USER MOD reduce.3.24.130724 H: found=0, std=0, add=1103, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1103 hydrogens (55 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 54 SER OG : rot -90:sc= 0.639 USER MOD Set 1.2: A 90 GLN : amide:sc= 0.436 X(o=1.1,f=1.3) USER MOD Set 2.1: A 29 TYR OH : rot 178:sc= 1.16 USER MOD Set 2.2: A 97 THR OG1 : rot 112:sc= 1.1 USER MOD Single : A 6 SER OG : rot 180:sc=-0.000548 USER MOD Single : A 9 SER OG : rot 180:sc= -0.0218 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 171:sc=-0.00359 (180deg=-0.103) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 156:sc= -0.39 (180deg=-1.3) USER MOD Single : A 28 GLN : amide:sc= -0.773 K(o=-0.77,f=-0.12) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.37 K(o=-0.37,f=-7!) USER MOD Single : A 38 SER OG : rot 180:sc= -0.502 USER MOD Single : A 47 ASN : amide:sc= -0.0442 K(o=-0.044,f=-1.6!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.656 USER MOD Single : A 57 CYS SG : rot 180:sc= -0.249 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 GLN : amide:sc=-0.000418 X(o=-0.00042,f=0) USER MOD Single : A 67 SER OG : rot 159:sc= -1.9! USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0.0349 USER MOD Single : A 77 SER OG : rot -130:sc= 1.05 USER MOD Single : A 79 TYR OH : rot 180:sc= -0.905 USER MOD Single : A 80 ASN : amide:sc= -4.46! C(o=-4.5!,f=-5.2!) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.479 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 CYS SG : rot -150:sc= -2.24! USER MOD Single : A 89 HIS : no HE2:sc= -0.166 K(o=0.56,f=-3.7!) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc= -0.0467 X(o=-0.047,f=0) USER MOD Single : A 109 ASN : amide:sc= -0.0787 K(o=-0.079,f=-1.1) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot 30:sc= 0.777! USER MOD Single : A 124 ASN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 125 ASN : amide:sc= -0.0869 X(o=-0.087,f=-0.087) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 300 PBU O2 : rot -149:sc= 0.0617 USER MOD Single : A 300 PBU O3 : rot -125:sc= 0.262 USER MOD Single : A 300 PBU O6 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 3.024 6.016 -15.882 1.00 23.41 N ATOM 2 CA GLY A 2 4.435 5.999 -15.546 1.00 1.55 C ATOM 3 C GLY A 2 5.042 4.615 -15.661 1.00 24.23 C ATOM 4 O GLY A 2 5.924 4.383 -16.488 1.00 34.43 O ATOM 0 HA2 GLY A 2 4.970 6.683 -16.205 1.00 1.55 H new ATOM 0 HA3 GLY A 2 4.567 6.367 -14.529 1.00 1.55 H new ATOM 8 N ALA A 3 4.570 3.691 -14.830 1.00 54.12 N ATOM 9 CA ALA A 3 5.071 2.323 -14.844 1.00 42.31 C ATOM 10 C ALA A 3 6.593 2.295 -14.741 1.00 31.34 C ATOM 11 O ALA A 3 7.291 2.242 -15.754 1.00 43.34 O ATOM 12 CB ALA A 3 4.612 1.605 -16.104 1.00 12.11 C ATOM 0 H ALA A 3 3.841 3.866 -14.138 1.00 54.12 H new ATOM 0 HA ALA A 3 4.664 1.805 -13.976 1.00 42.31 H new ATOM 0 HB1 ALA A 3 4.994 0.584 -16.101 1.00 12.11 H new ATOM 0 HB2 ALA A 3 3.523 1.585 -16.135 1.00 12.11 H new ATOM 0 HB3 ALA A 3 4.990 2.131 -16.981 1.00 12.11 H new ATOM 18 N ARG A 4 7.099 2.330 -13.513 1.00 73.11 N ATOM 19 CA ARG A 4 8.538 2.310 -13.279 1.00 33.20 C ATOM 20 C ARG A 4 9.103 0.909 -13.491 1.00 44.12 C ATOM 21 O ARG A 4 10.153 0.740 -14.111 1.00 72.11 O ATOM 22 CB ARG A 4 8.852 2.789 -11.861 1.00 73.03 C ATOM 23 CG ARG A 4 8.858 4.303 -11.717 1.00 52.11 C ATOM 24 CD ARG A 4 10.248 4.879 -11.943 1.00 21.12 C ATOM 25 NE ARG A 4 10.289 5.772 -13.097 1.00 71.32 N ATOM 26 CZ ARG A 4 11.414 6.159 -13.688 1.00 11.41 C ATOM 27 NH1 ARG A 4 12.585 5.732 -13.235 1.00 41.13 N ATOM 28 NH2 ARG A 4 11.370 6.974 -14.734 1.00 11.30 N ATOM 0 H ARG A 4 6.534 2.372 -12.665 1.00 73.11 H new ATOM 0 HA ARG A 4 9.007 2.985 -13.995 1.00 33.20 H new ATOM 0 HB2 ARG A 4 8.117 2.370 -11.174 1.00 73.03 H new ATOM 0 HB3 ARG A 4 9.825 2.400 -11.562 1.00 73.03 H new ATOM 0 HG2 ARG A 4 8.161 4.740 -12.432 1.00 52.11 H new ATOM 0 HG3 ARG A 4 8.507 4.576 -10.722 1.00 52.11 H new ATOM 0 HD2 ARG A 4 10.564 5.422 -11.053 1.00 21.12 H new ATOM 0 HD3 ARG A 