1.00 0.00 H new ATOM 0 HB2 LEU A 15 17.193 -39.300 0.220 1.00 0.00 H new ATOM 0 HB3 LEU A 15 17.893 -38.149 -0.901 1.00 0.00 H new ATOM 0 HG LEU A 15 19.156 -37.118 1.040 1.00 0.00 H new ATOM 0 HD11 LEU A 15 19.395 -38.405 3.101 1.00 0.00 H new ATOM 0 HD12 LEU A 15 17.721 -37.845 2.876 1.00 0.00 H new ATOM 0 HD13 LEU A 15 18.144 -39.543 2.548 1.00 0.00 H new ATOM 0 HD21 LEU A 15 20.775 -39.046 1.102 1.00 0.00 H new ATOM 0 HD22 LEU A 15 19.495 -40.128 0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 15 20.120 -38.827 -0.538 1.00 0.00 H new ATOM 202 N LEU A 16 16.730 -35.486 -1.215 1.00 0.00 N ATOM 203 CA LEU A 16 17.062 -34.147 -1.710 1.00 0.00 C ATOM 204 C LEU A 16 16.250 -33.080 -0.988 1.00 0.00 C ATOM 205 O LEU A 16 16.824 -32.115 -0.489 1.00 0.00 O ATOM 206 CB LEU A 16 16.789 -34.032 -3.223 1.00 0.00 C ATOM 207 CG LEU A 16 17.804 -34.753 -4.129 1.00 0.00 C ATOM 208 CD1 LEU A 16 17.271 -34.802 -5.565 1.00 0.00 C ATOM 209 CD2 LEU A 16 19.175 -34.064 -4.121 1.00 0.00 C ATOM 0 H LEU A 16 16.424 -36.120 -1.953 1.00 0.00 H new ATOM 0 HA LEU A 16 18.123 -33.990 -1.518 1.00 0.00 H new ATOM 0 HB2 LEU A 16 15.796 -34.431 -3.428 1.00 0.00 H new ATOM 0 HB3 LEU A 16 16.771 -32.976 -3.493 1.00 0.00 H new ATOM 0 HG LEU A 16 17.933 -35.762 -3.738 1.00 0.00 H new ATOM 0 HD11 LEU A 16 17.992 -35.313 -6.203 1.00 0.00 H new ATOM 0 HD12 LEU A 16 16.324 -35.341 -5.583 1.00 0.00 H new ATOM 0 HD13 LEU A 16 17.118 -33.787 -5.931 1.00 0.00 H new ATOM 0 HD21 LEU A 16 19.859 -34.607 -4.774 1.00 0.00 H new ATOM 0 HD22 LEU A 16 19.069 -33.039 -4.478 1.00 0.00 H new ATOM 0 HD23 LEU A 16 19.572 -34.056 -3.106 1.00 0.00 H new ATOM 221 N GLU A 17 14.938 -33.288 -0.855 1.00 0.00 N ATOM 222 CA GLU A 17 14.029 -32.341 -0.208 1.00 0.00 C ATOM 223 C GLU A 17 14.458 -31.926 1.202 1.00 0.00 C ATOM 224 O GLU A 17 14.046 -30.872 1.677 1.00 0.00 O ATOM 225 CB GLU A 17 12.611 -32.920 -0.197 1.00 0.00 C ATOM 226 CG GLU A 17 12.388 -33.899 0.958 1.00 0.00 C ATOM 227 CD GLU A 17 11.029 -34.578 0.887 1.00 0.00 C ATOM 228 OE1 GLU A 17 10.790 -35.359 -0.053 1.00 0.00 O ATOM 229 OE2 GLU A 17 10.199 -34.293 1.786 1.00 0.00 O ATOM 0 H GLU A 17 14.472 -34.128 -1.198 1.00 0.00 H new ATOM 0 HA GLU A 17 14.059 -31.425 -0.798 1.00 0.00 H new ATOM 0 HB2 GLU A 17 11.890 -32.106 -0.124 1.00 0.00 H new ATOM 0 HB3 GLU A 17 12.422 -33.429 -1.142 1.00 0.00 H new ATOM 0 HG2 GLU A 17 13.171 -34.657 0.945 1.00 0.00 H new ATOM 0 HG3 GLU A 17 12.476 -33.366 1.905 1.00 0.00 H new ATOM 236 N ARG A 18 15.259 -32.740 1.908 1.00 0.00 N ATOM 237 CA ARG A 18 15.714 -32.382 3.257 1.00 0.00 C ATOM 238 C ARG A 18 16.510 -31.069 3.227 1.00 0.00 C ATOM 239 O ARG A 18 16.679 -30.453 4.286 1.00 0.00 O ATOM 240 CB ARG A 18 16.527 -33.507 3.926 1.00 0.00 C ATOM 241 CG ARG A 18 15.698 -34.546 4.705 1.00 0.00 C ATOM 242 CD ARG A 18 14.988 -35.622 3.867 1.00 0.00 C ATOM 243 NE ARG A 18 13.556 -35.371 3.616 1.00 0.00 N ATOM 244 CZ ARG A 18 12.543 -35.436 4.494 1.00 0.00 C ATOM 245 NH1 ARG A 18 12.760 -35.605 5.796 1.00 0.00 N ATOM 246 NH2 ARG A 18 11.282 -35.350 4.098 1.00 0.00 N ATOM 0 H ARG A 18 15.601 -33.640 1.570 1.00 0.00 H new ATOM 0 HA ARG A 18 14.823 -32.238 3.868 1.00 0.00 H new ATOM 0 HB2 ARG A 18 17.099 -34.026 3.157 1.00 0.00 H new ATOM 0 HB3 ARG A 18 17.247 -33.056 4.609 1.00 0.00 H new ATOM 0 HG2 ARG A 18 16.357 -35.046 5.415 1.00 0.00 H new ATOM 0 HG3 ARG A 18 14.945 -34.015 5.288 1.00 0.00 H new ATOM 0 HD2 ARG A 18 15.499 -35.711 2.909 1.00 0.00 H new ATOM 0 HD3 ARG A 18 15.090 -36.582 4.373 1.00 0.00 H new ATOM 0 HE ARG A 18 13.306 -35.118 2.660 1.00 0.00 H new ATOM 0 HH11 ARG A 18 13.714 -35.688 6.147 1.00 0.00 H new ATOM 0 HH12 ARG A 18 11.972 -35.651 6.443 1.00 0.00 H new ATOM 0 HH21 ARG A 18 11.065 -35.232 3.108 1.00 0.00 H new ATOM 0 HH22 ARG A 18 10.528 -35.402 4.783 1.00 0.00 H new ATOM 260 N ILE A 19 17.004 -30.630 2.062 1.00 0.00 N ATOM 261 CA ILE A 19 17.748 -29.388 1.891 1.00 0.00 C ATOM 262 C ILE A 19 16.866 -28.198 2.331 1.00 0.00 C ATOM 263 O ILE A 19 17.419 -27.181 2.751 1.00 0.00 O ATOM 264 CB ILE A 19 18.314 -29.308 0.447 1.00 0.00 C ATOM 265 CG1 ILE A 19 19.419 -30.380 0.260 1.00 0.00 C ATOM 266 CG2 ILE A 19 18.899 -27.921 0.125 1.00 0.00 C ATOM 267 CD1 ILE A 19 19.811 -30.621 -1.204 1.00 0.00 C ATOM 0 H ILE A 19 16.891 -31.149 1.191 1.00 0.00 H new ATOM 0 HA ILE A 19 18.625 -29.351 2.537 1.00 0.00 H new ATOM 0 HB ILE A 19 17.484 -29.488 -0.237 1.00 0.00 H new ATOM 0 HG12 ILE A 19 20.305 -30.076 0.818 1.00 0.00 H new ATOM 0 HG13 ILE A 19 19.077 -31.320 0.694 1.00 0.00 H new ATOM 0 HG21 ILE A 19 19.282 -27.916 -0.896 1.00 0.00 H new ATOM 0 HG22 ILE A 19 18.120 -27.165 0.224 1.00 0.00 H new ATOM 0 HG23 ILE A 19 19.710 -27.698 0.818 1.00 0.00 H new ATOM 0 HD11 ILE A 19 20.588 -31.384 -1.252 1.00 0.00 H new ATOM 0 HD12 ILE A 19 18.938 -30.957 -1.764 1.00 0.00 H new ATOM 0 HD13 ILE A 19 20.185 -29.694 -1.638 1.00 0.00 H new ATOM 279 N ARG A 20 15.530 -28.339 2.391 1.00 0.00 N ATOM 280 CA ARG A 20 14.606 -27.285 2.829 1.00 0.00 C ATOM 281 C ARG A 20 14.924 -26.772 4.234 1.00 0.00 C ATOM 282 O ARG A 20 14.483 -25.684 4.602 1.00 0.00 O ATOM 283 CB ARG A 20 13.152 -27.778 2.747 1.00 0.00 C ATOM 284 CG ARG A 20 12.768 -28.945 3.688 1.00 0.00 C ATOM 285 CD ARG A 20 12.354 -28.561 5.116 1.00 0.00 C ATOM 286 NE ARG A 20 11.263 -27.581 5.150 1.00 0.00 N ATOM 287 CZ ARG A 20 9.977 -27.813 4.881 1.00 0.00 C ATOM 288 NH1 ARG A 20 9.525 -29.047 4.692 1.00 0.00 N ATOM 289 NH2 ARG A 20 9.145 -26.789 4.790 1.00 0.00 N ATOM 0 H ARG A 20 15.057 -29.205 2.131 1.00 0.00 H new ATOM 0 HA ARG A 20 14.736 -26.443 2.149 1.00 0.00 H new ATOM 0 HB2 ARG A 20 12.493 -26.936 2.960 1.00 0.00 H new ATOM 0 HB3 ARG A 20 12.953 -28.087 1.721 1.00 0.00 H new ATOM 0 HG2 ARG A 20 11.947 -29.497 3.231 1.00 0.00 H new ATOM 0 HG3 ARG A 20 13.616 -29.628 3.750 1.00 0.00 H new ATOM 0 HD2 ARG A 20 12.047 -29.458 5.653 1.00 0.00 H new ATOM 0 HD3 ARG A 20 13.218 -28.154 5.642 1.00 0.00 H new ATOM 0 HE ARG A 20 11.513 -26.626 5.405 1.00 0.00 H new ATOM 0 HH11 ARG A 20 10.165 -29.839 4.751 1.00 0.00 H new ATOM 0 HH12 ARG A 20 8.538 -29.203 4.487 1.00 0.00 H new ATOM 0 HH21 ARG A 20 9.489 -25.838 4.925 1.00 0.00 H new ATOM 0 HH22 ARG A 20 8.159 -26.950 4.585 1.00 0.00 H new ATOM 303 N ALA A 21 15.630 -27.572 5.039 1.00 0.00 N ATOM 304 CA ALA A 21 16.025 -27.199 6.384 1.00 0.00 C ATOM 305 C ALA A 21 17.363 -26.460 6.320 1.00 0.00 C ATOM 306 O ALA A 21 17.577 -25.498 7.047 1.00 0.00 O ATOM 307 CB ALA A 21 16.163 -28.452 7.247 1.00 0.00 C ATOM 0 H ALA A 21 15.942 -28.504 4.765 1.00 0.00 H new ATOM 0 HA ALA A 21 15.269 -26.550 6.825 1.00 0.00 H new ATOM 0 HB1 ALA A 21 16.460 -28.168 8.257 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.208 -28.976 7.284 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.920 -29.108 6.817 1.00 0.00 H new ATOM 313 N LYS A 22 18.289 -26.913 5.463 1.00 0.00 N ATOM 314 CA LYS A 22 19.602 -26.291 5.296 1.00 0.00 C ATOM 315 C LYS A 22 19.437 -24.822 4.933 1.00 0.00 C ATOM 316 O LYS A 22 20.100 -23.973 5.519 1.00 0.00 O ATOM 317 CB LYS A 22 20.441 -27.009 4.244 1.00 0.00 C ATOM 318 CG LYS A 22 21.355 -27.990 4.983 1.00 0.00 C ATOM 319 CD LYS A 22 21.920 -29.025 4.033 1.00 0.00 C ATOM 320 CE LYS A 22 22.846 -28.408 2.971 1.00 0.00 C ATOM 321 NZ LYS A 22 23.394 -29.416 2.033 1.00 0.00 N ATOM 0 H LYS A 22 18.143 -27.726 4.865 1.00 0.00 H new ATOM 0 HA LYS A 22 20.133 -26.371 6.244 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.801 -27.538 3.537 1.00 0.00 H new ATOM 0 HB3 LYS A 22 21.029 -26.294 3.668 1.00 0.00 H new ATOM 0 HG2 LYS A 22 22.170 -27.445 5.459 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.796 -28.486 5.777 1.00 0.00 H new ATOM 0 HD2 LYS A 22 22.473 -29.772 4.602 1.00 0.00 H new ATOM 0 HD3 LYS A 22 21.100 -29.544 3.537 1.00 0.00 H new ATOM 0 HE2 LYS A 22 22.294 -27.656 2.407 1.00 0.00 H new ATOM 0 HE3 LYS A 22 23.669 -27.894 3.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 24.010 -28.946 1.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 23.944 -30.121 2.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.612 -29.889 1.537 1.00 0.00 H new ATOM 335 N GLU A 23 18.547 -24.532 3.982 1.00 0.00 N ATOM 336 CA GLU A 23 18.294 -23.171 3.521 1.00 0.00 C ATOM 337 C GLU A 23 17.751 -22.241 4.609 1.00 0.00 C ATOM 338 O GLU A 23 17.838 -21.026 4.434 1.00 0.00 O ATOM 339 CB GLU A 23 17.376 -23.172 2.290 1.00 0.00 C ATOM 340 CG GLU A 23 15.969 -23.696 2.576 1.00 0.00 C ATOM 341 CD GLU A 23 15.075 -23.619 1.342 1.00 0.00 C ATOM 342 OE1 GLU A 23 15.486 -24.129 0.274 1.00 0.00 O ATOM 343 OE2 GLU A 23 13.958 -23.065 1.429 1.00 0.00 O ATOM 0 H GLU A 23 17.982 -25.238 3.511 1.00 0.00 H new ATOM 0 HA GLU A 23 19.266 -22.765 3.240 1.00 0.00 H new ATOM 0 HB2 GLU A 23 17.304 -22.157 1.900 1.00 0.00 H new ATOM 0 HB3 GLU A 23 17.830 -23.782 1.509 1.00 0.00 H new ATOM 0 HG2 GLU A 23 16.028 -24.729 2.918 1.00 0.00 H new ATOM 0 HG3 GLU A 23 15.523 -23.117 3.385 1.00 0.00 H new ATOM 350 N VAL A 24 17.247 -22.757 5.742 1.00 0.00 N ATOM 351 CA VAL A 24 16.718 -21.903 6.804 1.00 0.00 C ATOM 352 C VAL A 24 17.799 -20.953 7.342 1.00 0.00 C ATOM 353 O VAL A 24 17.478 -19.925 7.942 1.00 0.00 O ATOM 354 CB VAL A 24 15.978 -22.741 7.871 1.00 0.00 C ATOM 355 CG1 VAL A 24 16.868 -23.187 9.038 1.00 0.00 C ATOM 356 CG2 VAL A 24 14.783 -21.944 8.408 1.00 0.00 C ATOM 0 H VAL A 24 17.197 -23.756 5.940 1.00 0.00 H new ATOM 0 HA VAL A 24 15.954 -21.242 6.395 1.00 0.00 H new ATOM 0 HB VAL A 24 15.647 -23.653 7.374 1.00 0.00 H new ATOM 0 HG11 VAL A 24 16.277 -23.770 9.744 1.00 0.00 H new ATOM 0 HG12 VAL A 24 17.686 -23.799 8.658 1.00 0.00 H new ATOM 0 HG13 VAL A 24 17.274 -22.310 9.542 1.00 0.00 H new ATOM 0 HG21 VAL A 24 14.261 -22.534 9.161 1.00 0.00 H new ATOM 0 HG22 VAL A 24 15.137 -21.016 8.856 1.00 0.00 H new ATOM 0 HG23 VAL A 24 14.101 -21.715 7.589 1.00 0.00 H new ATOM 366 N GLN A 25 19.081 -21.252 7.081 1.00 0.00 N ATOM 367 CA GLN A 25 20.212 -20.427 7.475 1.00 0.00 C ATOM 368 C GLN A 25 20.061 -19.014 6.885 1.00 0.00 C ATOM 369 O GLN A 25 20.615 -18.066 7.437 1.00 0.00 O ATOM 370 CB GLN A 25 21.528 -21.121 7.072 1.00 0.00 C ATOM 371 CG GLN A 25 21.728 -21.341 5.560 1.00 0.00 C ATOM 372 CD GLN A 25 22.375 -20.154 4.858 1.00 0.00 C ATOM 373 OE1 GLN A 25 21.725 -19.427 4.111 1.00 0.00 O ATOM 374 NE2 GLN A 25 23.655 -19.919 5.071 1.00 0.00 N ATOM 0 H GLN A 25 19.356 -22.096 6.578 1.00 0.00 H new ATOM 0 HA GLN A 25 20.238 -20.310 8.558 1.00 0.00 H new ATOM 0 HB2 GLN A 25 22.361 -20.527 7.448 1.00 0.00 H new ATOM 0 HB3 GLN A 25 21.575 -22.089 7.571 1.00 0.00 H new ATOM 0 HG2 GLN A 25 22.346 -22.226 5.407 1.00 0.00 H new ATOM 0 HG3 GLN A 25 20.762 -21.544 5.099 1.00 0.00 H new ATOM 0 HE21 GLN A 25 24.189 -20.527 5.693 1.00 0.00 H new ATOM 0 HE22 GLN A 25 24.111 -19.129 4.614 1.00 0.00 H new ATOM 383 N LYS A 26 19.283 -18.839 5.804 1.00 0.00 N ATOM 384 CA LYS A 26 19.045 -17.543 5.178 1.00 0.00 C ATOM 385 C LYS A 26 18.407 -16.591 6.186 1.00 0.00 C ATOM 386 O LYS A 26 18.673 -15.392 6.154 1.00 0.00 O ATOM 387 CB LYS A 26 18.116 -17.722 3.965 1.00 0.00 C ATOM 388 CG LYS A 26 17.861 -16.412 3.193 1.00 0.00 C ATOM 389 CD LYS A 26 19.097 -15.863 2.462 1.00 0.00 C ATOM 390 CE LYS A 26 19.637 -16.832 1.403 1.00 0.00 C ATOM 391 NZ LYS A 26 18.629 -17.172 0.379 1.00 0.00 N ATOM 0 H LYS A 26 18.799 -19.608 5.340 1.00 0.00 H new ATOM 0 HA LYS A 26 19.994 -17.122 4.845 1.00 0.00 H new ATOM 0 HB2 LYS A 26 18.552 -18.456 3.287 1.00 0.00 H new ATOM 0 HB3 LYS A 26 17.163 -18.128 4.303 1.00 0.00 H new ATOM 0 HG2 LYS A 26 17.067 -16.580 2.465 1.00 0.00 H new ATOM 0 HG3 LYS A 26 17.499 -15.656 3.890 1.00 0.00 H new ATOM 0 HD2 LYS A 26 18.842 -14.916 1.986 1.00 0.00 H new ATOM 0 HD3 LYS A 26 19.881 -15.653 3.190 1.00 0.00 H new ATOM 0 HE2 LYS A 26 20.506 -16.387 0.918 1.00 0.00 H new ATOM 0 HE3 LYS A 26 19.977 -17.746 1.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.079 -17.718 -0.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.873 -17.740 0.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.224 -16.298 -0.013 1.00 0.00 H new ATOM 405 N GLN A 27 17.568 -17.107 7.084 1.00 0.00 N ATOM 406 CA GLN A 27 16.906 -16.296 8.095 1.00 0.00 C ATOM 407 C GLN A 27 17.936 -15.694 9.067 1.00 0.00 C ATOM 408 O GLN A 27 17.635 -14.700 9.716 1.00 0.00 O ATOM 409 CB GLN A 27 15.845 -17.134 8.829 1.00 0.00 C ATOM 410 CG GLN A 27 14.829 -17.854 7.913 1.00 0.00 C ATOM 411 CD GLN A 27 14.034 -16.905 7.017 1.00 0.00 C ATOM 412 OE1 GLN A 27 13.218 -16.123 7.495 1.00 0.00 O ATOM 413 NE2 GLN A 27 14.229 -16.944 5.707 1.00 0.00 N ATOM 0 H GLN A 27 17.331 -18.098 7.128 1.00 0.00 H new ATOM 0 HA GLN A 27 16.397 -15.463 7.610 1.00 0.00 H new ATOM 0 HB2 GLN A 27 16.353 -17.881 9.440 1.00 0.00 H new ATOM 0 HB3 GLN A 27 15.298 -16.483 9.511 1.00 0.00 H new ATOM 0 HG2 GLN A 27 15.361 -18.571 7.287 1.00 0.00 H new ATOM 0 HG3 GLN A 27 14.135 -18.424 8.531 1.00 0.00 H new ATOM 0 HE21 GLN A 27 14.908 -17.595 5.312 1.00 0.00 H new ATOM 0 HE22 GLN A 27 13.700 -16.323 5.094 1.00 0.00 H new ATOM 422 N LEU A 28 19.136 -16.275 9.195 1.00 0.00 N ATOM 423 CA LEU A 28 20.217 -15.798 10.065 1.00 0.00 C ATOM 424 C LEU A 28 21.257 -14.985 9.283 1.00 0.00 C ATOM 425 O LEU A 28 22.233 -14.510 9.876 1.00 0.00 O ATOM 426 CB LEU A 28 20.935 -16.985 10.730 1.00 0.00 C ATOM 427 CG LEU A 28 20.057 -17.891 11.611 1.00 0.00 C ATOM 428 CD1 LEU A 28 20.947 -18.924 12.311 1.00 0.00 C ATOM 429 CD2 LEU A 28 19.273 -17.112 12.669 1.00 0.00 C ATOM 0 H LEU A 28 19.389 -17.118 8.679 1.00 0.00 H new ATOM 0 HA LEU A 28 19.758 -15.160 10.820 1.00 0.00 H new ATOM 0 HB2 LEU A 28 21.386 -17.597 9.948 1.00 0.00 H new ATOM 0 HB3 LEU A 28 21.750 -16.596 11.340 1.00 0.00 H new ATOM 0 HG LEU A 28 19.331 -18.373 10.957 1.00 0.00 H new ATOM 0 HD11 LEU A 28 20.331 -19.570 12.937 1.00 0.00 H new ATOM 0 HD12 LEU A 28 21.462 -19.527 11.563 1.00 0.00 H new ATOM 0 HD13 LEU A 28 21.682 -18.411 12.931 1.00 0.00 H new ATOM 0 HD21 LEU A 28 18.672 -17.804 13.259 1.00 0.00 H new ATOM 0 HD22 LEU A 28 19.968 -16.586 13.323 1.00 0.00 H new ATOM 0 HD23 LEU A 28 18.619 -16.390 12.179 1.00 0.00 H new ATOM 441 N ALA A 29 21.087 -14.861 7.964 1.00 0.00 N ATOM 442 CA ALA A 29 21.974 -14.142 7.060 1.00 0.00 C ATOM 443 C ALA A 29 22.094 -12.654 7.410 1.00 0.00 C ATOM 444 O ALA A 29 21.342 -12.115 8.232 1.00 0.00 O ATOM 445 CB ALA A 29 21.519 -14.334 5.612 1.00 0.00 C ATOM 0 H ALA A 29 20.292 -15.279 7.481 1.00 0.00 H new ATOM 0 HA ALA A 29 22.972 -14.565 7.177 1.00 0.00 H new ATOM 0 HB1 ALA A 29 22.189 -13.792 4.945 1.00 0.00 H new ATOM 0 HB2 ALA A 29 21.538 -15.395 5.362 1.00 0.00 H new ATOM 0 HB3 ALA A 29 20.505 -13.952 5.496 1.00 0.00 H new ATOM 451 N ARG A 30 23.068 -11.985 6.793 1.00 0.00 N ATOM 452 CA ARG A 30 23.332 -10.561 6.975 1.00 0.00 C ATOM 453 C ARG A 30 22.204 -9.746 6.342 1.00 0.00 C ATOM 454 O ARG A 30 21.306 -10.292 5.685 1.00 0.00 O ATOM 455 CB ARG A 30 24.711 -10.206 6.398 1.00 0.00 C ATOM 456 CG ARG A 30 24.705 -10.209 4.865 1.00 0.00 C ATOM 457 CD ARG A 30 26.126 -10.202 4.313 1.00 0.00 C ATOM 458 NE ARG A 30 26.096 -10.083 2.853 1.00 0.00 N ATOM 459 CZ ARG A 30 26.016 -11.063 1.950 1.00 0.00 C ATOM 460 NH1 ARG A 30 25.870 -12.334 2.317 1.00 0.00 N ATOM 461 NH2 ARG A 30 26.085 -10.740 0.668 1.00 0.00 N ATOM 0 H ARG A 30 23.710 -12.431 6.137 1.00 0.00 H new ATOM 0 HA ARG A 30 23.357 -10.315 8.037 1.00 0.00 H new ATOM 0 HB2 ARG A 30 25.014 -9.223 6.758 1.00 0.00 H new ATOM 0 HB3 ARG A 30 25.451 -10.920 6.760 1.00 0.00 H new ATOM 0 HG2 ARG A 30 24.174 -11.089 4.502 1.00 0.00 H new ATOM 0 HG3 ARG A 30 24.164 -9.337 4.498 1.00 0.00 H new ATOM 0 HD2 ARG A 30 26.688 -9.372 4.742 1.00 0.00 H new ATOM 0 HD3 ARG A 30 26.641 -11.118 4.601 1.00 0.00 H new ATOM 0 HE ARG A 30 26.142 -9.135 2.481 1.00 0.00 H new ATOM 0 HH11 ARG A 30 25.817 -12.576 3.306 1.00 0.00 H new ATOM 0 HH12 ARG A 30 25.811 -13.066 1.609 1.00 0.00 H new ATOM 0 HH21 ARG A 30 26.196 -9.764 0.393 1.00 