4 10.958 4.065 -12.089 1.00 21.12 H new ATOM 0 HE ARG A 4 9.405 6.118 -13.470 1.00 71.32 H new ATOM 0 HH11 ARG A 4 12.623 5.105 -12.431 1.00 41.13 H new ATOM 0 HH12 ARG A 4 13.448 6.030 -13.690 1.00 41.13 H new ATOM 0 HH21 ARG A 4 10.471 7.304 -15.086 1.00 11.30 H new ATOM 0 HH22 ARG A 4 12.235 7.270 -15.187 1.00 11.30 H new ATOM 42 N ALA A 5 8.402 -0.092 -12.970 1.00 21.15 N ATOM 43 CA ALA A 5 8.834 -1.478 -13.103 1.00 14.53 C ATOM 44 C ALA A 5 7.658 -2.437 -12.946 1.00 40.32 C ATOM 45 O ALA A 5 6.546 -2.022 -12.618 1.00 31.31 O ATOM 46 CB ALA A 5 9.916 -1.794 -12.081 1.00 15.42 C ATOM 0 H ALA A 5 7.532 0.031 -12.452 1.00 21.15 H new ATOM 0 HA ALA A 5 9.246 -1.610 -14.104 1.00 14.53 H new ATOM 0 HB1 ALA A 5 10.229 -2.832 -12.192 1.00 15.42 H new ATOM 0 HB2 ALA A 5 10.771 -1.138 -12.242 1.00 15.42 H new ATOM 0 HB3 ALA A 5 9.524 -1.639 -11.076 1.00 15.42 H new ATOM 52 N SER A 6 7.911 -3.720 -13.181 1.00 72.13 N ATOM 53 CA SER A 6 6.872 -4.738 -13.070 1.00 64.45 C ATOM 54 C SER A 6 5.662 -4.374 -13.926 1.00 22.32 C ATOM 55 O SER A 6 5.703 -3.423 -14.707 1.00 55.42 O ATOM 56 CB SER A 6 6.447 -4.904 -11.610 1.00 13.10 C ATOM 57 OG SER A 6 7.480 -4.501 -10.728 1.00 32.53 O ATOM 0 H SER A 6 8.827 -4.080 -13.450 1.00 72.13 H new ATOM 0 HA SER A 6 7.281 -5.682 -13.432 1.00 64.45 H new ATOM 0 HB2 SER A 6 5.551 -4.313 -11.420 1.00 13.10 H new ATOM 0 HB3 SER A 6 6.188 -5.946 -11.420 1.00 13.10 H new ATOM 0 HG SER A 6 7.182 -4.615 -9.801 1.00 32.53 H new ATOM 63 N VAL A 7 4.587 -5.139 -13.773 1.00 73.22 N ATOM 64 CA VAL A 7 3.364 -4.898 -14.530 1.00 22.12 C ATOM 65 C VAL A 7 2.385 -4.039 -13.736 1.00 25.30 C ATOM 66 O VAL A 7 2.161 -2.873 -14.061 1.00 64.30 O ATOM 67 CB VAL A 7 2.673 -6.220 -14.916 1.00 22.41 C ATOM 68 CG1 VAL A 7 1.427 -5.950 -15.745 1.00 53.22 C ATOM 69 CG2 VAL A 7 3.637 -7.125 -15.668 1.00 2.01 C ATOM 0 H VAL A 7 4.537 -5.931 -13.132 1.00 73.22 H new ATOM 0 HA VAL A 7 3.654 -4.369 -15.438 1.00 22.12 H new ATOM 0 HB VAL A 7 2.369 -6.730 -14.002 1.00 22.41 H new ATOM 0 HG11 VAL A 7 0.953 -6.896 -16.008 1.00 53.22 H new ATOM 0 HG12 VAL A 7 0.730 -5.343 -15.167 1.00 53.22 H new ATOM 0 HG13 VAL A 7 1.704 -5.418 -16.655 1.00 53.22 H new ATOM 0 HG21 VAL A 7 3.132 -8.054 -15.933 1.00 2.01 H new ATOM 0 HG22 VAL A 7 3.974 -6.624 -16.575 1.00 2.01 H new ATOM 0 HG23 VAL A 7 4.497 -7.347 -15.035 1.00 2.01 H new ATOM 79 N LEU A 8 1.805 -4.624 -12.694 1.00 64.34 N ATOM 80 CA LEU A 8 0.851 -3.911 -11.852 1.00 22.13 C ATOM 81 C LEU A 8 1.518 -3.414 -10.574 1.00 0.30 C ATOM 82 O LEU A 8 2.083 -4.198 -9.811 1.00 14.31 O ATOM 83 CB LEU A 8 -0.330 -4.820 -11.505 1.00 24.13 C ATOM 84 CG LEU A 8 -1.227 -5.231 -12.672 1.00 63.53 C ATOM 85 CD1 LEU A 8 -2.409 -6.048 -12.176 1.00 21.04 C ATOM 86 CD2 LEU A 8 -1.707 -4.003 -13.433 1.00 34.02 C ATOM 0 H LEU A 8 1.978 -5.589 -12.412 1.00 64.34 H new ATOM 0 HA LEU A 8 0.486 -3.047 -12.408 1.00 22.13 H new ATOM 0 HB2 LEU A 8 0.059 -5.724 -11.036 1.00 24.13 H new ATOM 0 HB3 LEU A 8 -0.945 -4.314 -10.761 1.00 24.13 H new ATOM 0 HG LEU A 8 -0.644 -5.851 -13.352 1.00 63.53 H new ATOM 0 HD11 LEU A 8 -3.036 -6.331 -13.021 1.00 21.04 H new ATOM 0 HD12 LEU A 8 -2.046 -6.946 -11.676 1.00 21.04 H new ATOM 0 HD13 LEU A 8 -2.993 -5.453 -11.474 1.00 21.04 H new ATOM 0 HD21 LEU A 8 -2.344 -4.314 -14.261 1.00 34.02 H new ATOM 0 HD22 LEU A 8 -2.273 -3.357 -12.762 1.00 34.02 H new ATOM 0 HD23 LEU A 8 -0.848 -3.457 -13.822 1.00 34.02 H new ATOM 98 N SER A 9 1.446 -2.107 -10.344 1.00 13.12 N ATOM 99 CA SER A 9 2.043 -1.505 -9.158 1.00 63.12 C ATOM 100 C SER A 9 1.249 -1.865 -7.907 1.00 70.12 C ATOM 101 O SER A 9 0.304 -2.650 -7.963 1.00 53.23 O ATOM 102 CB SER A 9 2.112 0.016 -9.313 1.00 1.32 C ATOM 103 OG SER A 9 0.964 0.637 -8.761 1.00 10.14 O ATOM 0 H SER A 9 0.980 -1.444 -10.964 1.00 13.12 H new ATOM 0 HA SER A 9 3.054 -1.899 -9.050 1.00 63.12 H new ATOM 0 HB2 SER A 9 3.007 0.395 -8.820 1.00 1.32 H new ATOM 0 HB3 SER A 9 2.197 0.274 -10.369 1.00 1.32 H new ATOM 0 HG SER A 9 1.033 1.608 -8.871 1.00 10.14 H new ATOM 109 N GLY A 10 1.642 -1.285 -6.776 1.00 74.42 N ATOM 110 CA GLY A 10 0.956 -1.556 -5.527 1.00 43.42 C ATOM 111 C GLY A 10 -0.534 -1.291 -5.612 1.00 5.41 C ATOM 112 O GLY A 10 -1.344 -2.136 -5.236 1.00 23.45 O ATOM 0 H GLY A 10 2.423 -0.633 -6.703 1.00 74.42 H new ATOM 0 HA2 GLY A 10 1.121 -2.596 -5.244 1.00 43.42 H new ATOM 0 HA3 GLY A 10 1.387 -0.939 -4.739 1.00 43.42 H new ATOM 116 N GLY A 11 -0.896 -0.111 -6.108 1.00 40.31 N ATOM 117 CA GLY A 11 -2.299 0.242 -6.230 1.00 24.51 C ATOM 118 C GLY A 11 -3.050 -0.683 -7.168 1.00 43.45 C ATOM 119 O GLY A 11 -4.118 -1.189 -6.826 1.00 44.45 O ATOM 0 H GLY A 11 -0.244 0.606 -6.427 1.00 40.31 H new ATOM 0 HA2 GLY A 11 -2.765 0.212 -5.245 1.00 24.51 H new ATOM 0 HA3 GLY A 11 -2.383 1.267 -6.591 1.00 24.51 H new ATOM 123 N GLU A 12 -2.490 -0.902 -8.354 1.00 13.32 N ATOM 124 CA GLU A 12 -3.117 -1.771 -9.344 1.00 2.53 C ATOM 125 C GLU A 12 -3.274 -3.189 -8.802 1.00 42.45 C ATOM 126 O GLU A 12 -4.306 -3.831 -8.999 1.00 74.11 O ATOM 127 CB GLU A 12 -2.290 -1.794 -10.630 1.00 24.42 C ATOM 128 CG GLU A 12 -1.869 -0.414 -11.108 1.00 64.04 C ATOM 129 CD GLU A 12 -1.219 -0.444 -12.477 1.00 31.32 C ATOM 130 OE1 GLU A 12 -0.032 -0.825 -12.563 1.00 14.20 O ATOM 131 OE2 GLU A 12 -1.896 -0.085 -13.463 1.00 25.52 O ATOM 0 H GLU A 12 -1.605 -0.491 -8.652 1.00 13.32 H new ATOM 0 HA GLU A 12 -4.108 -1.373 -9.564 1.00 2.53 H new ATOM 0 HB2 GLU A 12 -1.399 -2.401 -10.468 1.00 24.42 H new ATOM 0 HB3 GLU A 12 -2.869 -2.280 -11.415 1.00 24.42 H new ATOM 0 HG2 GLU A 12 -2.742 0.238 -11.139 1.00 64.04 H new ATOM 0 HG3 GLU A 12 -1.173 0.019 -10.389 1.00 64.04 H new ATOM 138 N LEU A 13 -2.242 -3.672 -8.119 1.00 40.31 N ATOM 139 CA LEU A 13 -2.263 -5.014 -7.548 1.00 14.04 C ATOM 140 C LEU A 13 -3.451 -5.187 -6.606 1.00 63.44 C ATOM 141 O LEU A 13 -4.060 -6.255 -6.548 1.00 21.11 O ATOM 142 CB LEU A 13 -0.959 -5.293 -6.799 1.00 31.22 C ATOM 143 CG LEU A 13 -0.590 -6.765 -6.618 1.00 44.21 C ATOM 144 CD1 LEU A 13 0.844 -6.900 -6.127 1.00 23.54 C ATOM 145 CD2 LEU A 13 -1.551 -7.442 -5.653 1.00 41.54 C ATOM 0 H LEU A 13 -1.380 -3.154 -7.947 1.00 40.31 H new ATOM 0 HA LEU A 13 -2.364 -5.728 -8.366 1.00 14.04 H new ATOM 0 HB2 LEU A 13 -0.146 -4.798 -7.330 1.00 31.22 H new ATOM 0 HB3 LEU A 13 -1.024 -4.832 -5.814 1.00 31.22 H new ATOM 0 HG LEU A 13 -0.670 -7.260 -7.586 1.00 44.21 H new ATOM 0 HD11 LEU A 13 1.089 -7.955 -6.004 1.00 23.54 H new ATOM 0 HD12 LEU A 13 1.521 -6.453 -6.855 1.00 23.54 H new ATOM 0 HD13 LEU A 13 0.951 -6.389 -5.170 1.00 23.54 H new ATOM 0 HD21 LEU A 13 -1.272 -8.489 -5.537 1.00 41.54 H new ATOM 0 HD22 LEU A 13 -1.505 -6.945 -4.684 1.00 41.54 H new ATOM 0 HD23 LEU A 13 -2.566 -7.378 -6.045 1.00 41.54 H new ATOM 157 N ASP A 14 -3.775 -4.128 -5.872 1.00 14.45 N ATOM 158 CA ASP A 14 -4.892 -4.161 -4.936 1.00 51.53 C ATOM 159 C ASP A 14 -6.198 -4.479 -5.657 1.00 72.14 C ATOM 160 O ASP A 14 -6.862 -5.470 -5.355 1.00 53.33 O ATOM 161 CB ASP A 14 -5.012 -2.823 -4.203 1.00 64.41 C ATOM 162 CG ASP A 14 -4.642 -2.930 -2.737 1.00 24.41 C ATOM 163 OD1 ASP A 14 -3.690 -3.672 -2.419 1.00 52.13 O ATOM 164 OD2 ASP A 14 -5.306 -2.272 -1.908 1.00 62.11 O ATOM 0 H ASP A 14 -3.280 -3.237 -5.907 1.00 14.45 H new ATOM 0 HA ASP A 14 -4.699 -4.949 -4.208 1.00 51.53 H new ATOM 0 HB2 ASP A 14 -4.366 -2.089 -4.685 1.00 64.41 H new ATOM 0 HB3 ASP A 14 -6.034 -2.455 -4.291 1.00 64.41 H new ATOM 169 N LYS A 15 -6.562 -3.629 -6.612 1.00 1.12 N ATOM 170 CA LYS A 15 -7.788 -3.818 -7.378 1.00 21.34 C ATOM 171 C LYS A 15 -7.735 -5.114 -8.180 1.00 5.23 C ATOM 172 O LYS A 15 -8.727 -5.837 -8.278 1.00 71.02 O ATOM 173 CB LYS A 15 -8.012 -2.633 -8.320 1.00 75.33 C ATOM 174 CG LYS A 15 -8.831 -1.512 -7.702 1.00 72.21 C ATOM 175 CD LYS A 15 -8.039 -0.759 -6.646 1.00 24.14 C ATOM 176 CE LYS A 15 -8.829 0.414 -6.087 1.00 5.22 C ATOM 177 NZ LYS A 15 -9.736 -0.004 -4.983 1.00 53.43 N ATOM 0 H LYS A 15 -6.025 -2.802 -6.874 1.00 1.12 H new ATOM 0 HA LYS A 15 -8.619 -3.880 -6.676 1.00 21.34 H new ATOM 0 HB2 LYS A 15 -7.045 -2.237 -8.629 1.00 75.33 H new ATOM 0 HB3 LYS A 15 -8.515 -2.985 -9.221 1.00 75.33 H new ATOM 0 HG2 LYS A 15 -9.149 -0.820 -8.482 1.00 72.21 H new ATOM 0 HG3 LYS A 15 -9.735 -1.925 -7.254 1.00 72.21 H new ATOM 0 HD2 LYS A 15 -7.773 -1.438 -5.836 1.00 24.14 H new ATOM 0 HD3 LYS A 15 -7.106 -0.397 -7.079 1.00 24.14 H new ATOM 0 HE2 LYS A 15 -8.139 1.175 -5.722 1.00 5.22 H new ATOM 0 HE3 LYS A 15 -9.415 0.871 -6.885 1.00 5.22 H new ATOM 0 HZ1 LYS A 15 -10.257 0.824 -4.629 1.00 53.43 H new ATOM 0 HZ2 LYS A 15 -10.411 -0.712 -5.337 1.00 53.43 H new ATOM 0 HZ3 LYS A 15 -9.175 -0.417 -4.210 1.00 53.43 H new ATOM 191 N TRP A 16 -6.571 -5.404 -8.751 1.00 64.13 N ATOM 192 CA TRP A 16 -6.389 -6.615 -9.543 1.00 64.35 C ATOM 193 C TRP A 16 -6.841 -7.847 -8.767 1.00 43.54 C ATOM 194 O TRP A 16 -7.574 -8.685 -9.289 1.00 35.54 O ATOM 195 CB TRP A 16 -4.922 -6.765 -9.953 1.00 34.02 C ATOM 196 CG TRP A 16 -4.622 -8.076 -10.615 1.00 62.31 C ATOM 197 CD1 TRP A 16 -4.127 -9.200 -10.018 1.00 23.43 C ATOM 198 CD2 TRP A 16 -4.795 -8.397 -12.000 1.00 51.22 C ATOM 199 NE1 TRP A 16 -3.982 -10.201 -10.949 1.00 71.41 N ATOM 200 CE2 TRP A 16 -4.386 -9.733 -12.172 1.00 10.41 C ATOM 201 CE3 TRP A 16 -5.258 -7.685 -13.111 1.00 40.53 C ATOM 202 CZ2 TRP A 16 -4.426 -10.369 -13.409 1.00 23.22 C ATOM 203 CZ3 TRP A 16 -5.296 -8.319 -14.337 1.00 62.42 C ATOM 204 CH2 TRP A 16 -4.882 -9.650 -14.479 1.00 34.31 C ATOM 0 H TRP A 16 -5.740 -4.817 -8.680 1.00 64.13 H new ATOM 0 HA TRP A 16 -7.003 -6.528 -10.439 1.00 64.35 H new ATOM 0 HB2 TRP A 16 -4.657 -5.954 -10.632 1.00 34.02 H new ATOM 0 HB3 TRP A 16 -4.292 -6.660 -9.069 1.00 34.02 H new ATOM 0 HD1 TRP A 16 -3.885 -9.289 -8.969 1.00 23.43 H new ATOM 0 HE1 TRP A 16 -3.631 -11.140 -10.760 1.00 71.41 H new ATOM 0 HE3 TRP A 16 -5.580 -6.659 -13.012 1.00 40.53 H new ATOM 0 HZ2 TRP A 16 -4.108 -11.395 -13.520 1.00 23.22 H new ATOM 0 HZ3 TRP A 16 -5.651 -7.779 -15.202 1.00 62.42 H new ATOM 0 HH2 TRP A 16 -4.924 -10.117 -15.452 1.00 34.31 H new ATOM 215 N GLU A 17 -6.398 -7.949 -7.517 1.00 70.34 N ATOM 216 CA GLU A 17 -6.758 -9.080 -6.670 1.00 3.10 C ATOM 217 C GLU A 17 -8.263 -9.117 -6.423 1.00 53.14 C ATOM 218 O GLU A 17 -8.836 -10.175 -6.163 1.00 13.14 O ATOM 219 CB GLU A 17 -6.013 -9.003 -5.336 1.00 4.14 C ATOM 220 CG GLU A 17 -4.670 -9.714 -5.348 1.00 64.44 C ATOM 221 CD GLU A 17 -4.278 -10.244 -3.982 1.00 61.30 C ATOM 222 OE1 GLU A 17 -5.047 -11.046 -3.414 1.00 53.31 O ATOM 223 OE2 GLU A 17 -3.200 -9.857 -3.483 1.00 73.31 O ATOM 0 H GLU A 17 -5.790 -7.263 -7.070 1.00 70.34 H new ATOM 0 HA GLU A 17 -6.470 -9.995 -7.187 1.00 3.10 H new ATOM 0 HB2 GLU A 17 -5.858 -7.956 -5.076 1.00 4.14 H new ATOM 0 HB3 GLU A 17 -6.637 -9.437 -4.555 1.00 4.14 H new ATOM 0 HG2 GLU A 17 -4.707 -10.541 -6.057 1.00 64.44 H new ATOM 0 HG3 GLU A 17 -3.902 -9.026 -5.701 1.00 64.44 H new ATOM 230 N LYS A 18 -8.900 -7.952 -6.505 1.00 25.55 N ATOM 231 CA LYS A 18 -10.338 -7.850 -6.292 1.00 44.13 C ATOM 232 C LYS A 18 -11.106 -8.331 -7.518 1.00 65.32 C ATOM 233 O LYS A 18 -12.092 -9.059 -7.399 1.00 74.33 O ATOM 234 CB LYS A 18 -10.724 -6.404 -5.970 1.00 61.11 C ATOM 235 CG LYS A 18 -11.621 -6.271 -4.752 1.00 11.43 C ATOM 236 CD LYS A 18 -11.535 -4.881 -4.145 1.00 54.24 C ATOM 237 CE LYS A 18 -12.390 -4.766 -2.892 1.00 50.33 C ATOM 238 NZ LYS A 18 -11.846 -5.584 -1.772 1.00 51.21 N ATOM 0 H LYS A 18 -8.442 -7.066 -6.718 1.00 25.55 H new ATOM 0 HA LYS A 18 -10.601 -8.488 -5.448 1.00 44.13 H new ATOM 0 HB2 LYS A 18 -9.817 -5.822 -5.808 1.00 61.11 H new ATOM 0 HB3 LYS A 18 -11.230 -5.971 -6.833 1.00 61.11 H new ATOM 0 HG2 LYS A 18 -12.652 -6.483 -5.034 1.00 11.43 H new ATOM 0 HG3 LYS A 18 -11.336 -7.013 -4.006 1.00 11.43 H new ATOM 0 HD2 LYS A 18 -10.497 -4.653 -3.901 1.00 54.24 H new ATOM 0 HD3 LYS A 18 -11.860 -4.142 -4.878 1.00 54.24 H new ATOM 0 HE2 LYS A 18 -12.446 -3.722 -2.585 1.00 50.33 H new ATOM 0 HE3 LYS A 18 -13.407 -5.087 -3.116 1.00 50.33 H