0.00 H new ATOM 0 HH22 ARG A 30 26.027 -11.467 -0.045 1.00 0.00 H new ATOM 475 N MET A 31 22.263 -8.428 6.497 1.00 0.00 N ATOM 476 CA MET A 31 21.252 -7.524 5.974 1.00 0.00 C ATOM 477 C MET A 31 21.846 -6.138 5.726 1.00 0.00 C ATOM 478 O MET A 31 23.033 -5.921 5.980 1.00 0.00 O ATOM 479 CB MET A 31 20.113 -7.493 7.006 1.00 0.00 C ATOM 480 CG MET A 31 20.517 -6.815 8.328 1.00 0.00 C ATOM 481 SD MET A 31 19.407 -7.135 9.723 1.00 0.00 S ATOM 482 CE MET A 31 19.952 -8.802 10.175 1.00 0.00 C ATOM 0 H MET A 31 23.020 -7.956 6.993 1.00 0.00 H new ATOM 0 HA MET A 31 20.871 -7.863 5.010 1.00 0.00 H new ATOM 0 HB2 MET A 31 19.259 -6.967 6.580 1.00 0.00 H new ATOM 0 HB3 MET A 31 19.789 -8.513 7.212 1.00 0.00 H new ATOM 0 HG2 MET A 31 21.520 -7.147 8.597 1.00 0.00 H new ATOM 0 HG3 MET A 31 20.571 -5.739 8.165 1.00 0.00 H new ATOM 0 HE1 MET A 31 19.089 -9.400 10.467 1.00 0.00 H new ATOM 0 HE2 MET A 31 20.444 -9.268 9.321 1.00 0.00 H new ATOM 0 HE3 MET A 31 20.651 -8.743 11.009 1.00 0.00 H new ATOM 492 N THR A 32 21.018 -5.217 5.236 1.00 0.00 N ATOM 493 CA THR A 32 21.327 -3.824 4.938 1.00 0.00 C ATOM 494 C THR A 32 20.025 -3.090 4.568 1.00 0.00 C ATOM 495 O THR A 32 19.085 -3.712 4.069 1.00 0.00 O ATOM 496 CB THR A 32 22.354 -3.753 3.787 1.00 0.00 C ATOM 497 OG1 THR A 32 22.844 -2.437 3.670 1.00 0.00 O ATOM 498 CG2 THR A 32 21.817 -4.235 2.434 1.00 0.00 C ATOM 0 H THR A 32 20.046 -5.443 5.023 1.00 0.00 H new ATOM 0 HA THR A 32 21.766 -3.340 5.811 1.00 0.00 H new ATOM 0 HB THR A 32 23.156 -4.442 4.051 1.00 0.00 H new ATOM 0 HG1 THR A 32 23.497 -2.395 2.940 1.00 0.00 H new ATOM 0 HG21 THR A 32 22.601 -4.152 1.681 1.00 0.00 H new ATOM 0 HG22 THR A 32 21.502 -5.275 2.517 1.00 0.00 H new ATOM 0 HG23 THR A 32 20.966 -3.621 2.141 1.00 0.00 H new ATOM 506 N ARG A 33 19.964 -1.769 4.761 1.00 0.00 N ATOM 507 CA ARG A 33 18.833 -0.918 4.434 1.00 0.00 C ATOM 508 C ARG A 33 19.312 0.154 3.473 1.00 0.00 C ATOM 509 O ARG A 33 20.201 0.927 3.824 1.00 0.00 O ATOM 510 CB ARG A 33 18.226 -0.273 5.688 1.00 0.00 C ATOM 511 CG ARG A 33 17.138 -1.154 6.290 1.00 0.00 C ATOM 512 CD ARG A 33 17.606 -2.223 7.262 1.00 0.00 C ATOM 513 NE ARG A 33 18.152 -1.654 8.497 1.00 0.00 N ATOM 514 CZ ARG A 33 18.897 -2.349 9.360 1.00 0.00 C ATOM 515 NH1 ARG A 33 19.081 -3.658 9.196 1.00 0.00 N ATOM 516 NH2 ARG A 33 19.465 -1.721 10.382 1.00 0.00 N ATOM 0 H ARG A 33 20.740 -1.247 5.168 1.00 0.00 H new ATOM 0 HA ARG A 33 18.051 -1.524 3.977 1.00 0.00 H new ATOM 0 HB2 ARG A 33 19.009 -0.101 6.427 1.00 0.00 H new ATOM 0 HB3 ARG A 33 17.809 0.701 5.433 1.00 0.00 H new ATOM 0 HG2 ARG A 33 16.422 -0.512 6.804 1.00 0.00 H new ATOM 0 HG3 ARG A 33 16.602 -1.642 5.476 1.00 0.00 H new ATOM 0 HD2 ARG A 33 16.771 -2.879 7.506 1.00 0.00 H new ATOM 0 HD3 ARG A 33 18.366 -2.839 6.782 1.00 0.00 H new ATOM 0 HE ARG A 33 17.953 -0.676 8.708 1.00 0.00 H new ATOM 0 HH11 ARG A 33 18.651 -4.138 8.406 1.00 0.00 H new ATOM 0 HH12 ARG A 33 19.652 -4.180 9.861 1.00 0.00 H new ATOM 0 HH21 ARG A 33 19.330 -0.717 10.502 1.00 0.00 H new ATOM 0 HH22 ARG A 33 20.036 -2.242 11.047 1.00 0.00 H new ATOM 530 N CYS A 34 18.740 0.160 2.271 1.00 0.00 N ATOM 531 CA CYS A 34 18.987 1.080 1.167 1.00 0.00 C ATOM 532 C CYS A 34 18.080 0.688 -0.008 1.00 0.00 C ATOM 533 O CYS A 34 17.247 1.511 -0.395 1.00 0.00 O ATOM 534 CB CYS A 34 20.469 1.209 0.770 1.00 0.00 C ATOM 535 SG CYS A 34 20.773 2.915 0.238 1.00 0.00 S ATOM 0 H CYS A 34 18.035 -0.535 2.026 1.00 0.00 H new ATOM 0 HA CYS A 34 18.733 2.086 1.501 1.00 0.00 H new ATOM 0 HB2 CYS A 34 21.111 0.955 1.613 1.00 0.00 H new ATOM 0 HB3 CYS A 34 20.708 0.513 -0.034 1.00 0.00 H new ATOM 0 HG CYS A 34 22.021 3.048 -0.100 1.00 0.00 H new ATOM 541 N PRO A 35 18.133 -0.554 -0.540 1.00 0.00 N ATOM 542 CA PRO A 35 17.273 -0.960 -1.648 1.00 0.00 C ATOM 543 C PRO A 35 15.796 -1.000 -1.237 1.00 0.00 C ATOM 544 O PRO A 35 14.930 -1.124 -2.097 1.00 0.00 O ATOM 545 CB PRO A 35 17.792 -2.323 -2.121 1.00 0.00 C ATOM 546 CG PRO A 35 18.474 -2.892 -0.881 1.00 0.00 C ATOM 547 CD PRO A 35 19.040 -1.643 -0.206 1.00 0.00 C ATOM 0 HA PRO A 35 17.313 -0.237 -2.463 1.00 0.00 H new ATOM 0 HB2 PRO A 35 16.980 -2.965 -2.463 1.00 0.00 H new ATOM 0 HB3 PRO A 35 18.490 -2.221 -2.952 1.00 0.00 H new ATOM 0 HG2 PRO A 35 17.769 -3.417 -0.236 1.00 0.00 H new ATOM 0 HG3 PRO A 35 19.259 -3.603 -1.141 1.00 0.00 H new ATOM 0 HD2 PRO A 35 19.104 -1.779 0.874 1.00 0.00 H new ATOM 0 HD3 PRO A 35 20.049 -1.432 -0.561 1.00 0.00 H new ATOM 555 N GLU A 36 15.469 -0.880 0.059 1.00 0.00 N ATOM 556 CA GLU A 36 14.096 -0.876 0.565 1.00 0.00 C ATOM 557 C GLU A 36 13.287 0.262 -0.075 1.00 0.00 C ATOM 558 O GLU A 36 12.061 0.233 -0.053 1.00 0.00 O ATOM 559 CB GLU A 36 14.078 -0.692 2.087 1.00 0.00 C ATOM 560 CG GLU A 36 14.794 -1.795 2.882 1.00 0.00 C ATOM 561 CD GLU A 36 14.347 -1.822 4.347 1.00 0.00 C ATOM 562 OE1 GLU A 36 14.131 -0.729 4.920 1.00 0.00 O ATOM 563 OE2 GLU A 36 14.300 -2.909 4.975 1.00 0.00 O ATOM 0 H GLU A 36 16.168 -0.781 0.795 1.00 0.00 H new ATOM 0 HA GLU A 36 13.649 -1.836 0.307 1.00 0.00 H new ATOM 0 HB2 GLU A 36 14.539 0.266 2.328 1.00 0.00 H new ATOM 0 HB3 GLU A 36 13.041 -0.640 2.420 1.00 0.00 H new ATOM 0 HG2 GLU A 36 14.593 -2.763 2.423 1.00 0.00 H new ATOM 0 HG3 GLU A 36 15.871 -1.637 2.834 1.00 0.00 H new ATOM 570 N GLN A 37 13.964 1.263 -0.645 1.00 0.00 N ATOM 571 CA GLN A 37 13.355 2.401 -1.317 1.00 0.00 C ATOM 572 C GLN A 37 12.372 1.915 -2.392 1.00 0.00 C ATOM 573 O GLN A 37 11.248 2.413 -2.448 1.00 0.00 O ATOM 574 CB GLN A 37 14.491 3.237 -1.918 1.00 0.00 C ATOM 575 CG GLN A 37 14.068 4.497 -2.695 1.00 0.00 C ATOM 576 CD GLN A 37 15.274 5.183 -3.349 1.00 0.00 C ATOM 577 OE1 GLN A 37 16.413 4.724 -3.237 1.00 0.00 O ATOM 578 NE2 GLN A 37 15.075 6.289 -4.040 1.00 0.00 N ATOM 0 H GLN A 37 14.983 1.299 -0.648 1.00 0.00 H new ATOM 0 HA GLN A 37 12.781 3.012 -0.621 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.158 3.540 -1.111 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.069 2.599 -2.587 1.00 0.00 H new ATOM 0 HG2 GLN A 37 13.342 4.227 -3.461 1.00 0.00 H new ATOM 0 HG3 GLN A 37 13.573 5.194 -2.019 1.00 0.00 H new ATOM 0 HE21 GLN A 37 14.133 6.670 -4.133 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.863 6.764 -4.481 1.00 0.00 H new ATOM 587 N GLU A 38 12.770 0.927 -3.206 1.00 0.00 N ATOM 588 CA GLU A 38 11.954 0.365 -4.284 1.00 0.00 C ATOM 589 C GLU A 38 10.617 -0.170 -3.766 1.00 0.00 C ATOM 590 O GLU A 38 9.584 -0.084 -4.428 1.00 0.00 O ATOM 591 CB GLU A 38 12.746 -0.744 -5.020 1.00 0.00 C ATOM 592 CG GLU A 38 12.702 -2.129 -4.337 1.00 0.00 C ATOM 593 CD GLU A 38 13.626 -3.177 -4.961 1.00 0.00 C ATOM 594 OE1 GLU A 38 13.496 -3.419 -6.182 1.00 0.00 O ATOM 595 OE2 GLU A 38 14.377 -3.839 -4.207 1.00 0.00 O ATOM 0 H GLU A 38 13.688 0.489 -3.129 1.00 0.00 H new ATOM 0 HA GLU A 38 11.725 1.165 -4.988 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.354 -0.841 -6.033 1.00 0.00 H new ATOM 0 HB3 GLU A 38 13.786 -0.431 -5.109 1.00 0.00 H new ATOM 0 HG2 GLU A 38 12.967 -2.010 -3.286 1.00 0.00 H new ATOM 0 HG3 GLU A 38 11.678 -2.502 -4.367 1.00 0.00 H new ATOM 602 N LEU A 39 10.647 -0.744 -2.565 1.00 0.00 N ATOM 603 CA LEU A 39 9.518 -1.337 -1.888 1.00 0.00 C ATOM 604 C LEU A 39 8.489 -0.244 -1.611 1.00 0.00 C ATOM 605 O LEU A 39 7.304 -0.428 -1.880 1.00 0.00 O ATOM 606 CB LEU A 39 10.065 -2.030 -0.621 1.00 0.00 C ATOM 607 CG LEU A 39 9.278 -3.223 -0.076 1.00 0.00 C ATOM 608 CD1 LEU A 39 7.907 -2.793 0.416 1.00 0.00 C ATOM 609 CD2 LEU A 39 9.165 -4.383 -1.075 1.00 0.00 C ATOM 0 H LEU A 39 11.506 -0.806 -2.019 1.00 0.00 H new ATOM 0 HA LEU A 39 9.003 -2.092 -2.482 1.00 0.00 H new ATOM 0 HB2 LEU A 39 11.081 -2.365 -0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.133 -1.282 0.169 1.00 0.00 H new ATOM 0 HG LEU A 39 9.850 -3.604 0.770 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.369 -3.661 0.798 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.020 -2.057 1.212 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.346 -2.352 -0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.595 -5.196 -0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 39 8.657 -4.039 -1.976 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.162 -4.739 -1.334 1.00 0.00 H new ATOM 621 N ARG A 40 8.942 0.909 -1.108 1.00 0.00 N ATOM 622 CA ARG A 40 8.077 2.042 -0.788 1.00 0.00 C ATOM 623 C ARG A 40 7.370 2.540 -2.042 1.00 0.00 C ATOM 624 O ARG A 40 6.150 2.714 -2.044 1.00 0.00 O ATOM 625 CB ARG A 40 8.880 3.185 -0.137 1.00 0.00 C ATOM 626 CG ARG A 40 9.887 2.771 0.950 1.00 0.00 C ATOM 627 CD ARG A 40 9.304 1.891 2.063 1.00 0.00 C ATOM 628 NE ARG A 40 8.223 2.598 2.763 1.00 0.00 N ATOM 629 CZ ARG A 40 8.338 3.522 3.720 1.00 0.00 C ATOM 630 NH1 ARG A 40 9.451 3.636 4.435 1.00 0.00 N ATOM 631 NH2 ARG A 40 7.317 4.333 3.966 1.00 0.00 N ATOM 0 H ARG A 40 9.928 1.080 -0.911 1.00 0.00 H new ATOM 0 HA ARG A 40 7.328 1.704 -0.072 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.420 3.715 -0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 40 8.176 3.894 0.299 1.00 0.00 H new ATOM 0 HG2 ARG A 40 10.711 2.237 0.478 1.00 0.00 H new ATOM 0 HG3 ARG A 40 10.306 3.671 1.399 1.00 0.00 H new ATOM 0 HD2 ARG A 40 8.924 0.962 1.639 1.00 0.00 H new ATOM 0 HD3 ARG A 40 10.088 1.621 2.770 1.00 0.00 H new ATOM 0 HE ARG A 40 7.272 2.354 2.485 1.00 0.00 H new ATOM 0 HH11 ARG A 40 10.237 3.011 4.257 1.00 0.00 H new ATOM 0 HH12 ARG A 40 9.520 4.348 5.162 1.00 0.00 H new ATOM 0 HH21 ARG A 40 6.456 4.247 3.426 1.00 0.00 H new ATOM 0 HH22 ARG A 40 7.393 5.043 4.695 1.00 0.00 H new ATOM 645 N LEU A 41 8.137 2.754 -3.113 1.00 0.00 N ATOM 646 CA LEU A 41 7.608 3.235 -4.388 1.00 0.00 C ATOM 647 C LEU A 41 6.549 2.266 -4.908 1.00 0.00 C ATOM 648 O LEU A 41 5.523 2.682 -5.455 1.00 0.00 O ATOM 649 CB LEU A 41 8.739 3.436 -5.407 1.00 0.00 C ATOM 650 CG LEU A 41 9.884 4.367 -4.957 1.00 0.00 C ATOM 651 CD1 LEU A 41 10.756 4.764 -6.148 1.00 0.00 C ATOM 652 CD2 LEU A 41 9.397 5.612 -4.204 1.00 0.00 C ATOM 0 H LEU A 41 9.145 2.598 -3.119 1.00 0.00 H new ATOM 0 HA LEU A 41 7.136 4.206 -4.234 1.00 0.00 H new ATOM 0 HB2 LEU A 41 9.162 2.461 -5.651 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.309 3.836 -6.326 1.00 0.00 H new ATOM 0 HG LEU A 41 10.482 3.795 -4.248 1.00 0.00 H new ATOM 0 HD11 LEU A 41 11.557 5.421 -5.809 1.00 0.00 H new ATOM 0 HD12 LEU A 41 11.186 3.869 -6.599 1.00 0.00 H new ATOM 0 HD13 LEU A 41 10.147 5.286 -6.887 1.00 0.00 H new ATOM 0 HD21 LEU A 41 10.254 6.222 -3.917 1.00 0.00 H new ATOM 0 HD22 LEU A 41 8.738 6.193 -4.849 1.00 0.00 H new ATOM 0 HD23 LEU A 41 8.853 5.307 -3.310 1.00 0.00 H new ATOM 664 N GLN A 42 6.773 0.966 -4.719 1.00 0.00 N ATOM 665 CA GLN A 42 5.827 -0.048 -5.135 1.00 0.00 C ATOM 666 C GLN A 42 4.542 0.091 -4.320 1.00 0.00 C ATOM 667 O GLN A 42 3.468 0.011 -4.909 1.00 0.00 O ATOM 668 CB GLN A 42 6.470 -1.439 -5.036 1.00 0.00 C ATOM 669 CG GLN A 42 7.284 -1.725 -6.303 1.00 0.00 C ATOM 670 CD GLN A 42 6.379 -1.927 -7.515 1.00 0.00 C ATOM 671 OE1 GLN A 42 6.256 -1.059 -8.375 1.00 0.00 O ATOM 672 NE2 GLN A 42 5.719 -3.068 -7.620 1.00 0.00 N ATOM 0 H GLN A 42 7.613 0.596 -4.275 1.00 0.00 H new ATOM 0 HA GLN A 42 5.554 0.087 -6.181 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.115 -1.490 -4.159 1.00 0.00 H new ATOM 0 HB3 GLN A 42 5.698 -2.198 -4.909 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.968 -0.897 -6.492 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.895 -2.615 -6.151 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.824 -3.786 -6.903 1.00 0.00 H new ATOM 0 HE22 GLN A 42 5.105 -3.230 -8.418 1.00 0.00 H new ATOM 681 N ARG A 43 4.604 0.324 -3.001 1.00 0.00 N ATOM 682 CA ARG A 43 3.385 0.480 -2.195 1.00 0.00 C ATOM 683 C ARG A 43 2.561 1.676 -2.677 1.00 0.00 C ATOM 684 O ARG A 43 1.332 1.630 -2.597 1.00 0.00 O ATOM 685 CB ARG A 43 3.690 0.589 -0.687 1.00 0.00 C ATOM 686 CG ARG A 43 4.494 -0.571 -0.064 1.00 0.00 C ATOM 687 CD ARG A 43 4.040 -1.928 -0.597 1.00 0.00 C ATOM 688 NE ARG A 43 4.682 -3.077 0.064 1.00 0.00 N ATOM 689 CZ ARG A 43 4.856 -4.260 -0.536 1.00 0.00 C ATOM 690 NH1 ARG A 43 4.215 -4.545 -1.664 1.00 0.00 N ATOM 691 NH2 ARG A 43 5.656 -5.187 -0.032 1.00 0.00 N ATOM 0 H ARG A 43 5.474 0.408 -2.475 1.00 0.00 H new ATOM 0 HA ARG A 43 2.793 -0.424 -2.334 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.238 1.515 -0.515 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.744 0.675 -0.152 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.554 -0.433 -0.277 1.00 0.00 H new ATOM 0 HG3 ARG A 43 4.381 -0.550 1.020 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.960 -2.011 -0.478 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.247 -1.975 -1.666 1.00 0.00 H new ATOM 0 HE ARG A 43 5.009 -2.966 1.024 1.00 0.00 H new ATOM 0 HH11 ARG A 43 3.584 -3.859 -2.079 1.00 0.00 H new ATOM 0 HH12 ARG A 43 4.354 -5.449 -2.115 1.00 0.00 H new ATOM 0 HH21 ARG A 43 6.160 -5.008 0.837 1.00 0.00 H new ATOM 0 HH22 ARG A 43 5.768 -6.080 -0.512 1.00 0.00 H new ATOM 705 N LEU A 44 3.203 2.730 -3.192 1.00 0.00 N ATOM 706 CA LEU A 44 2.488 3.900 -3.693 1.00 0.00 C ATOM 707 C LEU A 44 1.680 3.531 -4.937 1.00 0.00 C ATOM 708 O LEU A 44 0.455 3.619 -4.932 1.00 0.00 O ATOM 709 CB LEU A 44 3.436 5.071 -3.999 1.00 0.00 C ATOM 710 CG LEU A 44 4.116 5.690 -2.766 1.00 0.00 C ATOM 711 CD1 LEU A 44 5.068 6.805 -3.212 1.00 0.00 C ATOM 712 CD2 LEU A 44 3.088 6.257 -1.780 1.00 0.00 C ATOM 0 H LEU A 44 4.218 2.793 -3.271 1.00 0.00 H new ATOM 0 HA LEU A 44 1.809 4.230 -2.907 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.208 4.725 -4.687 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.874 5.849 -4.516 1.00 0.00 H new ATOM 0 HG LEU A 44 4.672 4.903 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 44 5.550 7.243 -2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.827 6.391 -3.876 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.505 7.575 -3.740 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.605 6.686 -0.922 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.499 7.031 -2.273 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.427 5.458 -1.443 1.00 0.00 H new ATOM 724 N GLU A 45 2.343 3.054 -5.990 1.00 0.00 N ATOM 725 CA GLU A 45 1.704 2.689 -7.251 1.00 0.00 C ATOM 726 C GLU A 45 0.816 1.444 -7.151 1.00 0.00 C ATOM 727 O GLU A 45 0.119 1.110 -8.114 1.00 0.00 O ATOM 728 CB GLU A 45 2.756 2.604 -8.367 1.00 0.00 C ATOM 729 CG GLU A 45 3.526 3.926 -8.562 1.00 0.00 C ATOM 730 CD GLU A 45 2.611 5.120 -8.860 1.00 0.00 C ATOM 731 OE1 GLU A 45 2.093 5.760 -7.922 1.00 0.00 O ATOM 732 OE2 GLU A 45 2.369 5.433 -10.050 1.00 0.00 O ATOM 0 H GLU A 45 3.353 2.909 -5.990 1.00 0.00 H new ATOM 0 HA GLU A 45 1.005 3.484 -7.511 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.463 1.808 -8.134 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.266 2.332 -9.302 1.00 0.00 H new ATOM 0 HG2 GLU A 45 4.106 4.137 -7.664 1.00 0.00 H new ATOM 0 HG3 GLU A 45 4.236 3.808 -9.380 1.00 0.00 H new ATOM 739 N ARG A 46 0.801 0.760 -6.000 1.00 0.00 N ATOM 740 CA ARG A 46 -0.035 -0.413 -5.769 1.00 0.00 C ATOM 741 C ARG A 46 -1.458 0.008 -5.404 1.00 0.00 C ATOM 742 O ARG A 46 -2.288 -0.877 -5.227 1.00 0.00 O ATOM 743 CB ARG A 46 0.600 -1.366 -4.737 1.00 0.00 C ATOM 744 CG ARG A 46 1.591 -2.331 -5.422 1.00 0.00 C ATOM 745 CD ARG A 46 1.058 -3.754 -5.621 1.00 0.00 C ATOM 746 NE ARG A 46 1.875 -4.765 -4.941 1.00 0.00 N ATOM 747 CZ ARG A 46 2.926 -5.435 -5.421 1.00 0.00 C ATOM 748 NH1 ARG A 46 3.423 -5.231 -6.635 1.00 0.00 N ATOM 749 NH2 ARG A 46 3.490 -6.341 -4.646 1.00 0.00 N ATOM 0 H ARG A 46 1.377 1.013 -5.197 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.101 -0.983 -6.696 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.118 -0.788 -3.972 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.180 -1.936 -4.233 1.00 0.00 H new ATOM 0 HG2 ARG A 46 1.866 -1.920 -6.394 1.00 0.00 H new ATOM 0 HG3 ARG A 46 2.503 -2.378 -4.827 1.00 0.00 