new ATOM 0 HZ1 LYS A 18 -12.363 -5.363 -0.897 1.00 51.21 H new ATOM 0 HZ2 LYS A 18 -11.957 -6.594 -1.994 1.00 51.21 H new ATOM 0 HZ3 LYS A 18 -10.837 -5.367 -1.642 1.00 51.21 H new ATOM 252 N ILE A 19 -10.647 -7.921 -8.696 1.00 71.23 N ATOM 253 CA ILE A 19 -11.291 -8.313 -9.944 1.00 63.10 C ATOM 254 C ILE A 19 -11.427 -9.829 -10.040 1.00 31.12 C ATOM 255 O ILE A 19 -10.491 -10.567 -9.731 1.00 64.54 O ATOM 256 CB ILE A 19 -10.506 -7.801 -11.167 1.00 61.32 C ATOM 257 CG1 ILE A 19 -10.368 -6.278 -11.111 1.00 11.01 C ATOM 258 CG2 ILE A 19 -11.194 -8.229 -12.455 1.00 50.11 C ATOM 259 CD1 ILE A 19 -9.297 -5.734 -12.030 1.00 51.12 C ATOM 0 H ILE A 19 -9.832 -7.318 -8.812 1.00 71.23 H new ATOM 0 HA ILE A 19 -12.283 -7.861 -9.943 1.00 63.10 H new ATOM 0 HB ILE A 19 -9.508 -8.238 -11.149 1.00 61.32 H new ATOM 0 HG12 ILE A 19 -11.324 -5.825 -11.373 1.00 11.01 H new ATOM 0 HG13 ILE A 19 -10.143 -5.979 -10.087 1.00 11.01 H new ATOM 0 HG21 ILE A 19 -10.628 -7.860 -13.310 1.00 50.11 H new ATOM 0 HG22 ILE A 19 -11.245 -9.317 -12.496 1.00 50.11 H new ATOM 0 HG23 ILE A 19 -12.203 -7.817 -12.483 1.00 50.11 H new ATOM 0 HD11 ILE A 19 -9.255 -4.649 -11.938 1.00 51.12 H new ATOM 0 HD12 ILE A 19 -8.332 -6.159 -11.755 1.00 51.12 H new ATOM 0 HD13 ILE A 19 -9.531 -6.002 -13.060 1.00 51.12 H new ATOM 271 N ARG A 20 -12.597 -10.286 -10.471 1.00 34.00 N ATOM 272 CA ARG A 20 -12.856 -11.714 -10.608 1.00 33.41 C ATOM 273 C ARG A 20 -12.692 -12.159 -12.059 1.00 31.21 C ATOM 274 O ARG A 20 -12.886 -11.373 -12.987 1.00 52.23 O ATOM 275 CB ARG A 20 -14.267 -12.048 -10.118 1.00 42.21 C ATOM 276 CG ARG A 20 -14.357 -12.245 -8.613 1.00 33.04 C ATOM 277 CD ARG A 20 -15.789 -12.500 -8.170 1.00 3.11 C ATOM 278 NE ARG A 20 -16.062 -11.937 -6.851 1.00 1.25 N ATOM 279 CZ ARG A 20 -16.254 -10.642 -6.630 1.00 71.42 C ATOM 280 NH1 ARG A 20 -16.205 -9.780 -7.637 1.00 63.54 N ATOM 281 NH2 ARG A 20 -16.498 -10.206 -5.401 1.00 73.21 N ATOM 0 H ARG A 20 -13.381 -9.688 -10.732 1.00 34.00 H new ATOM 0 HA ARG A 20 -12.130 -12.250 -9.996 1.00 33.41 H new ATOM 0 HB2 ARG A 20 -14.944 -11.246 -10.412 1.00 42.21 H new ATOM 0 HB3 ARG A 20 -14.611 -12.955 -10.616 1.00 42.21 H new ATOM 0 HG2 ARG A 20 -13.728 -13.084 -8.316 1.00 33.04 H new ATOM 0 HG3 ARG A 20 -13.970 -11.362 -8.105 1.00 33.04 H new ATOM 0 HD2 ARG A 20 -16.476 -12.068 -8.898 1.00 3.11 H new ATOM 0 HD3 ARG A 20 -15.977 -13.573 -8.152 1.00 3.11 H new ATOM 0 HE ARG A 20 -16.108 -12.574 -6.055 1.00 1.25 H new ATOM 0 HH11 ARG A 20 -16.020 -10.112 -8.584 1.00 63.54 H new ATOM 0 HH12 ARG A 20 -16.353 -8.786 -7.465 1.00 63.54 H new ATOM 0 HH21 ARG A 20 -16.538 -10.866 -4.624 1.00 73.21 H new ATOM 0 HH22 ARG A 20 -16.645 -9.211 -5.233 1.00 73.21 H new ATOM 295 N LEU A 21 -12.334 -13.425 -12.246 1.00 61.32 N ATOM 296 CA LEU A 21 -12.143 -13.976 -13.584 1.00 63.33 C ATOM 297 C LEU A 21 -13.435 -13.903 -14.392 1.00 11.05 C ATOM 298 O LEU A 21 -13.419 -13.576 -15.578 1.00 71.52 O ATOM 299 CB LEU A 21 -11.663 -15.425 -13.497 1.00 44.34 C ATOM 300 CG LEU A 21 -10.222 -15.627 -13.024 1.00 13.23 C ATOM 301 CD1 LEU A 21 -9.941 -17.103 -12.786 1.00 24.10 C ATOM 302 CD2 LEU A 21 -9.244 -15.052 -14.038 1.00 43.41 C ATOM 0 H LEU A 21 -12.170 -14.089 -11.489 1.00 61.32 H new ATOM 0 HA LEU A 21 -11.385 -13.379 -14.091 1.00 63.33 H new ATOM 0 HB2 LEU A 21 -12.325 -15.966 -12.822 1.00 44.34 H new ATOM 0 HB3 LEU A 21 -11.769 -15.882 -14.481 1.00 44.34 H new ATOM 0 HG LEU A 21 -10.090 -15.097 -12.081 1.00 13.23 H new ATOM 0 HD11 LEU A 21 -8.912 -17.228 -12.450 1.00 24.10 H new ATOM 0 HD12 LEU A 21 -10.620 -17.484 -12.024 1.00 24.10 H new ATOM 0 HD13 LEU A 21 -10.090 -17.656 -13.714 1.00 24.10 H new ATOM 0 HD21 LEU A 21 -8.224 -15.204 -13.686 1.00 43.41 H new ATOM 0 HD22 LEU A 21 -9.376 -15.554 -14.996 1.00 43.41 H new ATOM 0 HD23 LEU A 21 -9.431 -13.985 -14.159 1.00 43.41 H new ATOM 314 N ARG A 22 -14.552 -14.211 -13.741 1.00 53.55 N ATOM 315 CA ARG A 22 -15.853 -14.180 -14.398 1.00 21.01 C ATOM 316 C ARG A 22 -16.899 -13.523 -13.502 1.00 34.44 C ATOM 317 O ARG A 22 -16.740 -13.430 -12.286 1.00 41.34 O ATOM 318 CB ARG A 22 -16.297 -15.597 -14.764 1.00 22.21 C ATOM 319 CG ARG A 22 -16.101 -15.937 -16.232 1.00 21.11 C ATOM 320 CD ARG A 22 -17.310 -16.662 -16.803 1.00 73.44 C ATOM 321 NE ARG A 22 -16.924 -17.758 -17.687 1.00 73.43 N ATOM 322 CZ ARG A 22 -17.793 -18.603 -18.232 1.00 62.24 C ATOM 323 NH1 ARG A 22 -19.089 -18.477 -17.985 1.00 54.43 N ATOM 324 NH2 ARG A 22 -17.365 -19.575 -19.026 1.00 33.14 N ATOM 0 H ARG A 22 -14.582 -14.485 -12.759 1.00 53.55 H new ATOM 0 HA ARG A 22 -15.758 -13.590 -15.309 1.00 21.01 H new ATOM 0 HB2 ARG A 22 -15.740 -16.311 -14.157 1.00 22.21 H new ATOM 0 HB3 ARG A 22 -17.350 -15.716 -14.510 1.00 22.21 H new ATOM 0 HG2 ARG A 22 -15.923 -15.022 -16.798 1.00 21.11 H new ATOM 0 HG3 ARG A 22 -15.214 -16.560 -16.347 1.00 21.11 H new ATOM 0 HD2 ARG A 22 -17.918 -17.052 -15.986 1.00 73.44 H new ATOM 0 HD3 ARG A 22 -17.931 -15.954 -17.353 1.00 73.44 H new ATOM 0 HE ARG A 22 -15.934 -17.882 -17.898 1.00 73.43 H new ATOM 0 HH11 ARG A 22 -19.422 -17.730 -17.375 1.00 54.43 H new ATOM 0 HH12 ARG A 22 -19.754 -19.127 -18.405 1.00 54.43 H new ATOM 0 HH21 ARG A 22 -16.368 -19.674 -19.219 1.00 33.14 H new ATOM 0 HH22 ARG A 22 -18.032 -20.223 -19.444 1.00 33.14 H new ATOM 338 N PRO A 23 -17.996 -13.057 -14.118 1.00 71.15 N ATOM 339 CA PRO A 23 -19.090 -12.400 -13.396 1.00 20.21 C ATOM 340 C PRO A 23 -19.875 -13.373 -12.523 1.00 20.44 C ATOM 341 O PRO A 23 -20.360 -13.011 -11.453 1.00 72.34 O ATOM 342 CB PRO A 23 -19.977 -11.853 -14.517 1.00 50.25 C ATOM 343 CG PRO A 23 -19.697 -12.734 -15.685 1.00 74.22 C ATOM 344 CD PRO A 23 -18.253 -13.134 -15.566 1.00 41.22 C ATOM 0 HA PRO A 23 -18.724 -11.635 -12.711 1.00 20.21 H new ATOM 0 HB2 PRO A 23 -21.031 -11.886 -14.240 1.00 50.25 H new ATOM 0 HB3 PRO A 23 -19.738 -10.813 -14.739 1.00 50.25 H new ATOM 0 HG2 PRO A 23 -20.346 -13.610 -15.678 1.00 74.22 H new ATOM 0 HG3 PRO A 23 -19.880 -12.209 -16.622 1.00 74.22 H new ATOM 0 HD2 PRO A 23 -18.081 -14.139 -15.952 1.00 41.22 H new ATOM 0 HD3 PRO A 23 -17.602 -12.462 -16.126 1.00 41.22 H new ATOM 352 N GLY A 24 -19.994 -14.614 -12.988 1.00 12.43 N ATOM 353 CA GLY A 24 -20.721 -15.621 -12.236 1.00 62.24 C ATOM 354 C GLY A 24 -19.815 -16.714 -11.706 1.00 52.34 C ATOM 355 O GLY A 24 -20.122 -17.899 -11.829 1.00 74.21 O ATOM 0 H GLY A 24 -19.600 -14.939 -13.871 1.00 12.43 H new ATOM 0 HA2 GLY A 24 -21.237 -15.145 -11.402 1.00 62.24 H new ATOM 0 HA3 GLY A 24 -21.486 -16.064 -12.873 1.00 62.24 H new ATOM 359 N GLY A 25 -18.693 -16.315 -11.114 1.00 4.24 N ATOM 360 CA GLY A 25 -17.755 -17.283 -10.573 1.00 54.12 C ATOM 361 C GLY A 25 -17.301 -16.929 -9.172 1.00 54.45 C ATOM 362 O GLY A 25 -17.833 -16.005 -8.552 1.00 25.42 O ATOM 0 H GLY A 25 -18.417 -15.340 -10.999 1.00 4.24 H new ATOM 0 HA2 GLY A 25 -18.220 -18.269 -10.563 1.00 54.12 H new ATOM 0 HA3 GLY A 25 -16.886 -17.348 -11.228 1.00 54.12 H new ATOM 366 N LYS A 26 -16.316 -17.663 -8.667 1.00 31.12 N ATOM 367 CA LYS A 26 -15.789 -17.423 -7.329 1.00 15.24 C ATOM 368 C LYS A 26 -14.271 -17.567 -7.308 1.00 11.42 C ATOM 369 O LYS A 26 -13.702 -18.116 -6.363 1.00 53.13 O ATOM 370 CB LYS A 26 -16.419 -18.395 -6.328 1.00 42.10 C ATOM 371 CG LYS A 26 -16.687 -17.778 -4.967 1.00 4.31 C ATOM 372 CD LYS A 26 -18.068 -18.143 -4.451 1.00 35.20 C ATOM 373 CE LYS A 26 -18.207 -17.841 -2.967 1.00 73.25 C ATOM 374 NZ LYS A 26 -19.592 -18.089 -2.477 1.00 72.45 N ATOM 0 H LYS A 26 -15.866 -18.431 -9.165 1.00 31.12 H new ATOM 0 HA LYS A 26 -16.043 -16.402 -7.043 1.00 15.24 H new ATOM 0 HB2 LYS A 26 -17.357 -18.769 -6.739 1.00 42.10 H new ATOM 0 HB3 LYS A 26 -15.760 -19.254 -6.205 1.00 42.10 H new ATOM 0 HG2 LYS A 26 -15.932 -18.117 -4.258 1.00 4.31 H new ATOM 0 HG3 LYS A 26 -16.598 -16.694 -5.034 1.00 4.31 H new ATOM 0 HD2 LYS A 26 -18.824 -17.589 -5.008 1.00 35.20 H new ATOM 0 HD3 LYS A 26 -18.255 -19.202 -4.627 1.00 35.20 H new ATOM 0 HE2 LYS A 26 -17.507 -18.458 -2.404 1.00 73.25 H new ATOM 0 HE3 LYS A 26 -17.937 -16.801 -2.781 1.00 73.25 H new ATOM 0 HZ1 LYS A 26 -19.645 -17.871 -1.461 1.00 72.45 H new ATOM 0 HZ2 LYS A 26 -20.258 -17.482 -2.996 1.00 72.45 H new ATOM 0 HZ3 LYS A 26 -19.841 -19.087 -2.631 1.00 72.45 H new ATOM 388 N LYS A 27 -13.620 -17.071 -8.353 1.00 25.22 N ATOM 389 CA LYS A 27 -12.167 -17.142 -8.455 1.00 22.12 C ATOM 390 C LYS A 27 -11.576 -15.772 -8.773 1.00 24.43 C ATOM 391 O LYS A 27 -11.514 -15.369 -9.935 1.00 11.11 O ATOM 392 CB LYS A 27 -11.758 -18.149 -9.533 1.00 21.10 C ATOM 393 CG LYS A 27 -10.494 -18.921 -9.197 1.00 45.33 C ATOM 394 CD LYS A 27 -10.402 -20.214 -9.990 1.00 40.34 C ATOM 395 CE LYS A 27 -9.005 -20.425 -10.551 1.00 23.41 C ATOM 396 NZ LYS A 27 -8.830 -21.798 -11.102 1.00 61.01 N ATOM 0 H LYS A 27 -14.076 -16.614 -9.143 1.00 25.22 H new ATOM 0 HA LYS A 27 -11.777 -17.472 -7.492 1.00 22.12 H new ATOM 0 HB2 LYS A 27 -12.574 -18.855 -9.687 1.00 21.10 H new ATOM 0 HB3 LYS A 27 -11.611 -17.620 -10.475 1.00 21.10 H new ATOM 0 HG2 LYS A 27 -9.622 -18.302 -9.407 1.00 45.33 H new ATOM 0 HG3 LYS A 27 -10.476 -19.145 -8.130 1.00 45.33 H new ATOM 0 HD2 LYS A 27 -10.669 -21.055 -9.350 1.00 40.34 H new ATOM 0 HD3 LYS A 27 -11.124 -20.194 -10.806 1.00 40.34 H new ATOM 0 HE2 LYS A 27 -8.814 -19.692 -11.335 1.00 23.41 H new ATOM 0 HE3 LYS A 27 -8.269 -20.252 -9.766 1.00 23.41 H new ATOM 0 HZ1 LYS A 27 -8.069 -21.793 -11.811 1.00 61.01 H new ATOM 0 HZ2 LYS A 27 -8.583 -22.452 -10.332 1.00 61.01 H new ATOM 0 HZ3 LYS A 27 -9.716 -22.108 -11.549 1.00 61.01 H new ATOM 410 N GLN A 28 -11.142 -15.063 -7.737 1.00 2.45 N ATOM 411 CA GLN A 28 -10.555 -13.740 -7.908 1.00 40.12 C ATOM 412 C GLN A 28 -9.282 -13.813 -8.744 1.00 11.42 C ATOM 413 O GLN A 28 -8.761 -14.897 -9.006 1.00 72.40 O ATOM 414 CB GLN A 28 -10.250 -13.114 -6.546 1.00 53.52 C ATOM 415 CG GLN A 28 -11.389 -13.245 -5.547 1.00 20.42 C ATOM 416 CD GLN A 28 -11.112 -14.286 -4.480 1.00 40.33 C ATOM 417 OE1 GLN A 28 -10.314 -14.061 -3.569 1.00 61.45 O ATOM 418 NE2 GLN A 28 -11.772 -15.433 -4.585 1.00 62.32 N ATOM 0 H GLN A 28 -11.186 -15.383 -6.769 1.00 2.45 H new ATOM 0 HA GLN A 28 -11.277 -13.115 -8.433 1.00 40.12 H new ATOM 0 HB2 GLN A 28 -9.358 -13.584 -6.131 1.00 53.52 H new ATOM 0 HB3 GLN A 28 -10.019 -12.058 -6.684 1.00 53.52 H new ATOM 0 HG2 GLN A 28 -11.563 -12.280 -5.071 1.00 20.42 H new ATOM 0 HG3 GLN A 28 -12.304 -13.508 -6.077 1.00 20.42 H new ATOM 0 HE21 GLN A 28 -12.424 -15.577 -5.356 1.00 62.32 H new ATOM 0 HE22 GLN A 28 -11.627 -16.170 -3.895 1.00 62.32 H new ATOM 427 N TYR A 29 -8.785 -12.652 -9.158 1.00 33.13 N ATOM 428 CA TYR A 29 -7.574 -12.585 -9.967 1.00 4.34 C ATOM 429 C TYR A 29 -6.328 -12.626 -9.087 1.00 51.33 C ATOM 430 O TYR A 29 -6.339 -12.147 -7.952 1.00 21.31 O ATOM 431 CB TYR A 29 -7.572 -11.312 -10.814 1.00 32.20 C ATOM 432 CG TYR A 29 -7.998 -11.538 -12.247 1.00 72.35 C ATOM 433 CD1 TYR A 29 -7.121 -12.082 -13.177 1.00 4.33 C ATOM 434 CD2 TYR A 29 -9.278 -11.206 -12.673 1.00 52.11 C ATOM 435 CE1 TYR A 29 -7.505 -12.290 -14.487 1.00 22.22 C ATOM 436 CE2 TYR A 29 -9.673 -11.411 -13.981 1.00 41.04 C ATOM 437 CZ TYR A 29 -8.782 -11.953 -14.884 1.00 11.11 C ATOM 438 OH TYR A 29 -9.171 -12.158 -16.188 1.00 24.23 O ATOM 0 H TYR A 29 -9.202 -11.745 -8.947 1.00 33.13 H new ATOM 0 HA TYR A 29 -7.559 -13.453 -10.627 1.00 4.34 H new ATOM 0 HB2 TYR A 29 -8.238 -10.580 -10.357 1.00 32.20 H new ATOM 0 HB3 TYR A 29 -6.571 -10.881 -10.805 1.00 32.20 H new ATOM 0 HD1 TYR A 29 -6.120 -12.347 -12.870 1.00 4.33 H new ATOM 0 HD2 TYR A 29 -9.977 -10.780 -11.969 1.00 52.11 H new ATOM 0 HE1 TYR A 29 -6.810 -12.714 -15.196 1.00 22.22 H new ATOM 0 HE2 TYR A 29 -10.673 -11.149 -14.294 1.00 41.04 H new ATOM 0 HH TYR A 29 -10.110 -11.898 -16.294 1.00 24.23 H new ATOM 448 N LYS A 30 -5.255 -13.201 -9.618 1.00 72.43 N ATOM 449 CA LYS A 30 -3.999 -13.303 -8.884 1.00 23.31 C ATOM 450 C LYS A 30 -2.807 -13.206 -9.831 1.00 1.12 C ATOM 451 O LYS A 30 -2.957 -13.316 -11.049 