H new ATOM 0 HD2 ARG A 46 0.035 -3.810 -5.249 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.022 -3.978 -6.687 1.00 0.00 H new ATOM 0 HE ARG A 46 1.607 -4.984 -3.981 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.000 -4.535 -7.249 1.00 0.00 H new ATOM 0 HH12 ARG A 46 4.228 -5.770 -6.954 1.00 0.00 H new ATOM 0 HH21 ARG A 46 3.122 -6.512 -3.710 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.294 -6.870 -4.982 1.00 0.00 H new ATOM 763 N LEU A 47 -1.779 1.307 -5.318 1.00 0.00 N ATOM 764 CA LEU A 47 -3.128 1.799 -5.016 1.00 0.00 C ATOM 765 C LEU A 47 -4.165 1.086 -5.914 1.00 0.00 C ATOM 766 O LEU A 47 -5.033 0.380 -5.389 1.00 0.00 O ATOM 767 CB LEU A 47 -3.210 3.332 -5.194 1.00 0.00 C ATOM 768 CG LEU A 47 -2.706 4.208 -4.043 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.675 5.675 -4.501 1.00 0.00 C ATOM 770 CD2 LEU A 47 -3.621 4.074 -2.834 1.00 0.00 C ATOM 0 H LEU A 47 -1.099 2.054 -5.458 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.354 1.573 -3.974 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.647 3.597 -6.089 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.251 3.593 -5.384 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.704 3.884 -3.762 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.317 6.303 -3.685 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.007 5.775 -5.356 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.679 5.988 -4.786 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.249 4.703 -2.025 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.629 4.389 -3.104 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -3.641 3.035 -2.506 1.00 0.00 H new ATOM 782 N PRO A 48 -4.087 1.192 -7.258 1.00 0.00 N ATOM 783 CA PRO A 48 -5.044 0.517 -8.133 1.00 0.00 C ATOM 784 C PRO A 48 -4.924 -1.009 -8.046 1.00 0.00 C ATOM 785 O PRO A 48 -5.907 -1.712 -8.281 1.00 0.00 O ATOM 786 CB PRO A 48 -4.756 1.022 -9.550 1.00 0.00 C ATOM 787 CG PRO A 48 -3.292 1.449 -9.477 1.00 0.00 C ATOM 788 CD PRO A 48 -3.149 1.975 -8.057 1.00 0.00 C ATOM 0 HA PRO A 48 -6.067 0.743 -7.833 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -4.911 0.242 -10.295 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.405 1.855 -9.821 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.619 0.612 -9.665 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.060 2.217 -10.215 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.128 1.855 -7.694 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.382 3.039 -8.007 1.00 0.00 H new ATOM 796 N GLU A 49 -3.737 -1.528 -7.720 1.00 0.00 N ATOM 797 CA GLU A 49 -3.480 -2.953 -7.586 1.00 0.00 C ATOM 798 C GLU A 49 -4.356 -3.514 -6.461 1.00 0.00 C ATOM 799 O GLU A 49 -4.999 -4.550 -6.636 1.00 0.00 O ATOM 800 CB GLU A 49 -1.982 -3.193 -7.309 1.00 0.00 C ATOM 801 CG GLU A 49 -1.495 -4.543 -7.852 1.00 0.00 C ATOM 802 CD GLU A 49 -0.488 -4.373 -8.991 1.00 0.00 C ATOM 803 OE1 GLU A 49 -0.774 -3.611 -9.945 1.00 0.00 O ATOM 804 OE2 GLU A 49 0.583 -5.021 -8.925 1.00 0.00 O ATOM 0 H GLU A 49 -2.915 -0.952 -7.539 1.00 0.00 H new ATOM 0 HA GLU A 49 -3.731 -3.470 -8.512 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.399 -2.391 -7.761 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -1.803 -3.151 -6.235 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.036 -5.114 -7.045 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.349 -5.121 -8.206 1.00 0.00 H new ATOM 811 N LEU A 50 -4.398 -2.814 -5.321 1.00 0.00 N ATOM 812 CA LEU A 50 -5.186 -3.193 -4.155 1.00 0.00 C ATOM 813 C LEU A 50 -6.664 -3.144 -4.498 1.00 0.00 C ATOM 814 O LEU A 50 -7.383 -4.072 -4.137 1.00 0.00 O ATOM 815 CB LEU A 50 -4.885 -2.282 -2.946 1.00 0.00 C ATOM 816 CG LEU A 50 -3.948 -2.916 -1.904 1.00 0.00 C ATOM 817 CD1 LEU A 50 -4.566 -4.170 -1.261 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.575 -3.237 -2.511 1.00 0.00 C ATOM 0 H LEU A 50 -3.872 -1.951 -5.186 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.912 -4.210 -3.875 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.438 -1.355 -3.305 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -5.824 -2.017 -2.461 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.808 -2.178 -1.114 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.871 -4.585 -0.532 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.497 -3.902 -0.762 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.768 -4.913 -2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.936 -3.684 -1.749 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.697 -3.936 -3.338 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.115 -2.319 -2.877 1.00 0.00 H new ATOM 830 N ALA A 51 -7.110 -2.109 -5.223 1.00 0.00 N ATOM 831 CA ALA A 51 -8.513 -1.982 -5.618 1.00 0.00 C ATOM 832 C ALA A 51 -8.977 -3.255 -6.341 1.00 0.00 C ATOM 833 O ALA A 51 -10.032 -3.811 -6.027 1.00 0.00 O ATOM 834 CB ALA A 51 -8.696 -0.754 -6.516 1.00 0.00 C ATOM 0 H ALA A 51 -6.514 -1.347 -5.547 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.123 -1.852 -4.724 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.743 -0.668 -6.805 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.394 0.142 -5.973 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.081 -0.862 -7.409 1.00 0.00 H new ATOM 840 N ARG A 52 -8.173 -3.723 -7.304 1.00 0.00 N ATOM 841 CA ARG A 52 -8.467 -4.927 -8.073 1.00 0.00 C ATOM 842 C ARG A 52 -8.534 -6.142 -7.151 1.00 0.00 C ATOM 843 O ARG A 52 -9.527 -6.878 -7.193 1.00 0.00 O ATOM 844 CB ARG A 52 -7.415 -5.134 -9.176 1.00 0.00 C ATOM 845 CG ARG A 52 -7.491 -4.084 -10.293 1.00 0.00 C ATOM 846 CD ARG A 52 -6.528 -4.426 -11.434 1.00 0.00 C ATOM 847 NE ARG A 52 -5.109 -4.311 -11.063 1.00 0.00 N ATOM 848 CZ ARG A 52 -4.122 -5.095 -11.512 1.00 0.00 C ATOM 849 NH1 ARG A 52 -4.362 -6.181 -12.232 1.00 0.00 N ATOM 850 NH2 ARG A 52 -2.859 -4.802 -11.252 1.00 0.00 N ATOM 0 H ARG A 52 -7.298 -3.271 -7.569 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.439 -4.806 -8.551 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.421 -5.108 -8.730 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.544 -6.126 -9.610 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.510 -4.029 -10.676 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.248 -3.101 -9.890 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.725 -5.443 -11.772 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.729 -3.766 -12.278 1.00 0.00 H new ATOM 0 HE ARG A 52 -4.856 -3.571 -10.408 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -5.322 -6.440 -12.459 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.587 -6.758 -12.559 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -2.630 -3.972 -10.705 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -2.114 -5.406 -11.599 1.00 0.00 H new ATOM 864 N VAL A 53 -7.516 -6.369 -6.317 1.00 0.00 N ATOM 865 CA VAL A 53 -7.509 -7.519 -5.416 1.00 0.00 C ATOM 866 C VAL A 53 -8.728 -7.481 -4.498 1.00 0.00 C ATOM 867 O VAL A 53 -9.407 -8.500 -4.408 1.00 0.00 O ATOM 868 CB VAL A 53 -6.184 -7.614 -4.632 1.00 0.00 C ATOM 869 CG1 VAL A 53 -6.218 -8.758 -3.606 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.010 -7.871 -5.587 1.00 0.00 C ATOM 0 H VAL A 53 -6.691 -5.774 -6.249 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.576 -8.428 -6.013 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.054 -6.664 -4.114 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.269 -8.796 -3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.027 -8.586 -2.896 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.382 -9.704 -4.121 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.084 -7.935 -5.016 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.173 -8.808 -6.120 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -4.938 -7.053 -6.304 1.00 0.00 H new ATOM 880 N LEU A 54 -9.032 -6.352 -3.849 1.00 0.00 N ATOM 881 CA LEU A 54 -10.168 -6.186 -2.941 1.00 0.00 C ATOM 882 C LEU A 54 -11.452 -6.688 -3.603 1.00 0.00 C ATOM 883 O LEU A 54 -12.165 -7.510 -3.018 1.00 0.00 O ATOM 884 CB LEU A 54 -10.244 -4.719 -2.483 1.00 0.00 C ATOM 885 CG LEU A 54 -11.538 -4.331 -1.743 1.00 0.00 C ATOM 886 CD1 LEU A 54 -11.877 -5.243 -0.561 1.00 0.00 C ATOM 887 CD2 LEU A 54 -11.399 -2.903 -1.214 1.00 0.00 C ATOM 0 H LEU A 54 -8.475 -5.503 -3.945 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.034 -6.793 -2.045 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -9.395 -4.514 -1.830 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.137 -4.076 -3.357 1.00 0.00 H new ATOM 0 HG LEU A 54 -12.345 -4.429 -2.469 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -12.801 -4.904 -0.093 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -12.004 -6.266 -0.915 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -11.068 -5.210 0.168 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -12.311 -2.619 -0.688 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -10.553 -2.850 -0.528 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -11.234 -2.221 -2.048 1.00 0.00 H new ATOM 899 N ARG A 55 -11.734 -6.245 -4.834 1.00 0.00 N ATOM 900 CA ARG A 55 -12.921 -6.691 -5.564 1.00 0.00 C ATOM 901 C ARG A 55 -12.924 -8.220 -5.637 1.00 0.00 C ATOM 902 O ARG A 55 -13.956 -8.839 -5.379 1.00 0.00 O ATOM 903 CB ARG A 55 -12.945 -6.045 -6.962 1.00 0.00 C ATOM 904 CG ARG A 55 -14.189 -6.445 -7.769 1.00 0.00 C ATOM 905 CD ARG A 55 -14.179 -5.868 -9.185 1.00 0.00 C ATOM 906 NE ARG A 55 -15.415 -6.250 -9.885 1.00 0.00 N ATOM 907 CZ ARG A 55 -15.586 -6.414 -11.201 1.00 0.00 C ATOM 908 NH1 ARG A 55 -14.606 -6.172 -12.063 1.00 0.00 N ATOM 909 NH2 ARG A 55 -16.769 -6.828 -11.640 1.00 0.00 N ATOM 0 H ARG A 55 -11.155 -5.578 -5.343 1.00 0.00 H new ATOM 0 HA ARG A 55 -13.826 -6.378 -5.044 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -12.915 -4.960 -6.859 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.050 -6.338 -7.510 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -14.249 -7.532 -7.824 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.082 -6.103 -7.247 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.093 -4.782 -9.145 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -13.311 -6.236 -9.732 1.00 0.00 H new ATOM 0 HE ARG A 55 -16.235 -6.408 -9.300 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -13.698 -5.853 -11.726 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -14.761 -6.305 -13.062 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -17.522 -7.013 -10.978 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -16.924 -6.961 -12.639 1.00 0.00 H new ATOM 923 N ASN A 56 -11.788 -8.833 -5.987 1.00 0.00 N ATOM 924 CA ASN A 56 -11.638 -10.274 -6.095 1.00 0.00 C ATOM 925 C ASN A 56 -11.955 -10.962 -4.754 1.00 0.00 C ATOM 926 O ASN A 56 -12.652 -11.978 -4.746 1.00 0.00 O ATOM 927 CB ASN A 56 -10.233 -10.592 -6.650 1.00 0.00 C ATOM 928 CG ASN A 56 -9.534 -11.687 -5.867 1.00 0.00 C ATOM 929 OD1 ASN A 56 -9.709 -12.870 -6.135 1.00 0.00 O ATOM 930 ND2 ASN A 56 -8.785 -11.297 -4.854 1.00 0.00 N ATOM 0 H ASN A 56 -10.933 -8.323 -6.206 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.362 -10.682 -6.800 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.318 -10.894 -7.694 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -9.624 -9.688 -6.628 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.327 -11.990 -4.262 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -8.663 -10.302 -4.663 1.00 0.00 H new ATOM 937 N VAL A 57 -11.506 -10.403 -3.622 1.00 0.00 N ATOM 938 CA VAL A 57 -11.743 -10.976 -2.299 1.00 0.00 C ATOM 939 C VAL A 57 -13.250 -11.073 -2.037 1.00 0.00 C ATOM 940 O VAL A 57 -13.747 -12.169 -1.753 1.00 0.00 O ATOM 941 CB VAL A 57 -11.000 -10.191 -1.188 1.00 0.00 C ATOM 942 CG1 VAL A 57 -11.137 -10.904 0.162 1.00 0.00 C ATOM 943 CG2 VAL A 57 -9.499 -10.039 -1.465 1.00 0.00 C ATOM 0 H VAL A 57 -10.967 -9.537 -3.603 1.00 0.00 H new ATOM 0 HA VAL A 57 -11.330 -11.985 -2.278 1.00 0.00 H new ATOM 0 HB VAL A 57 -11.463 -9.205 -1.169 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -10.608 -10.337 0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.191 -10.979 0.428 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -10.709 -11.904 0.091 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.034 -9.481 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.041 -11.025 -1.537 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.355 -9.503 -2.403 1.00 0.00 H new ATOM 953 N PHE A 58 -13.984 -9.960 -2.151 1.00 0.00 N ATOM 954 CA PHE A 58 -15.428 -9.946 -1.915 1.00 0.00 C ATOM 955 C PHE A 58 -16.163 -10.856 -2.901 1.00 0.00 C ATOM 956 O PHE A 58 -17.131 -11.514 -2.517 1.00 0.00 O ATOM 957 CB PHE A 58 -15.977 -8.516 -1.961 1.00 0.00 C ATOM 958 CG PHE A 58 -15.970 -7.795 -0.626 1.00 0.00 C ATOM 959 CD1 PHE A 58 -14.757 -7.434 -0.013 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.187 -7.439 -0.015 1.00 0.00 C ATOM 961 CE1 PHE A 58 -14.764 -6.699 1.185 1.00 0.00 C ATOM 962 CE2 PHE A 58 -17.193 -6.684 1.171 1.00 0.00 C ATOM 963 CZ PHE A 58 -15.981 -6.320 1.777 1.00 0.00 C ATOM 0 H PHE A 58 -13.596 -9.052 -2.407 1.00 0.00 H new ATOM 0 HA PHE A 58 -15.605 -10.340 -0.914 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.390 -7.938 -2.675 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -16.999 -8.545 -2.338 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -13.819 -7.722 -0.463 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.122 -7.748 -0.460 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -13.830 -6.424 1.653 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.130 -6.384 1.616 1.00 0.00 H new ATOM 0 HZ PHE A 58 -15.983 -5.751 2.695 1.00 0.00 H new ATOM 973 N VAL A 59 -15.730 -10.921 -4.165 1.00 0.00 N ATOM 974 CA VAL A 59 -16.382 -11.798 -5.142 1.00 0.00 C ATOM 975 C VAL A 59 -16.260 -13.262 -4.665 1.00 0.00 C ATOM 976 O VAL A 59 -17.247 -14.004 -4.741 1.00 0.00 O ATOM 977 CB VAL A 59 -15.825 -11.553 -6.566 1.00 0.00 C ATOM 978 CG1 VAL A 59 -16.269 -12.624 -7.575 1.00 0.00 C ATOM 979 CG2 VAL A 59 -16.277 -10.203 -7.149 1.00 0.00 C ATOM 0 H VAL A 59 -14.943 -10.385 -4.531 1.00 0.00 H new ATOM 0 HA VAL A 59 -17.445 -11.568 -5.209 1.00 0.00 H new ATOM 0 HB VAL A 59 -14.743 -11.579 -6.433 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.847 -12.398 -8.554 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -15.918 -13.602 -7.246 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -17.357 -12.632 -7.642 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -15.859 -10.080 -8.148 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -17.365 -10.177 -7.205 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -15.927 -9.394 -6.508 1.00 0.00 H new ATOM 989 N SER A 60 -15.105 -13.683 -4.127 1.00 0.00 N ATOM 990 CA SER A 60 -14.922 -15.059 -3.662 1.00 0.00 C ATOM 991 C SER A 60 -15.697 -15.322 -2.371 1.00 0.00 C ATOM 992 O SER A 60 -16.011 -16.474 -2.080 1.00 0.00 O ATOM 993 CB SER A 60 -13.436 -15.411 -3.512 1.00 0.00 C ATOM 994 OG SER A 60 -13.245 -16.819 -3.578 1.00 0.00 O ATOM 0 H SER A 60 -14.286 -13.087 -4.005 1.00 0.00 H new ATOM 0 HA SER A 60 -15.334 -15.718 -4.426 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.860 -14.923 -4.299 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.061 -15.032 -2.561 1.00 0.00 H new ATOM 0 HG SER A 60 -12.292 -17.025 -3.482 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.040 -14.286 -1.600 1.00 0.00 N ATOM 1001 CA GLU A 61 -16.807 -14.429 -0.364 1.00 0.00 C ATOM 1002 C GLU A 61 -18.262 -14.791 -0.701 1.00 0.00 C ATOM 1003 O GLU A 61 -19.061 -15.101 0.183 1.00 0.00 O ATOM 1004 CB GLU A 61 -16.766 -13.089 0.386 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.061 -13.143 1.898 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.536 -14.357 2.664 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.309 -14.446 2.892 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -17.382 -15.187 3.072 1.00 0.00 O ATOM 0 H GLU A 61 -15.791 -13.321 -1.819 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.382 -15.219 0.256 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -15.779 -12.648 0.246 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -17.485 -12.415 -0.079 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.644 -12.247 2.357 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.141 -13.098 2.034 1.00 0.00 H new ATOM 1015 N ARG A 62 -18.638 -14.715 -1.987 1.00 0.00 N ATOM 1016 CA ARG A 62 -19.960 -15.006 -2.532 1.00 0.00 C ATOM 1017 C ARG A 62 -21.053 -14.113 -1.933 1.00 0.00 C ATOM 1018 O ARG A 62 -22.233 -14.317 -2.224 1.00 0.00 O ATOM 1019 CB ARG A 62 -20.197 -16.529 -2.448 1.00 0.00 C ATOM 1020 CG ARG A 62 -21.366 -17.082 -3.283 1.00 0.00 C ATOM 1021 CD ARG A 62 -21.221 -18.605 -3.365 1.00 0.00 C ATOM 1022 NE ARG A 62 -22.390 -19.270 -3.965 1.00 0.00 N ATOM 1023 CZ ARG A 62 -22.536 -20.597 -4.096 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -21.539 -21.432 -3.807 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -23.703 -21.072 -4.517 1.00 0.00 N ATOM 0 H ARG A 62 -17.981 -14.430 -2.714 1.00 0.00 H new ATOM 0 HA ARG A 62 -20.011 -14.742 -3.588 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -19.284 -17.036 -2.760 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.367 -16.792 -1.404 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -22.319 -16.815 -2.825 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -21.359 -16.646 -4.282 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -20.334 -18.848 -3.950 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -21.060 -19.002 -2.363 1.00 0.00 H new ATOM 0 HE ARG A 62 -23.146 -18.677 -4.307 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -20.645 -21.065 -3.480 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -21.669 -22.438 -3.913 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -24.466 -20.431 -4.734 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -23.836 -22.078 -4.624 1.00 0.00 H new ATOM 1039 N LYS A 63 -20.725 -13.092 -1.135 1.00 0.00 N ATOM 1040 CA LYS A 63 -21.677 -12.174 -0.517 1.00 0.00 C ATOM 1041 C LYS A 63 -21.118 -10.760 -0.563 1.00 0.00 C ATOM 1042 O LYS A 63 -19.928 -10.585 -0.326 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.081 -12.652 0.893 1.00 0.00 C ATOM 1044 CG LYS A 63 -20.900 -12.579 1.859 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.087 -13.156 3.258 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.281 -14.662 3.209 1.00 0.00 C ATOM 1047 NZ LYS A 63 -20.080 -15.403 2.756 1.00 0.00 N ATOM 0 H LYS A 63 -19.757 -12.878 -0.896 1.00 0.00 H new ATOM 0 HA LYS A 63 -22.608 -12.163 -1.083 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -22.900 -12.038 1.268 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -22.449 -13.677 0.841 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.057 -13.091 1.396 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.618 -11.531 1.964 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.218 -12.918 3.872 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -21.950 -12.691 3.734 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -21.563 -15.016 4.201 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.112 -14.891 2.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -20.188 -16.412 2.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -19.970 -15.290 1.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -19.238 -15.028 3.238 1.00 0.00 H new ATOM 1061 N PRO A 64 -21.945 -9.751 -0.886 1.00 0.00 N ATOM 1062 CA PRO A 64 -21.481 -8.378 -0.928 1.00 0.00 C ATOM 1063 C PRO A 64 -21.424 -7.778 0.482 1.00 0.00 C ATOM 1064 O PRO A 64 -20.876 -6.691 0.623 1.00 0.00 O ATOM 1065 CB PRO A 64 -22.526 -7.638 -1.768 1.00 0.00 C ATOM 1066 CG PRO A 64 -23.821 -8.354 -1.389 1.00 0.00 C ATOM 1067 CD PRO A 64 -23.371 -9.807 -1.204 1.00 0.00 C ATOM 0 HA PRO A 64 -20.476 -8.303 -1.344 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -22.564 -6.576 -1.526 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -22.317 -7.714 -2.835 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.255 -7.947 -0.476 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -24.576 -8.262 -2.169 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -23.931 -10.290 -0.403 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -23.546 -10.388 -2.110 1.00 0.00 H new ATOM 1075 N ALA A 65 -21.992 -8.440 1.506 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.007 -7.922 2.874 1.00 0.00 C ATOM 1077 C ALA A 65 -21.198 -8.831 3.786 1.00 0.00 C ATOM 1078 O ALA A 65 -21.541 -10.009 3.924 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.446 -7.782 3.381 1.00 0.00 C ATOM 0 H ALA A 65 -22.450 -9.345 1.403 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.550 -6.932 2.879 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.437 -7.395 4.400 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -23.993 -7.094 2.737 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -23.933 -8.757 3.367 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.141 -8.302 4.399 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.238 -9.028 5.287 1.00 0.00 C ATOM 1087 C LEU A 66 -19.226 -8.381 6.663 1.00 0.00 C ATOM 1088 O LEU A 66 -19.468 -7.179 6.783 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.798 -8.946 4.743 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.425 -9.929 3.621 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -18.295 -9.793 2.367 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -15.959 -9.689 3.256 1.00 0.00 C ATOM 0 H LEU A 66 -19.882 -7.322 4.287 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.580 -10.061 5.347 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.630 -7.933 4.377 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.111 -9.103 5.575 1.00 0.00 H new ATOM 0 HG LEU A 66 -17.594 -10.939 3.995 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -17.973 -10.518 1.620 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.338 -9.978 2.626 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -18.194 -8.786 1.962 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.665 -10.374 2.460 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.832 -8.661 2.915 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.333 -9.861 4.132 1.00 0.00 H new ATOM 1104 N THR A 67 -18.963 -9.171 7.698 1.00 0.00 N ATOM 1105 CA THR A 67 -18.869 -8.659 9.060 1.00 0.00 C ATOM 1106 C THR A 67 -17.517 -7.935 9.145 1.00 0.00 C ATOM 1107 O THR A 67 -16.599 -8.255 8.385 1.00 0.00 O ATOM 1108 CB THR A 67 -18.975 -9.810 10.079 1.00 0.00 C ATOM 1109 OG1 THR A 67 -19.962 -10.754 9.700 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.366 -9.287 11.464 1.00 0.00 C ATOM 0 H THR A 67 -18.810 -10.176 7.618 1.00 0.00 H new ATOM 0 HA THR A 67 -19.684 -7.975 9.297 1.00 0.00 H new ATOM 0 HB THR A 67 -17.992 -10.280 10.106 1.00 0.00 H new ATOM 0 HG1 THR A 67 -20.803 -10.289 9.507 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.433 -10.121 12.162 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.612 -8.582 11.813 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.332 -8.785 11.404 1.00 0.00 H new ATOM 1118 N MET A 68 -17.375 -6.980 10.065 1.00 0.00 N ATOM 1119 CA MET A 68 -16.143 -6.225 10.259 1.00 0.00 C ATOM 1120 C MET A 68 -14.972 -7.180 10.478 1.00 0.00 C ATOM 1121 O MET A 68 -13.941 -7.034 9.829 1.00 0.00 O ATOM 1122 CB MET A 68 -16.337 -5.267 11.445 1.00 0.00 C ATOM 1123 CG MET A 68 -15.194 -4.262 11.636 1.00 0.00 C ATOM 1124 SD MET A 68 -15.618 -2.561 11.172 1.00 0.00 S ATOM 1125 CE MET A 68 -16.001 -2.793 9.419 1.00 0.00 C ATOM 0 H MET A 68 -18.123 -6.708 10.703 1.00 0.00 H new ATOM 0 HA MET A 68 -15.911 -5.635 9.372 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.268 -4.718 11.306 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.446 -5.854 12.357 1.00 0.00 H new ATOM 0 HG2 MET A 68 -14.884 -4.275 12.681 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.337 -4.586 11.045 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.196 -1.825 8.958 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.155 -3.268 8.922 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.882 -3.427 9.320 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.150 -8.184 11.340 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.089 -9.142 11.616 1.00 0.00 C ATOM 1137 C GLU A 69 -13.766 -9.990 10.386 1.00 0.00 C ATOM 1138 O GLU A 69 -12.599 -10.274 10.136 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.484 -10.038 12.791 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.353 -11.012 13.124 1.00 0.00 C ATOM 1141 CD GLU A 69 -13.682 -11.843 14.351 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -13.458 -11.331 15.472 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -14.124 -13.007 14.174 1.00 0.00 O ATOM 0 H GLU A 69 -16.015 -8.350 11.854 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.191 -8.583 11.878 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -14.713 -9.425 13.663 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.389 -10.593 12.545 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.175 -11.670 12.274 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.431 -10.457 13.295 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.781 -10.394 9.619 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.605 -11.217 8.430 1.00 0.00 C ATOM 1152 C VAL A 70 -13.665 -10.511 7.454 1.00 0.00 C ATOM 1153 O VAL A 70 -12.642 -11.088 7.098 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.978 -11.599 7.837 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.890 -12.312 6.480 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.725 -12.523 8.813 1.00 0.00 C ATOM 0 H VAL A 70 -15.754 -10.155 9.811 1.00 0.00 H new ATOM 0 HA VAL A 70 -14.125 -12.163 8.681 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.508 -10.659 7.682 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.894 -12.548 6.127 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -15.396 -11.661 5.758 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -15.318 -13.233 6.589 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.694 -12.791 8.391 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -16.139 -13.427 8.979 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.872 -12.007 9.762 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.972 -9.280 7.024 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.109 -8.559 6.084 1.00 0.00 C ATOM 1168 C VAL A 71 -11.724 -8.275 6.697 1.00 0.00 C ATOM 1169 O VAL A 71 -10.720 -8.226 5.985 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.837 -7.300 5.553 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.174 -6.252 6.623 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.057 -6.624 4.418 1.00 0.00 C ATOM 0 H VAL A 71 -14.806 -8.767 7.311 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.909 -9.189 5.217 1.00 0.00 H new ATOM 0 HB VAL A 71 -14.785 -7.687 5.178 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.682 -5.407 6.158 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.825 -6.697 7.376 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.255 -5.907 7.096 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -13.603 -5.745 4.075 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.075 -6.322 4.781 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -12.939 -7.324 3.591 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.666 -8.094 8.015 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.459 -7.807 8.777 1.00 0.00 C ATOM 1184 C CYS A 72 -9.510 -9.005 8.691 1.00 0.00 C ATOM 1185 O CYS A 72 -8.414 -8.865 8.132 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.840 -7.412 10.214 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.413 -6.946 11.231 1.00 0.00 S ATOM 0 H CYS A 72 -12.497 -8.146 8.604 1.00 0.00 H new ATOM 0 HA CYS A 72 -9.921 -6.956 8.359 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.541 -6.578 10.181 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.358 -8.246 10.688 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.817 -6.625 12.424 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.934 -10.162 9.207 1.00 0.00 N ATOM 1194 CA ALA A 73 -9.176 -11.407 9.213 1.00 0.00 C ATOM 1195 C ALA A 73 -8.782 -11.799 7.790 1.00 0.00 C ATOM 1196 O ALA A 73 -7.647 -12.199 7.524 1.00 0.00 O ATOM 1197 CB ALA A 73 -10.014 -12.516 9.856 1.00 0.00 C ATOM 0 H ALA A 73 -10.849 -10.256 9.647 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.265 -11.264 9.794 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.446 -13.446 9.859 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.261 -12.238 10.881 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.933 -12.655 9.286 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.722 -11.647 6.857 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.518 -11.965 5.456 1.00 0.00 C ATOM 1205 C ARG A 74 -8.410 -11.144 4.826 1.00 0.00 C ATOM 1206 O ARG A 74 -7.630 -11.710 4.061 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.824 -11.697 4.695 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.787 -12.896 4.719 1.00 0.00 C ATOM 1209 CD ARG A 74 -11.449 -13.960 3.653 1.00 0.00 C ATOM 1210 NE ARG A 74 -10.374 -14.894 4.042 1.00 0.00 N ATOM 1211 CZ ARG A 74 -10.534 -15.978 4.809 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -11.691 -16.187 5.419 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -9.554 -16.862 4.966 1.00 0.00 N ATOM 0 H ARG A 74 -10.657 -11.294 7.063 1.00 0.00 H new ATOM 0 HA ARG A 74 -9.226 -13.013 5.395 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.321 -10.830 5.130 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.591 -11.445 3.660 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.760 -13.357 5.706 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.805 -12.541 4.560 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.349 -14.533 3.432 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -11.159 -13.454 2.732 1.00 0.00 H new ATOM 0 HE ARG A 74 -9.434 -14.697 3.698 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -12.456 -15.522 5.303 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -11.817 -17.013 6.005 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -8.659 -16.720 4.497 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.697 -17.682 5.555 1.00 0.00 H new ATOM 1227 N MET A 75 -8.363 -9.834 5.057 1.00 0.00 N ATOM 1228 CA MET A 75 -7.342 -8.999 4.441 1.00 0.00 C ATOM 1229 C MET A 75 -5.993 -9.202 5.110 1.00 0.00 C ATOM 1230 O MET A 75 -4.992 -9.239 4.399 1.00 0.00 O ATOM 1231 CB MET A 75 -7.755 -7.517 4.396 1.00 0.00 C ATOM 1232 CG MET A 75 -7.514 -6.911 3.007 1.00 0.00 C ATOM 1233 SD MET A 75 -8.475 -7.606 1.625 1.00 0.00 S ATOM 1234 CE MET A 75 -10.182 -7.376 2.190 1.00 0.00 C ATOM 0 H MET A 75 -9.015 -9.334 5.661 1.00 0.00 H new ATOM 0 HA MET A 75 -7.240 -9.317 3.403 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.809 -7.423 4.658 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.190 -6.957 5.142 1.00 0.00 H new ATOM 0 HG2 MET A 75 -7.724 -5.843 3.062 1.00 0.00 H new ATOM 0 HG3 MET A 75 -6.455 -7.016 2.770 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.870 -7.627 1.382 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.373 -8.026 3.044 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.331 -6.337 2.484 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.940 -9.346 6.442 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.651 -9.546 7.095 1.00 0.00 C ATOM 1246 C VAL A 76 -4.040 -10.867 6.647 1.00 0.00 C ATOM 1247 O VAL A 76 -2.830 -10.936 6.487 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.731 -9.378 8.625 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.478 -10.483 9.367 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.324 -9.216 9.208 1.00 0.00 C ATOM 0 H VAL A 76 -6.747 -9.328 7.065 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.971 -8.756 6.776 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.326 -8.478 8.781 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.476 -10.269 10.436 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.506 -10.531 9.008 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.986 -11.439 9.187 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.390 -9.098 10.290 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.730 -10.099 8.975 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.850 -8.335 8.775 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.852 -11.881 6.334 1.00 0.00 N ATOM 1261 CA ASP A 77 -4.287 -13.164 5.892 1.00 0.00 C ATOM 1262 C ASP A 77 -3.452 -13.000 4.613 1.00 0.00 C ATOM 1263 O ASP A 77 -2.498 -13.740 4.364 1.00 0.00 O ATOM 1264 CB ASP A 77 -5.392 -14.186 5.623 1.00 0.00 C ATOM 1265 CG ASP A 77 -4.866 -15.614 5.751 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -4.216 -16.139 4.815 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -5.100 -16.219 6.826 1.00 0.00 O ATOM 0 H ASP A 77 -5.871 -11.846 6.375 1.00 0.00 H new ATOM 0 HA ASP A 77 -3.645 -13.519 6.698 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.211 -14.033 6.325 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.797 -14.033 4.623 1.00 0.00 H new ATOM 1272 N SER A 78 -3.806 -12.031 3.764 1.00 0.00 N ATOM 1273 CA SER A 78 -3.113 -11.765 2.513 1.00 0.00 C ATOM 1274 C SER A 78 -1.756 -11.090 2.734 1.00 0.00 C ATOM 1275 O SER A 78 -1.052 -10.843 1.750 1.00 0.00 O ATOM 1276 CB SER A 78 -4.014 -10.932 1.594 1.00 0.00 C ATOM 1277 OG SER A 78 -5.266 -11.579 1.417 1.00 0.00 O ATOM 0 H SER A 78 -4.593 -11.405 3.934 1.00 0.00 H new ATOM 0 HA SER A 78 -2.901 -12.719 2.031 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.166 -9.941 2.022 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.529 -10.791 0.628 1.00 0.00 H new ATOM 0 HG SER A 78 -5.834 -11.038 0.830 1.00 0.00 H new ATOM 1283 N CYS A 79 -1.358 -10.797 3.980 1.00 0.00 N ATOM 1284 CA CYS A 79 -0.086 -10.163 4.279 1.00 0.00 C ATOM 1285 C CYS A 79 1.112 -11.077 4.060 1.00 0.00 C ATOM 1286 O CYS A 79 2.235 -10.575 4.145 1.00 0.00 O ATOM 1287 CB CYS A 79 -0.057 -9.641 5.718 1.00 0.00 C ATOM 1288 SG CYS A 79 0.231 -10.962 6.935 1.00 0.00 S ATOM 0 H CYS A 79 -1.920 -10.998 4.807 1.00 0.00 H new ATOM 0 HA CYS A 79 -0.002 -9.334 3.576 1.00 0.00 H new ATOM 0 HB2 CYS A 79 0.726 -8.888 5.812 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -1.003 -9.147 5.941 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.902 -11.519 7.248 1.00 0.00 H new ATOM 1294 N GLN A 80 0.898 -12.375 3.800 1.00 0.00 N ATOM 1295 CA GLN A 80 1.939 -13.379 3.580 1.00 0.00 C ATOM 1296 C GLN A 80 2.668 -13.195 2.245 1.00 0.00 C ATOM 1297 O GLN A 80 2.657 -14.056 1.362 1.00 0.00 O ATOM 1298 CB GLN A 80 1.354 -14.789 3.754 1.00 0.00 C ATOM 1299 CG GLN A 80 0.890 -15.046 5.194 1.00 0.00 C ATOM 1300 CD GLN A 80 1.992 -14.806 6.220 1.00 0.00 C ATOM 1301 OE1 GLN A 80 3.039 -15.450 6.189 1.00 0.00 O ATOM 1302 NE2 GLN A 80 1.812 -13.849 7.112 1.00 0.00 N ATOM 0 H GLN A 80 -0.042 -12.765 3.736 1.00 0.00 H new ATOM 0 HA GLN A 80 2.709 -13.240 4.339 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.512 -14.919 3.073 1.00 0.00 H new ATOM 0 HB3 GLN A 80 2.105 -15.529 3.477 1.00 0.00 H new ATOM 0 HG2 GLN A 80 0.043 -14.398 5.419 1.00 0.00 H new ATOM 0 HG3 GLN A 80 0.537 -16.074 5.280 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.938 -13.323 7.126 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.547 -13.636 7.787 1.00 0.00 H new ATOM 1311 N THR A 81 3.295 -12.036 2.119 1.00 0.00 N ATOM 1312 CA THR A 81 4.079 -11.542 1.018 1.00 0.00 C ATOM 1313 C THR A 81 5.262 -10.839 1.699 1.00 0.00 C ATOM 1314 O THR A 81 6.137 -11.553 2.205 1.00 0.00 O ATOM 1315 CB THR A 81 3.192 -10.734 0.042 1.00 0.00 C ATOM 1316 OG1 THR A 81 3.977 -9.952 -0.825 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.157 -9.830 0.724 1.00 0.00 C ATOM 0 H THR A 81 3.257 -11.350 2.873 1.00 0.00 H new ATOM 0 HA THR A 81 4.488 -12.291 0.339 1.00 0.00 H new ATOM 0 HB THR A 81 2.638 -11.489 -0.515 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.393 -9.452 -1.433 1.00 0.00 H new ATOM 0 HG21 THR A 81 1.580 -9.301 -0.034 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.487 -10.438 1.332 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.668 -9.107 1.360 1.00 0.00 H new ATOM 1325 N ALA A 82 5.284 -9.502 1.812 1.00 0.00 N ATOM 1326 CA ALA A 82 6.376 -8.749 2.434 1.00 0.00 C ATOM 1327 C ALA A 82 5.963 -7.307 2.794 1.00 0.00 C ATOM 1328 O ALA A 82 6.615 -6.346 2.376 1.00 0.00 O ATOM 1329 CB ALA A 82 7.589 -8.773 1.489 1.00 0.00 C ATOM 0 H ALA A 82 4.530 -8.908 1.467 1.00 0.00 H new ATOM 0 HA ALA A 82 6.639 -9.224 3.379 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.411 -8.216 1.938 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.899 -9.804 1.321 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.318 -8.316 0.537 1.00 0.00 H new ATOM 1335 N LEU A 83 4.816 -7.149 3.462 1.00 0.00 N ATOM 1336 CA LEU A 83 4.239 -5.876 3.916 1.00 0.00 C ATOM 1337 C LEU A 83 3.609 -6.024 5.307 1.00 0.00 C ATOM 1338 O LEU A 83 3.339 -7.143 5.756 1.00 0.00 O ATOM 1339 CB LEU A 83 3.236 -5.318 2.885 1.00 0.00 C ATOM 1340 CG LEU A 83 2.299 -6.350 2.234 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.241 -6.858 3.200 1.00 0.00 C ATOM 1342 CD2 LEU A 83 1.607 -5.750 1.025 1.00 0.00 C ATOM 0 H LEU A 83 4.233 -7.947 3.715 1.00 0.00 H new ATOM 0 HA LEU A 83 5.047 -5.149 4.001 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.625 -4.559 3.375 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.796 -4.816 2.096 1.00 0.00 H new ATOM 0 HG LEU A 83 2.923 -7.191 1.933 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.604 -7.584 2.694 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.725 -7.333 4.053 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.633 -6.022 3.547 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.948 -6.494 0.577 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.021 -4.885 1.334 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.354 -5.440 0.295 1.00 0.00 H new ATOM 1354 N SER A 84 3.319 -4.907 5.972 1.00 0.00 N ATOM 1355 CA SER A 84 2.727 -4.864 7.305 1.00 0.00 C ATOM 1356 C SER A 84 1.203 -4.694 7.259 1.00 0.00 C ATOM 1357 O SER A 84 0.671 -4.152 6.283 1.00 0.00 O ATOM 1358 CB SER A 84 3.367 -3.706 8.071 1.00 0.00 C ATOM 1359 OG SER A 84 4.728 -3.998 8.324 1.00 0.00 O ATOM 0 H SER A 84 3.495 -3.980 5.585 1.00 0.00 H new ATOM 0 HA SER A 84 2.918 -5.813 7.806 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.284 -2.785 7.494 1.00 0.00 H new ATOM 0 HB3 SER A 84 2.839 -3.542 9.011 1.00 0.00 H new ATOM 0 HG SER A 84 5.137 -3.254 8.813 1.00 0.00 H new ATOM 1365 N PRO A 85 0.477 -5.098 8.317 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.978 -4.987 8.381 1.00 0.00 C ATOM 1367 C PRO A 85 -1.436 -3.527 8.482 1.00 0.00 C ATOM 1368 O PRO A 85 -2.547 -3.202 8.048 1.00 0.00 O ATOM 1369 CB PRO A 85 -1.376 -5.884 9.554 1.00 0.00 C ATOM 1370 CG PRO A 85 -0.184 -5.792 10.498 1.00 0.00 C ATOM 1371 CD PRO A 85 0.986 -5.743 9.521 1.00 0.00 C ATOM 0 HA PRO A 85 -1.481 -5.320 7.473 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -2.293 -5.537 10.031 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -1.553 -6.910 9.232 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -0.229 -4.903 11.127 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -0.124 -6.652 11.165 1.00 0.00 H new ATOM 0 HD2 PRO A 85 1.821 -5.182 9.940 1.00 0.00 H new ATOM 0 HD3 PRO A 85 1.353 -6.746 9.301 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.576 -2.622 8.966 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.910 -1.212 9.080 1.00 0.00 C ATOM 1381 C GLY A 86 -1.243 -0.621 7.707 1.00 0.00 C ATOM 1382 O GLY A 86 -2.172 0.181 7.601 1.00 0.00 O ATOM 0 H GLY A 86 0.365 -2.853 9.286 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.760 -1.088 9.751 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.074 -0.670 9.522 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.512 -1.016 6.656 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.730 -0.521 5.299 1.00 0.00 C ATOM 1388 C GLU A 87 -2.045 -1.075 4.748 1.00 0.00 C ATOM 1389 O GLU A 87 -2.875 -0.304 4.278 1.00 0.00 O ATOM 1390 CB GLU A 87 0.513 -0.787 4.415 1.00 0.00 C ATOM 1391 CG GLU A 87 0.421 -1.924 3.387 1.00 0.00 C ATOM 1392 CD GLU A 87 1.597 -1.937 2.410 1.00 0.00 C ATOM 1393 OE1 GLU A 87 2.717 -1.565 2.839 1.00 0.00 O ATOM 1394 OE2 GLU A 87 1.381 -2.307 1.231 1.00 0.00 O ATOM 0 H GLU A 87 0.249 -1.691 6.728 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.845 0.563 5.302 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.748 0.133 3.879 1.00 0.00 H new ATOM 0 HB3 GLU A 87 1.356 -0.996 5.074 1.00 0.00 H new ATOM 0 HG2 GLU A 87 0.380 -2.879 3.911 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.509 -1.827 2.827 1.00 0.00 H new ATOM 1401 N MET A 88 -2.273 -2.387 4.877 1.00 0.00 N ATOM 1402 CA MET A 88 -3.474 -3.078 4.414 1.00 0.00 C ATOM 1403 C MET A 88 -4.740 -2.319 4.834 1.00 0.00 C ATOM 1404 O MET A 88 -5.586 -1.976 3.998 1.00 0.00 O ATOM 1405 CB MET A 88 -3.460 -4.505 4.992 1.00 0.00 C ATOM 1406 CG MET A 88 -4.421 -5.475 4.298 1.00 0.00 C ATOM 1407 SD MET A 88 -3.812 -6.244 2.768 1.00 0.00 S ATOM 1408 CE MET A 88 -2.548 -7.381 3.424 1.00 0.00 C ATOM 0 H MET A 88 -1.603 -3.014 5.322 1.00 0.00 H new ATOM 0 HA MET A 88 -3.481 -3.124 3.325 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.448 -4.903 4.922 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.712 -4.458 6.051 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.677 -6.267 5.002 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.343 -4.940 4.070 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.405 -8.207 2.727 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.607 -6.845 3.550 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.875 -7.772 4.388 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.863 -2.056 6.137 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.995 -1.349 6.714 1.00 0.00 C ATOM 1420 C GLU A 89 -6.084 0.062 6.160 1.00 0.00 C ATOM 1421 O GLU A 89 -7.166 0.491 5.757 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.853 -1.336 8.231 1.00 0.00 C ATOM 1423 CG GLU A 89 -6.998 -0.582 8.921 1.00 0.00 C ATOM 1424 CD GLU A 89 -6.885 -0.601 10.444 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -5.752 -0.597 10.975 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -7.943 -0.546 11.112 1.00 0.00 O ATOM 0 H GLU A 89 -4.165 -2.335 6.826 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.919 -1.862 6.448 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -5.824 -2.362 8.599 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.903 -0.874 8.500 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.007 0.451 8.575 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.949 -1.026 8.626 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.963 0.787 6.132 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.944 2.139 5.611 1.00 0.00 C ATOM 1435 C LYS A 90 -5.400 2.173 4.157 1.00 0.00 C ATOM 1436 O LYS A 90 -5.952 3.189 3.748 1.00 0.00 O ATOM 1437 CB LYS A 90 -3.549 2.743 5.775 1.00 0.00 C ATOM 1438 CG LYS A 90 -3.269 3.140 7.236 1.00 0.00 C ATOM 1439 CD LYS A 90 -3.443 4.644 7.467 1.00 0.00 C ATOM 1440 CE LYS A 90 -4.918 5.074 7.490 1.00 0.00 C ATOM 1441 NZ LYS A 90 -5.103 6.507 7.191 1.00 0.00 N ATOM 0 H LYS A 90 -4.060 0.452 6.467 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.648 2.744 6.182 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.800 2.024 5.443 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.455 3.620 5.135 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.942 2.592 7.896 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.253 2.848 7.503 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -2.974 4.919 8.412 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.922 5.191 6.681 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.475 4.482 6.764 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.340 4.855 8.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.118 6.733 7.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.624 7.078 7.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.697 6.722 6.258 1.00 0.00 H new ATOM 1455 N HIS A 91 -5.192 1.104 3.382 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.617 1.083 1.989 1.00 0.00 C ATOM 1457 C HIS A 91 -7.127 0.856 1.934 1.00 0.00 C ATOM 1458 O HIS A 91 -7.781 1.371 1.025 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.836 0.032 1.190 1.00 0.00 C ATOM 1460 CG HIS A 91 -3.513 0.528 0.671 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -3.329 1.333 -0.428 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -2.279 0.197 1.153 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -2.006 1.480 -0.611 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -1.322 0.807 0.332 1.00 0.00 N ATOM 0 H HIS A 91 -4.734 0.249 3.698 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.398 2.043 1.521 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.665 -0.839 1.822 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.445 -0.299 0.349 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -2.077 -0.424 2.013 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -1.555 2.058 -1.404 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -0.308 0.752 0.430 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.687 0.089 2.878 1.00 0.00 N ATOM 1473 CA LEU A 92 -9.126 -0.161 2.921 1.00 0.00 C ATOM 1474 C LEU A 92 -9.867 1.137 3.242 1.00 0.00 C ATOM 1475 O LEU A 92 -10.790 1.499 2.512 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.496 -1.221 3.976 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.947 -2.627 3.696 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -9.124 -3.524 4.922 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.588 -3.265 2.461 1.00 0.00 C ATOM 0 H LEU A 92 -7.160 -0.368 3.622 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.420 -0.537 1.941 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.129 -0.890 4.948 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.582 -1.278 4.048 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.883 -2.523 3.485 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.730 -4.517 4.706 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.586 -3.095 5.767 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -10.183 -3.600 5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.167 -4.258 2.305 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.665 -3.347 2.611 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.390 -2.645 1.587 1.00 0.00 H new ATOM 1491 N VAL A 93 -9.472 1.836 4.316 1.00 0.00 N ATOM 1492 CA VAL A 93 -10.131 3.073 4.719 1.00 0.00 C ATOM 1493 C VAL A 93 -9.916 4.163 3.678 1.00 0.00 C ATOM 1494 O VAL A 93 -10.849 4.908 3.406 1.00 0.00 O ATOM 1495 CB VAL A 93 -9.749 3.460 6.163 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -8.262 3.783 6.329 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -10.590 4.628 6.697 1.00 0.00 C ATOM 0 H VAL A 93 -8.697 1.559 4.918 1.00 0.00 H new ATOM 0 HA VAL A 93 -11.210 2.921 4.750 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.966 2.571 6.755 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.061 4.047 7.367 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.668 2.912 6.054 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.997 4.621 5.684 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -10.282 4.862 7.716 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -10.442 5.503 6.064 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -11.644 4.350 6.691 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.736 4.234 3.055 1.00 0.00 N ATOM 1508 CA LEU A 94 -8.441 5.228 2.032 1.00 0.00 C ATOM 1509 C LEU A 94 -9.457 5.147 0.901 1.00 0.00 C ATOM 1510 O LEU A 94 -10.063 6.148 0.521 1.00 0.00 O ATOM 1511 CB LEU A 94 -7.024 4.978 1.485 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.777 5.575 0.091 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.867 7.105 0.041 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -5.379 5.175 -0.362 1.00 0.00 C ATOM 0 H LEU A 94 -7.961 3.601 3.250 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.497 6.224 2.471 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.298 5.396 2.182 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.845 3.903 1.445 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.562 5.186 -0.558 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.680 7.447 -0.977 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.862 7.421 0.354 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.122 7.535 0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.184 5.590 -1.351 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.644 5.560 0.344 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.307 4.088 -0.404 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.594 3.956 0.321 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.515 3.768 -0.780 1.00 0.00 C ATOM 1528 C LEU A 95 -11.939 4.018 -0.308 1.00 0.00 C ATOM 1529 O LEU A 95 -12.695 4.659 -1.025 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.319 2.379 -1.393 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.502 2.430 -2.700 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -7.995 2.486 -2.424 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.788 1.206 -3.570 1.00 0.00 C ATOM 0 H LEU A 95 -9.081 3.119 0.597 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.312 4.491 -1.570 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.812 1.735 -0.675 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.292 1.931 -1.592 1.00 0.00 H new ATOM 0 HG LEU A 95 -9.805 3.338 -3.222 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.453 2.521 -3.369 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.765 3.377 -1.841 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.694 1.599 -1.866 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -9.200 1.265 -4.486 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -9.520 0.301 -3.025 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.848 1.178 -3.821 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.312 3.546 0.882 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.651 3.757 1.409 1.00 0.00 C ATOM 1547 C ALA A 96 -13.976 5.252 1.522 1.00 0.00 C ATOM 1548 O ALA A 96 -15.056 5.673 1.107 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.781 3.079 2.775 1.00 0.00 C ATOM 0 H ALA A 96 -11.698 3.013 1.498 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.367 3.314 0.716 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.786 3.239 3.167 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.599 2.009 2.669 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -13.051 3.505 3.463 1.00 0.00 H new ATOM 1555 N GLU A 97 -13.040 6.049 2.039 1.00 0.00 N ATOM 1556 CA GLU A 97 -13.158 7.488 2.253 1.00 0.00 C ATOM 1557 C GLU A 97 -13.415 8.255 0.957 1.00 0.00 C ATOM 1558 O GLU A 97 -14.004 9.334 0.992 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.860 7.968 2.921 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.888 9.393 3.489 1.00 0.00 C ATOM 1561 CD GLU A 97 -12.724 9.487 4.765 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -13.966 9.641 4.683 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -12.143 9.422 5.871 1.00 0.00 O ATOM 0 H GLU A 97 -12.133 5.687 2.334 1.00 0.00 H new ATOM 0 HA GLU A 97 -14.020 7.683 2.891 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -11.614 7.280 3.730 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -11.053 7.904 2.191 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.869 9.719 3.699 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -12.293 10.073 2.740 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.972 7.726 -0.185 1.00 0.00 N ATOM 1571 CA LEU A 98 -13.159 8.353 -1.489 1.00 0.00 C ATOM 1572 C LEU A 98 -14.216 7.638 -2.322 1.00 0.00 C ATOM 1573 O LEU A 98 -14.562 8.144 -3.394 1.00 0.00 O ATOM 1574 CB LEU A 98 -11.829 8.355 -2.273 1.00 0.00 C ATOM 1575 CG LEU A 98 -10.944 9.570 -1.944 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -9.956 9.271 -0.814 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -10.183 10.030 -3.193 1.00 0.00 C ATOM 0 H LEU A 98 -12.468 6.840 -0.228 1.00 0.00 H new ATOM 0 HA LEU A 98 -13.496 9.374 -1.306 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -11.280 7.440 -2.050 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -12.043 8.346 -3.342 1.00 0.00 H new ATOM 0 HG LEU A 98 -11.605 10.368 -1.606 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -9.352 10.156 -0.615 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.505 8.997 0.087 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.306 8.447 -1.108 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.561 10.890 -2.944 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.551 9.218 -3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.894 10.309 -3.970 1.00 0.00 H new ATOM 1589 N LEU A 99 -14.735 6.495 -1.865 1.00 0.00 N ATOM 1590 CA LEU A 99 -15.712 5.687 -2.589 1.00 0.00 C ATOM 1591 C LEU A 99 -16.887 5.256 -1.688 1.00 0.00 C ATOM 1592 O LEU A 99 -17.006 4.067 -1.376 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.984 4.459 -3.187 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.692 4.701 -4.000 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -12.993 3.360 -4.261 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -13.979 5.425 -5.314 1.00 0.00 C ATOM 0 H LEU A 99 -14.480 6.099 -0.960 1.00 0.00 H new ATOM 0 HA LEU A 99 -16.147 6.286 -3.389 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -14.740 3.784 -2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -15.690 3.935 -3.831 1.00 0.00 H new ATOM 0 HG LEU A 99 -13.034 5.345 -3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -12.082 3.530 -4.834 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -12.741 2.890 -3.310 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.659 2.706 -4.824 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -13.046 5.577 -5.857 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -14.658 4.824 -5.920 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -14.438 6.391 -5.104 1.00 0.00 H new ATOM 1608 N PRO A 100 -17.803 6.166 -1.307 1.00 0.00 N ATOM 1609 CA PRO A 100 -18.954 5.861 -0.450 1.00 0.00 C ATOM 1610 C PRO A 100 -20.029 5.020 -1.152 1.00 0.00 C ATOM 1611 O PRO A 100 -20.890 4.433 -0.489 1.00 0.00 O ATOM 1612 CB PRO A 100 -19.499 7.223 -0.025 1.00 0.00 C ATOM 1613 CG PRO A 100 -19.156 8.108 -1.216 1.00 0.00 C ATOM 1614 CD PRO A 100 -17.781 7.584 -1.617 1.00 0.00 C ATOM 0 HA PRO A 100 -18.651 5.248 0.399 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -20.573 7.190 0.159 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -19.029 7.579 0.892 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -19.882 8.006 -2.022 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -19.127 9.163 -0.945 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -17.591 7.751 -2.677 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -16.990 8.094 -1.067 1.00 0.00 H new ATOM 1622 N ASP A 101 -20.010 4.980 -2.486 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.950 4.198 -3.287 1.00 0.00 C ATOM 1624 C ASP A 101 -20.390 2.784 -3.473 1.00 0.00 C ATOM 1625 O ASP A 101 -21.132 1.858 -3.800 1.00 0.00 O ATOM 1626 CB ASP A 101 -21.145 4.841 -4.671 1.00 0.00 C ATOM 1627 CG ASP A 101 -22.139 6.001 -4.662 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -23.246 5.868 -4.093 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -21.802 7.043 -5.265 1.00 0.00 O ATOM 0 H ASP A 101 -19.332 5.497 -3.046 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.910 4.165 -2.772 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.183 5.199 -5.037 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -21.490 4.081 -5.372 1.00 0.00 H new ATOM 1634 N TRP A 102 -19.067 2.618 -3.326 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.398 1.339 -3.480 1.00 0.00 C ATOM 1636 C TRP A 102 -18.426 0.636 -2.132 1.00 0.00 C ATOM 1637 O TRP A 102 -19.156 -0.344 -2.004 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.983 1.527 -4.048 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.385 0.326 -4.699 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.028 -0.482 -5.564 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.051 -0.238 -4.553 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.183 -1.482 -5.993 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -14.935 -1.368 -5.418 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -13.950 0.048 -3.726 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -13.760 -2.131 -5.505 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.793 -0.751 -3.756 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -12.690 -1.834 -4.646 1.00 0.00 C ATOM 0 H TRP A 102 -18.434 3.383 -3.094 1.00 0.00 H new ATOM 0 HA TRP A 102 -18.912 0.709 -4.205 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -17.008 2.338 -4.776 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.325 1.845 -3.239 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.055 -0.363 -5.876 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.447 -2.214 -6.652 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.994 0.895 -3.057 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -13.680 -2.935 -6.222 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -11.974 -0.530 -3.087 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -11.793 -2.434 -4.669 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.574 1.048 -1.184 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.556 0.465 0.152 1.00 0.00 C ATOM 1660 C LEU A 103 -18.653 1.199 0.914 1.00 0.00 C ATOM 1661 O LEU A 103 -18.881 2.391 0.694 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.251 0.728 0.949 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.007 -0.158 0.796 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -15.297 -1.639 1.057 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -14.337 0.050 -0.553 1.00 0.00 C ATOM 0 H LEU A 103 -16.886 1.788 -1.325 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.668 -0.615 0.052 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.941 1.747 0.715 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -16.520 0.711 2.005 1.00 0.00 H new ATOM 0 HG LEU A 103 -14.307 0.159 1.569 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -14.381 -2.216 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -15.671 -1.763 2.073 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -16.047 -1.993 0.349 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.460 -0.593 -0.627 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -15.038 -0.199 -1.350 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -14.032 1.092 -0.651 1.00 0.00 H new ATOM 1677 N SER A 104 -19.284 0.499 1.841 1.00 0.00 N ATOM 1678 CA SER A 104 -20.317 1.054 2.700 1.00 0.00 C ATOM 1679 C SER A 104 -20.202 0.410 4.076 1.00 0.00 C ATOM 1680 O SER A 104 -19.623 -0.670 4.228 1.00 0.00 O ATOM 1681 CB SER A 104 -21.711 0.902 2.097 1.00 0.00 C ATOM 1682 OG SER A 104 -22.574 1.870 2.657 1.00 0.00 O ATOM 0 H SER A 104 -19.090 -0.486 2.021 1.00 0.00 H new ATOM 0 HA SER A 104 -20.166 2.129 2.799 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.666 1.022 1.015 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.096 -0.099 2.291 1.00 0.00 H new ATOM 0 HG SER A 104 -23.469 1.774 2.269 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.793 1.055 5.080 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.784 0.635 6.479 1.00 0.00 C ATOM 1690 C LEU A 105 -22.176 0.659 7.057 1.00 0.00 C ATOM 1691 O LEU A 105 -22.940 1.606 6.848 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.965 1.609 7.327 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.456 1.449 7.150 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -17.798 2.778 7.509 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.926 0.340 8.066 1.00 0.00 C ATOM 0 H LEU A 105 -21.313 1.920 4.934 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.363 -0.370 6.500 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -20.247 2.630 7.069 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -20.217 1.465 8.378 1.00 0.00 H new ATOM 0 HG LEU A 105 -18.227 1.175 6.120 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -16.718 2.693 7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -18.174 3.560 6.849 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -18.031 3.032 8.543 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -16.850 0.238 7.928 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -18.137 0.594 9.105 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -18.414 -0.602 7.817 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.471 -0.360 7.855 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.751 -0.512 8.499 1.00 0.00 C ATOM 1709 C HIS A 106 -23.575 -1.201 9.844 1.00 0.00 C ATOM 1710 O HIS A 106 -23.335 -2.411 9.887 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.668 -1.330 7.588 1.00 0.00 C ATOM 1712 CG HIS A 106 -25.062 -0.667 6.286 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -24.359 -0.680 5.108 1.00 0.00 N flip ATOM 1714 CD2 HIS A 106 -26.224 0.040 6.065 1.00 0.00 C flip ATOM 1715 CE1 HIS A 106 -25.113 0.003 4.155 1.00 0.00 C flip ATOM 1716 NE2 HIS A 106 -26.228 0.422 4.777 1.00 0.00 N flip ATOM 0 H HIS A 106 -21.813 -1.109 8.070 1.00 0.00 H new ATOM 0 HA HIS A 106 -24.199 0.466 8.675 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -24.173 -2.274 7.358 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -25.576 -1.572 8.140 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -26.992 0.249 6.795 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -24.852 0.164 3.119 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -26.974 0.956 4.333 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.620 -0.446 10.945 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.508 -1.051 12.271 1.00 0.00 C ATOM 1726 C ARG A 107 -24.864 -1.709 12.531 1.00 0.00 C ATOM 1727 O ARG A 107 -25.901 -1.075 12.314 1.00 0.00 O ATOM 1728 CB ARG A 107 -23.085 -0.018 13.322 1.00 0.00 C ATOM 1729 CG ARG A 107 -22.641 -0.713 14.618 1.00 0.00 C ATOM 1730 CD ARG A 107 -21.993 0.278 15.591 1.00 0.00 C ATOM 1731 NE ARG A 107 -23.004 1.089 16.290 1.00 0.00 N ATOM 1732 CZ ARG A 107 -23.354 2.362 16.077 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -22.702 3.133 15.215 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -24.399 2.855 16.728 1.00 0.00 N ATOM 0 H ARG A 107 -23.731 0.568 10.945 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.721 -1.803 12.330 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.270 0.592 12.933 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -23.915 0.656 13.531 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -23.502 -1.182 15.094 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -21.934 -1.508 14.382 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -21.394 -0.266 16.321 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -21.313 0.933 15.046 1.00 0.00 H new ATOM 0 HE ARG A 107 -23.507 0.614 17.040 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -21.910 2.758 14.693 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -22.993 4.100 15.075 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -24.920 2.266 17.377 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -24.682 3.824 16.579 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.872 -2.967 12.950 1.00 0.00 N ATOM 1749 CA ILE A 108 -26.054 -3.779 13.217 1.00 0.00 C ATOM 1750 C ILE A 108 -26.089 -4.094 14.710 1.00 0.00 C ATOM 1751 O ILE A 108 -25.052 -4.129 15.368 1.00 0.00 O ATOM 1752 CB ILE A 108 -25.965 -5.088 12.378 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.486 -4.893 10.921 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.264 -5.907 12.358 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.362 -3.993 10.046 1.00 0.00 C ATOM 0 H ILE A 108 -24.006 -3.478 13.123 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.966 -3.250 12.940 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.199 -5.647 12.916 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.479 -4.477 10.942 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.417 -5.872 10.447 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.120 -6.802 11.753 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.528 -6.195 13.376 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.067 -5.306 11.931 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -25.932 -3.927 9.047 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.366 -4.413 9.982 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.413 -2.997 10.485 1.00 0.00 H new ATOM 1767 N ARG A 109 -27.271 -4.429 15.236 1.00 0.00 N ATOM 1768 CA ARG A 109 -27.520 -4.775 16.642 1.00 0.00 C ATOM 1769 C ARG A 109 -26.707 -5.953 17.199 1.00 0.00 C ATOM 1770 O ARG A 109 -26.926 -6.331 18.348 1.00 0.00 O ATOM 1771 CB ARG A 109 -29.022 -5.051 16.825 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.465 -6.305 16.041 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.809 -6.897 16.476 1.00 0.00 C ATOM 1774 NE ARG A 109 -30.876 -7.164 17.924 1.00 0.00 N ATOM 1775 CZ ARG A 109 -30.115 -8.031 18.609 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -29.334 -8.910 17.987 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -30.108 -8.002 19.937 1.00 0.00 N ATOM 0 H ARG A 109 -28.119 -4.469 14.670 1.00 0.00 H new ATOM 0 HA ARG A 109 -27.183 -3.913 17.218 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -29.242 -5.186 17.884 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -29.596 -4.188 16.488 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.522 -6.052 14.982 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.697 -7.071 16.145 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -31.609 -6.210 16.201 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.985 -7.825 15.932 1.00 0.00 H new ATOM 0 HE ARG A 109 -31.569 -6.638 18.457 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -29.305 -8.935 16.968 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -28.764 -9.559 18.529 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -30.681 -7.321 20.435 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -29.530 -8.661 20.458 1.00 0.00 H new ATOM 1791 N THR A 110 -25.854 -6.579 16.402 1.00 0.00 N ATOM 1792 CA THR A 110 -25.017 -7.710 16.766 1.00 0.00 C ATOM 1793 C THR A 110 -23.547 -7.465 16.425 1.00 0.00 C ATOM 1794 O THR A 110 -22.680 -8.098 17.035 1.00 0.00 O ATOM 1795 CB THR A 110 -25.603 -8.943 16.055 1.00 0.00 C ATOM 1796 OG1 THR A 110 -25.030 -10.164 16.477 1.00 0.00 O ATOM 1797 CG2 THR A 110 -25.487 -8.888 14.526 1.00 0.00 C ATOM 0 H THR A 110 -25.721 -6.295 15.431 1.00 0.00 H new ATOM 0 HA THR A 110 -25.023 -7.868 17.844 1.00 0.00 H new ATOM 0 HB THR A 110 -26.654 -8.910 16.343 1.00 0.00 H new ATOM 0 HG1 THR A 110 -25.446 -10.906 15.990 1.00 0.00 H new ATOM 0 HG21 THR A 110 -25.921 -9.790 14.095 1.00 0.00 H new ATOM 0 HG22 THR A 110 -26.021 -8.014 14.152 1.00 0.00 H new ATOM 0 HG23 THR A 110 -24.437 -8.820 14.243 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.260 -6.616 15.431 1.00 0.00 N ATOM 1806 CA ASP A 111 -21.892 -6.313 15.000 1.00 0.00 C ATOM 1807 C ASP A 111 -21.857 -5.271 13.887 1.00 0.00 C ATOM 1808 O ASP A 111 -22.905 -4.874 13.377 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.188 -7.570 14.455 1.00 0.00 C ATOM 1810 CG ASP A 111 -19.802 -7.656 15.068 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.001 -6.711 14.880 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.553 -8.649 15.784 1.00 0.00 O ATOM 0 H ASP A 111 -23.975 -6.118 14.901 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.384 -5.932 15.886 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -21.765 -8.462 14.699 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.118 -7.523 13.368 1.00 0.00 H new ATOM 1817 N THR A 112 -20.671 -4.808 13.502 1.00 0.00 N ATOM 1818 CA THR A 112 -20.486 -3.856 12.420 1.00 0.00 C ATOM 1819 C THR A 112 -20.295 -4.697 11.153 1.00 0.00 C ATOM 1820 O THR A 112 -19.656 -5.750 11.195 1.00 0.00 O ATOM 1821 CB THR A 112 -19.287 -2.931 12.688 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.435 -2.264 13.924 1.00 0.00 O ATOM 1823 CG2 THR A 112 -19.147 -1.856 11.604 1.00 0.00 C ATOM 0 H THR A 112 -19.797 -5.092 13.944 1.00 0.00 H new ATOM 0 HA THR A 112 -21.344 -3.191 12.318 1.00 0.00 H new ATOM 0 HB THR A 112 -18.403 -3.569 12.695 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.661 -1.682 14.076 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.289 -1.222 11.829 1.00 0.00 H new ATOM 0 HG22 THR A 112 -19.002 -2.333 10.635 1.00 0.00 H new ATOM 0 HG23 THR A 112 -20.051 -1.247 11.577 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.861 -4.268 10.023 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.733 -4.979 8.759 1.00 0.00 C ATOM 1833 C TYR A 113 -20.436 -3.945 7.678 1.00 0.00 C ATOM 1834 O TYR A 113 -20.811 -2.772 7.799 1.00 0.00 O ATOM 1835 CB TYR A 113 -22.013 -5.764 8.412 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.356 -6.956 9.298 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -22.798 -6.761 10.618 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.282 -8.267 8.792 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.211 -7.842 11.414 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.676 -9.361 9.587 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.153 -9.154 10.902 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.564 -10.202 11.667 1.00 0.00 O ATOM 0 H TYR A 113 -21.420 -3.417 9.963 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.928 -5.710 8.832 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.853 -5.070 8.438 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.924 -6.119 7.385 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -22.820 -5.762 11.028 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.921 -8.435 7.788 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -23.572 -7.668 12.417 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.613 -10.363 9.190 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.459 -11.036 11.163 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.790 -4.390 6.610 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.407 -3.605 5.452 1.00 0.00 C ATOM 1854 C VAL A 114 -20.109 -4.217 4.250 1.00 0.00 C ATOM 1855 O VAL A 114 -20.444 -5.405 4.234 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.861 -3.605 5.302 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.319 -3.391 3.879 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.254 -2.500 6.168 1.00 0.00 C ATOM 0 H VAL A 114 -19.504 -5.366 6.527 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.705 -2.561 5.550 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.574 -4.611 5.609 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.229 -3.410 3.898 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.685 -4.184 3.227 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.658 -2.426 3.502 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.170 -2.506 6.058 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.646 -1.533 5.852 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.514 -2.672 7.213 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.392 -3.386 3.261 1.00 0.00 N ATOM 1869 CA LYS A 115 -21.002 -3.699 2.000 1.00 0.00 C ATOM 1870 C LYS A 115 -20.027 -3.224 0.941 1.00 0.00 C ATOM 1871 O LYS A 115 -19.288 -2.268 1.188 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.386 -3.038 1.900 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.462 -4.096 2.143 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.378 -3.875 3.343 1.00 0.00 C ATOM 1875 CE LYS A 115 -23.559 -4.002 4.628 1.00 0.00 C ATOM 1876 NZ LYS A 115 -24.419 -4.251 5.800 1.00 0.00 N ATOM 0 H LYS A 115 -20.178 -2.392 3.337 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.188 -4.765 1.873 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.474 -2.236 2.633 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.517 -2.586 0.917 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -24.082 -4.163 1.249 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -22.970 -5.061 2.263 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -24.839 -2.889 3.287 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -25.186 -4.606 3.339 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -22.842 -4.816 4.523 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -22.985 -3.089 4.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -23.837 -4.264 6.662 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -25.131 -3.497 5.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -24.897 -5.168 5.691 1.00 0.00 H new ATOM 1890 N LEU A 116 -19.963 -3.927 -0.183 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.078 -3.571 -1.268 1.00 0.00 C ATOM 1892 C LEU A 116 -19.735 -3.905 -2.588 1.00 0.00 C ATOM 1893 O LEU A 116 -19.945 -5.079 -2.916 1.00 0.00 O ATOM 1894 CB LEU A 116 -17.724 -4.265 -1.135 1.00 0.00 C ATOM 1895 CG LEU A 116 -16.778 -3.911 -2.289 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -16.739 -2.417 -2.596 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -15.362 -4.411 -1.999 1.00 0.00 C ATOM 0 H LEU A 116 -20.526 -4.759 -0.361 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.891 -2.498 -1.227 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.263 -3.981 -0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -17.872 -5.345 -1.106 1.00 0.00 H new ATOM 0 HG LEU A 116 -17.176 -4.413 -3.171 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -16.052 -2.233 -3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -17.737 -2.076 -2.872 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -16.401 -1.873 -1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -14.707 -4.150 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -14.992 -3.946 -1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -15.377 -5.494 -1.875 1.00 0.00 H new ATOM 1909 N ASP A 117 -20.016 -2.869 -3.369 1.00 0.00 N ATOM 1910 CA ASP A 117 -20.650 -3.027 -4.653 1.00 0.00 C ATOM 1911 C ASP A 117 -19.602 -3.403 -5.691 1.00 0.00 C ATOM 1912 O ASP A 117 -19.008 -2.576 -6.384 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.414 -1.749 -5.006 1.00 0.00 C ATOM 1914 CG ASP A 117 -22.908 -1.974 -4.883 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.380 -2.423 -3.813 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -23.618 -1.732 -5.882 1.00 0.00 O ATOM 0 H ASP A 117 -19.808 -1.901 -3.122 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.380 -3.836 -4.628 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -21.106 -0.939 -4.344 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -21.169 -1.440 -6.022 1.00 0.00 H new ATOM 1921 N LYS A 118 -19.453 -4.707 -5.884 1.00 0.00 N ATOM 1922 CA LYS A 118 -18.501 -5.285 -6.829 1.00 0.00 C ATOM 1923 C LYS A 118 -18.884 -4.995 -8.288 1.00 0.00 C ATOM 1924 O LYS A 118 -18.083 -5.308 -9.174 1.00 0.00 O ATOM 1925 CB LYS A 118 -18.410 -6.805 -6.612 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.079 -7.279 -5.179 1.00 0.00 C ATOM 1927 CD LYS A 118 -18.712 -8.655 -4.907 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.239 -8.545 -4.790 1.00 0.00 C ATOM 1929 NZ LYS A 118 -20.944 -9.655 -5.469 1.00 0.00 N ATOM 0 H LYS A 118 -19.999 -5.406 -5.381 1.00 0.00 H new ATOM 0 HA LYS A 118 -17.533 -4.821 -6.643 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -19.361 -7.249 -6.907 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -17.650 -7.201 -7.286 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -16.998 -7.337 -5.049 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -18.448 -6.553 -4.455 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -18.454 -9.343 -5.712 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.302 -9.072 -3.987 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.519 -8.532 -3.737 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -20.565 -7.597 -5.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -21.971 -9.532 -5.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -20.701 -9.654 -6.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -20.656 -10.560 -5.045 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.085 -4.468 -8.567 1.00 0.00 N ATOM 1944 CA ALA A 119 -20.530 -4.171 -9.931 1.00 0.00 C ATOM 1945 C ALA A 119 -20.155 -2.760 -10.394 1.00 0.00 C ATOM 1946 O ALA A 119 -20.325 -2.469 -11.577 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.041 -4.382 -10.074 1.00 0.00 C ATOM 0 H ALA A 119 -20.774 -4.237 -7.851 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.002 -4.872 -10.577 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.345 -4.155 -11.096 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -22.287 -5.419 -9.844 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.567 -3.723 -9.384 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.682 -1.881 -9.503 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.294 -0.525 -9.886 1.00 0.00 C ATOM 1955 C VAL A 120 -18.067 -0.658 -10.794 1.00 0.00 C ATOM 1956 O VAL A 120 -17.163 -1.448 -10.494 1.00 0.00 O ATOM 1957 CB VAL A 120 -19.041 0.300 -8.615 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.399 1.655 -8.900 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -20.354 0.556 -7.861 1.00 0.00 C ATOM 0 H VAL A 120 -19.560 -2.088 -8.512 1.00 0.00 H new ATOM 0 HA VAL A 120 -20.071 0.005 -10.437 1.00 0.00 H new ATOM 0 HB VAL A 120 -18.353 -0.294 -8.014 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -18.246 2.190 -7.962 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.439 1.506 -9.394 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.053 2.239 -9.548 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -20.151 1.142 -6.965 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -21.042 1.104 -8.504 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -20.803 -0.396 -7.578 1.00 0.00 H new ATOM 1969 N ASP A 121 -18.038 0.079 -11.904 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.947 0.032 -12.870 1.00 0.00 C ATOM 1971 C ASP A 121 -15.627 0.506 -12.267 1.00 0.00 C ATOM 1972 O ASP A 121 -15.510 1.654 -11.828 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.292 0.833 -14.129 1.00 0.00 C ATOM 1974 CG ASP A 121 -16.224 0.688 -15.218 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -15.301 -0.147 -15.085 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -16.320 1.425 -16.224 1.00 0.00 O ATOM 0 H ASP A 121 -18.780 0.731 -12.158 1.00 0.00 H new ATOM 0 HA ASP A 121 -16.816 -1.012 -13.154 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -18.253 0.498 -14.518 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -17.403 1.886 -13.869 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.645 -0.401 -12.228 1.00 0.00 N ATOM 1982 CA LEU A 122 -13.303 -0.182 -11.710 1.00 0.00 C ATOM 1983 C LEU A 122 -12.617 0.965 -12.449 1.00 0.00 C ATOM 1984 O LEU A 122 -11.836 1.667 -11.824 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.490 -1.486 -11.806 1.00 0.00 C ATOM 1986 CG LEU A 122 -11.417 -1.724 -10.722 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -10.283 -0.708 -10.652 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.015 -1.903 -9.320 1.00 0.00 C ATOM 0 H LEU A 122 -14.777 -1.351 -12.575 1.00 0.00 H new ATOM 0 HA LEU A 122 -13.367 0.105 -10.660 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -13.188 -2.323 -11.781 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.999 -1.509 -12.779 1.00 0.00 H new ATOM 0 HG LEU A 122 -10.966 -2.656 -11.063 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -9.596 -0.984 -9.852 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -9.748 -0.694 -11.602 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.693 0.282 -10.452 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -11.213 -2.067 -8.600 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.572 -1.007 -9.045 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -12.686 -2.762 -9.317 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.910 1.200 -13.733 1.00 0.00 N ATOM 2001 CA ALA A 123 -12.301 2.297 -14.488 1.00 0.00 C ATOM 2002 C ALA A 123 -12.561 3.620 -13.766 1.00 0.00 C ATOM 2003 O ALA A 123 -11.620 4.332 -13.411 1.00 0.00 O ATOM 2004 CB ALA A 123 -12.825 2.320 -15.922 1.00 0.00 C ATOM 0 H ALA A 123 -13.570 0.640 -14.273 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.223 2.145 -14.544 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -12.360 3.142 -16.466 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -12.583 1.377 -16.413 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -13.906 2.457 -15.912 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.835 3.911 -13.492 1.00 0.00 N ATOM 2011 CA GLY A 124 -14.236 5.120 -12.796 1.00 0.00 C ATOM 2012 C GLY A 124 -13.584 5.177 -11.418 1.00 0.00 C ATOM 2013 O GLY A 124 -13.207 6.263 -10.978 1.00 0.00 O ATOM 0 H GLY A 124 -14.615 3.307 -13.751 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -13.949 5.996 -13.378 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -15.321 5.147 -12.694 1.00 0.00 H new ATOM 2017 N LEU A 125 -13.433 4.026 -10.742 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.807 3.940 -9.424 1.00 0.00 C ATOM 2019 C LEU A 125 -11.353 4.368 -9.561 1.00 0.00 C ATOM 2020 O LEU A 125 -10.962 5.316 -8.884 1.00 0.00 O ATOM 2021 CB LEU A 125 -12.959 2.552 -8.773 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.428 2.156 -8.539 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.543 0.740 -7.979 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.141 3.103 -7.573 1.00 0.00 C ATOM 0 H LEU A 125 -13.747 3.125 -11.103 1.00 0.00 H new ATOM 0 HA LEU A 125 -13.322 4.614 -8.740 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.484 1.805 -9.408 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.430 2.544 -7.820 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.905 2.215 -9.517 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.594 0.493 -7.826 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.103 0.033 -8.683 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.014 0.681 -7.028 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -16.174 2.780 -7.442 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.632 3.091 -6.609 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -15.126 4.115 -7.978 1.00 0.00 H new ATOM 2036 N THR A 126 -10.560 3.723 -10.428 1.00 0.00 N ATOM 2037 CA THR A 126 -9.161 4.085 -10.655 1.00 0.00 C ATOM 2038 C THR A 126 -9.035 5.583 -10.956 1.00 0.00 C ATOM 2039 O THR A 126 -8.121 6.222 -10.433 1.00 0.00 O ATOM 2040 CB THR A 126 -8.589 3.256 -11.821 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.794 1.879 -11.585 1.00 0.00 O ATOM 2042 CG2 THR A 126 -7.087 3.473 -12.027 1.00 0.00 C ATOM 0 H THR A 126 -10.875 2.934 -10.992 1.00 0.00 H new ATOM 0 HA THR A 126 -8.591 3.868 -9.751 1.00 0.00 H new ATOM 0 HB THR A 126 -9.115 3.591 -12.715 1.00 0.00 H new ATOM 0 HG1 THR A 126 -8.429 1.361 -12.332 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.742 2.863 -12.862 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.898 4.524 -12.244 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.551 3.187 -11.122 1.00 0.00 H new ATOM 2050 N ALA A 127 -9.954 6.143 -11.750 1.00 0.00 N ATOM 2051 CA ALA A 127 -9.946 7.547 -12.114 1.00 0.00 C ATOM 2052 C ALA A 127 -10.153 8.435 -10.887 1.00 0.00 C ATOM 2053 O ALA A 127 -9.273 9.224 -10.554 1.00 0.00 O ATOM 2054 CB ALA A 127 -10.992 7.818 -13.200 1.00 0.00 C ATOM 0 H ALA A 127 -10.729 5.620 -12.158 1.00 0.00 H new ATOM 0 HA ALA A 127 -8.967 7.797 -12.524 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -10.976 8.875 -13.465 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.764 7.220 -14.082 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -11.981 7.552 -12.827 1.00 0.00 H new ATOM 2060 N ARG A 128 -11.302 8.346 -10.198 1.00 0.00 N ATOM 2061 CA ARG A 128 -11.550 9.190 -9.015 1.00 0.00 C ATOM 2062 C ARG A 128 -10.472 8.999 -7.944 1.00 0.00 C ATOM 2063 O ARG A 128 -10.154 9.960 -7.241 1.00 0.00 O ATOM 2064 CB ARG A 128 -12.996 9.053 -8.497 1.00 0.00 C ATOM 2065 CG ARG A 128 -13.406 7.674 -7.969 1.00 0.00 C ATOM 2066 CD ARG A 128 -14.929 7.604 -7.755 1.00 0.00 C ATOM 2067 NE ARG A 128 -15.349 8.278 -6.514 1.00 0.00 N ATOM 2068 CZ ARG A 128 -16.606 8.447 -6.083 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -17.663 8.181 -6.840 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -16.819 8.863 -4.845 1.00 0.00 N ATOM 0 H ARG A 128 -12.064 7.710 -10.433 1.00 0.00 H new ATOM 0 HA ARG A 128 -11.463 10.232 -9.323 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -13.143 9.781 -7.699 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -13.675 9.324 -9.305 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -13.097 6.902 -8.674 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -12.892 7.471 -7.029 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -15.435 8.063 -8.605 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -15.242 6.560 -7.723 1.00 0.00 H new ATOM 0 HE ARG A 128 -14.607 8.654 -5.923 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -17.535 7.833 -7.790 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -18.603 8.324 -6.471 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -16.029 9.052 -4.228 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -17.773 8.995 -4.508 1.00 0.00 H new ATOM 2084 N LEU A 129 -9.896 7.800 -7.843 1.00 0.00 N ATOM 2085 CA LEU A 129 -8.835 7.456 -6.907 1.00 0.00 C ATOM 2086 C LEU A 129 -7.587 8.261 -7.262 1.00 0.00 C ATOM 2087 O LEU A 129 -7.188 9.134 -6.498 1.00 0.00 O ATOM 2088 CB LEU A 129 -8.607 5.924 -6.956 1.00 0.00 C ATOM 2089 CG LEU A 129 -7.346 5.317 -6.292 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -7.617 3.828 -6.016 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -6.085 5.381 -7.173 1.00 0.00 C ATOM 0 H LEU A 129 -10.169 7.015 -8.435 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.102 7.711 -5.881 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -9.476 5.450 -6.500 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.597 5.629 -8.005 1.00 0.00 H new ATOM 0 HG LEU A 129 -7.158 5.903 -5.392 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.741 3.379 -5.548 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.474 3.732 -5.349 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.828 3.316 -6.955 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.245 4.937 -6.639 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.259 4.831 -8.098 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.857 6.421 -7.407 1.00 0.00 H new ATOM 2103 N ALA A 130 -7.008 8.017 -8.441 1.00 0.00 N ATOM 2104 CA ALA A 130 -5.785 8.659 -8.900 1.00 0.00 C ATOM 2105 C ALA A 130 -5.901 10.162 -9.139 1.00 0.00 C ATOM 2106 O ALA A 130 -4.870 10.832 -9.186 1.00 0.00 O ATOM 2107 CB ALA A 130 -5.302 7.954 -10.173 1.00 0.00 C ATOM 0 H ALA A 130 -7.389 7.352 -9.114 1.00 0.00 H new ATOM 0 HA ALA A 130 -5.061 8.558 -8.091 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -4.386 8.427 -10.526 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -5.108 6.904 -9.956 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -6.069 8.029 -10.944 1.00 0.00 H new ATOM 2113 N HIS A 131 -7.107 10.715 -9.303 1.00 0.00 N ATOM 2114 CA HIS A 131 -7.268 12.145 -9.526 1.00 0.00 C ATOM 2115 C HIS A 131 -6.935 12.925 -8.238 1.00 0.00 C ATOM 2116 O HIS A 131 -6.614 14.103 -8.328 1.00 0.00 O ATOM 2117 CB HIS A 131 -8.672 12.439 -10.092 1.00 0.00 C ATOM 2118 CG HIS A 131 -8.822 13.692 -10.932 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -9.827 13.929 -11.845 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -7.969 14.759 -11.002 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -9.576 15.102 -12.450 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -8.474 15.670 -11.939 1.00 0.00 N ATOM 0 H HIS A 131 -7.981 10.190 -9.285 1.00 0.00 H new ATOM 0 HA HIS A 131 -6.560 12.491 -10.279 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -8.980 11.586 -10.697 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -9.368 12.505 -9.256 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -7.060 14.879 -10.431 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -10.178 15.528 -13.239 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -8.083 16.580 -12.183 1.00 0.00 H new ATOM 2130 N HIS A 132 -7.035 12.314 -7.046 1.00 0.00 N ATOM 2131 CA HIS A 132 -6.726 12.905 -5.734 1.00 0.00 C ATOM 2132 C HIS A 132 -7.307 14.310 -5.428 1.00 0.00 C ATOM 2133 O HIS A 132 -6.955 14.887 -4.401 1.00 0.00 O ATOM 2134 CB HIS A 132 -5.194 12.840 -5.538 1.00 0.00 C ATOM 2135 CG HIS A 132 -4.615 11.440 -5.566 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -3.519 11.016 -6.287 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -5.051 10.369 -4.832 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -3.310 9.722 -5.994 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -4.227 9.274 -5.121 1.00 0.00 N ATOM 0 H HIS A 132 -7.349 11.347 -6.968 1.00 0.00 H new ATOM 0 HA HIS A 132 -7.255 12.303 -4.995 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -4.715 13.433 -6.317 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -4.943 13.304 -4.584 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -5.887 10.369 -4.148 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -2.512 9.122 -6.405 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -4.307 8.329 -4.745 1.00 0.00 H new ATOM 2147 N VAL A 133 -8.273 14.822 -6.201 1.00 0.00 N ATOM 2148 CA VAL A 133 -8.907 16.138 -6.060 1.00 0.00 C ATOM 2149 C VAL A 133 -9.383 16.381 -4.630 1.00 0.00 C ATOM 2150 O VAL A 133 -9.066 17.406 -4.026 1.00 0.00 O ATOM 2151 CB VAL A 133 -10.075 16.280 -7.062 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -10.654 17.698 -7.069 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -9.675 15.916 -8.498 1.00 0.00 C ATOM 0 H VAL A 133 -8.655 14.297 -6.988 1.00 0.00 H new ATOM 0 HA VAL A 133 -8.159 16.898 -6.286 1.00 0.00 H new ATOM 0 HB VAL A 133 -10.830 15.574 -6.717 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -11.472 17.753 -7.787 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -11.027 17.944 -6.075 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -9.876 18.407 -7.350 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.535 16.035 -9.157 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.871 16.573 -8.829 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -9.334 14.881 -8.530 1.00 0.00 H new ATOM 2163 N HIS A 134 -10.174 15.452 -4.088 1.00 0.00 N ATOM 2164 CA HIS A 134 -10.695 15.545 -2.727 1.00 0.00 C ATOM 2165 C HIS A 134 -9.871 14.681 -1.768 1.00 0.00 C ATOM 2166 O HIS A 134 -10.192 14.620 -0.580 1.00 0.00 O ATOM 2167 CB HIS A 134 -12.205 15.253 -2.683 1.00 0.00 C ATOM 2168 CG HIS A 134 -12.614 13.919 -3.255 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -12.947 12.785 -2.546 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -12.766 13.635 -4.584 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -13.263 11.827 -3.432 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -13.144 12.294 -4.689 1.00 0.00 N ATOM 0 H HIS A 134 -10.471 14.612 -4.585 1.00 0.00 H new ATOM 0 HA HIS A 134 -10.586 16.572 -2.379 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -12.540 15.305 -1.647 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -12.728 16.040 -3.227 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.620 14.323 -5.404 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -13.569 10.824 -3.173 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -13.300 11.771 -5.551 1.00 0.00 H new ATOM 2180 N ALA A 135 -8.853 13.970 -2.272 1.00 0.00 N ATOM 2181 CA ALA A 135 -7.997 13.145 -1.443 1.00 0.00 C ATOM 2182 C ALA A 135 -7.059 14.059 -0.669 1.00 0.00 C ATOM 2183 O ALA A 135 -6.768 15.189 -1.067 1.00 0.00 O ATOM 2184 CB ALA A 135 -7.131 12.184 -2.268 1.00 0.00 C ATOM 0 H ALA A 135 -8.610 13.958 -3.262 1.00 0.00 H new ATOM 0 HA ALA A 135 -8.639 12.554 -0.790 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -6.509 11.589 -1.599 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -7.774 11.523 -2.849 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -6.494 12.756 -2.943 1.00 0.00 H new ATOM 2190 N GLU A 136 -6.514 13.497 0.388 1.00 0.00 N ATOM 2191 CA GLU A 136 -5.578 14.112 1.299 1.00 0.00 C ATOM 2192 C GLU A 136 -4.385 13.164 1.312 1.00 0.00 C ATOM 2193 O GLU A 136 -3.464 13.359 0.517 1.00 0.00 O ATOM 2194 CB GLU A 136 -6.223 14.464 2.657 1.00 0.00 C ATOM 2195 CG GLU A 136 -7.148 13.423 3.310 1.00 0.00 C ATOM 2196 CD GLU A 136 -8.507 13.289 2.620 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -9.420 14.098 2.919 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -8.667 12.369 1.787 1.00 0.00 O ATOM 0 H GLU A 136 -6.728 12.535 0.649 1.00 0.00 H new ATOM 0 HA GLU A 136 -5.237 15.100 0.989 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -5.420 14.685 3.360 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -6.794 15.383 2.527 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -6.650 12.453 3.304 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -7.306 13.694 4.354 1.00 0.00 H new ATOM 2205 N GLY A 137 -4.428 12.069 2.069 1.00 0.00 N ATOM 2206 CA GLY A 137 -3.321 11.129 2.112 1.00 0.00 C ATOM 2207 C GLY A 137 -3.574 9.949 3.035 1.00 0.00 C ATOM 2208 O GLY A 137 -2.623 9.543 3.707 1.00 0.00 O ATOM 0 H GLY A 137 -5.220 11.815 2.659 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -3.127 10.759 1.105 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -2.422 11.651 2.438 1.00 0.00 H new ATOM 2212 N LEU A 138 -4.812 9.425 3.085 1.00 0.00 N ATOM 2213 CA LEU A 138 -5.192 8.282 3.925 1.00 0.00 C ATOM 2214 C LEU A 138 -4.235 7.139 3.667 1.00 0.00 C ATOM 2215 O LEU A 138 -3.868 6.497 4.679 1.00 0.00 O ATOM 2216 CB LEU A 138 -6.631 7.777 3.664 1.00 0.00 C ATOM 2217 CG LEU A 138 -7.812 8.529 4.292 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -7.844 8.283 5.794 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -7.774 10.025 4.001 1.00 0.00 C ATOM 0 H LEU A 138 -5.587 9.792 2.533 1.00 0.00 H new ATOM 0 HA LEU A 138 -5.148 8.626 4.958 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -6.785 7.767 2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.683 6.742 4.003 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.723 8.141 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.685 8.820 6.233 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.955 7.216 5.986 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.915 8.637 6.241 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -8.632 10.508 4.468 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.854 10.451 4.403 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.809 10.187 2.924 1.00 0.00 H new TER 2231 LEU A 138