1.00 21.11 O ATOM 452 CB LYS A 30 -3.944 -14.622 -8.110 1.00 61.45 C ATOM 453 CG LYS A 30 -3.521 -14.459 -6.660 1.00 62.33 C ATOM 454 CD LYS A 30 -2.815 -15.700 -6.142 1.00 25.22 C ATOM 455 CE LYS A 30 -3.781 -16.635 -5.432 1.00 11.42 C ATOM 456 NZ LYS A 30 -3.706 -16.489 -3.951 1.00 74.40 N ATOM 0 H LYS A 30 -5.230 -13.604 -10.555 1.00 72.43 H new ATOM 0 HA LYS A 30 -3.949 -12.473 -8.179 1.00 23.31 H new ATOM 0 HB2 LYS A 30 -4.926 -15.094 -8.142 1.00 61.45 H new ATOM 0 HB3 LYS A 30 -3.249 -15.298 -8.609 1.00 61.45 H new ATOM 0 HG2 LYS A 30 -2.859 -13.598 -6.568 1.00 62.33 H new ATOM 0 HG3 LYS A 30 -4.398 -14.255 -6.045 1.00 62.33 H new ATOM 0 HD2 LYS A 30 -2.343 -16.225 -6.973 1.00 25.22 H new ATOM 0 HD3 LYS A 30 -2.020 -15.408 -5.456 1.00 25.22 H new ATOM 0 HE2 LYS A 30 -4.798 -16.429 -5.766 1.00 11.42 H new ATOM 0 HE3 LYS A 30 -3.558 -17.666 -5.707 1.00 11.42 H new ATOM 0 HZ1 LYS A 30 -4.379 -17.143 -3.503 1.00 74.40 H new ATOM 0 HZ2 LYS A 30 -2.742 -16.710 -3.629 1.00 74.40 H new ATOM 0 HZ3 LYS A 30 -3.944 -15.512 -3.686 1.00 74.40 H new ATOM 470 N LEU A 31 -1.623 -13.002 -9.265 1.00 50.55 N ATOM 471 CA LEU A 31 -0.403 -12.892 -10.058 1.00 11.44 C ATOM 472 C LEU A 31 -0.263 -14.078 -11.007 1.00 43.32 C ATOM 473 O LEU A 31 0.314 -13.958 -12.088 1.00 42.24 O ATOM 474 CB LEU A 31 0.819 -12.808 -9.142 1.00 2.54 C ATOM 475 CG LEU A 31 1.740 -11.607 -9.359 1.00 13.04 C ATOM 476 CD1 LEU A 31 2.260 -11.586 -10.787 1.00 25.52 C ATOM 477 CD2 LEU A 31 1.012 -10.311 -9.035 1.00 32.25 C ATOM 0 H LEU A 31 -1.481 -12.909 -8.259 1.00 50.55 H new ATOM 0 HA LEU A 31 -0.465 -11.980 -10.652 1.00 11.44 H new ATOM 0 HB2 LEU A 31 0.473 -12.793 -8.109 1.00 2.54 H new ATOM 0 HB3 LEU A 31 1.406 -13.718 -9.268 1.00 2.54 H new ATOM 0 HG LEU A 31 2.592 -11.699 -8.685 1.00 13.04 H new ATOM 0 HD11 LEU A 31 2.914 -10.725 -10.924 1.00 25.52 H new ATOM 0 HD12 LEU A 31 2.819 -12.501 -10.984 1.00 25.52 H new ATOM 0 HD13 LEU A 31 1.421 -11.518 -11.479 1.00 25.52 H new ATOM 0 HD21 LEU A 31 1.683 -9.467 -9.195 1.00 32.25 H new ATOM 0 HD22 LEU A 31 0.142 -10.211 -9.683 1.00 32.25 H new ATOM 0 HD23 LEU A 31 0.689 -10.325 -7.994 1.00 32.25 H new ATOM 489 N LYS A 32 -0.795 -15.224 -10.596 1.00 1.11 N ATOM 490 CA LYS A 32 -0.732 -16.433 -11.409 1.00 73.30 C ATOM 491 C LYS A 32 -1.243 -16.165 -12.821 1.00 41.21 C ATOM 492 O LYS A 32 -0.715 -16.703 -13.796 1.00 51.52 O ATOM 493 CB LYS A 32 -1.553 -17.551 -10.762 1.00 33.11 C ATOM 494 CG LYS A 32 -0.969 -18.936 -10.977 1.00 33.13 C ATOM 495 CD LYS A 32 0.277 -19.154 -10.135 1.00 74.31 C ATOM 496 CE LYS A 32 0.978 -20.452 -10.504 1.00 63.25 C ATOM 497 NZ LYS A 32 2.071 -20.230 -11.491 1.00 4.03 N ATOM 0 H LYS A 32 -1.275 -15.341 -9.704 1.00 1.11 H new ATOM 0 HA LYS A 32 0.310 -16.746 -11.471 1.00 73.30 H new ATOM 0 HB2 LYS A 32 -1.631 -17.361 -9.692 1.00 33.11 H new ATOM 0 HB3 LYS A 32 -2.566 -17.526 -11.164 1.00 33.11 H new ATOM 0 HG2 LYS A 32 -1.715 -19.689 -10.725 1.00 33.13 H new ATOM 0 HG3 LYS A 32 -0.725 -19.069 -12.031 1.00 33.13 H new ATOM 0 HD2 LYS A 32 0.962 -18.317 -10.273 1.00 74.31 H new ATOM 0 HD3 LYS A 32 0.006 -19.173 -9.080 1.00 74.31 H new ATOM 0 HE2 LYS A 32 1.388 -20.912 -9.605 1.00 63.25 H new ATOM 0 HE3 LYS A 32 0.252 -21.152 -10.917 1.00 63.25 H new ATOM 0 HZ1 LYS A 32 2.524 -21.138 -11.717 1.00 4.03 H new ATOM 0 HZ2 LYS A 32 1.676 -19.815 -12.359 1.00 4.03 H new ATOM 0 HZ3 LYS A 32 2.777 -19.582 -11.087 1.00 4.03 H new ATOM 511 N HIS A 33 -2.273 -15.330 -12.925 1.00 44.21 N ATOM 512 CA HIS A 33 -2.853 -14.989 -14.219 1.00 53.15 C ATOM 513 C HIS A 33 -1.982 -13.975 -14.954 1.00 62.43 C ATOM 514 O HIS A 33 -1.923 -14.064 -16.181 1.00 71.33 O ATOM 515 CB HIS A 33 -4.265 -14.428 -14.037 1.00 25.23 C ATOM 516 CG HIS A 33 -5.120 -15.249 -13.121 1.00 51.44 C ATOM 517 ND1 HIS A 33 -5.847 -14.704 -12.083 1.00 33.02 N ATOM 518 CD2 HIS A 33 -5.363 -16.579 -13.092 1.00 52.41 C ATOM 519 CE1 HIS A 33 -6.500 -15.666 -11.455 1.00 62.32 C ATOM 520 NE2 HIS A 33 -6.224 -16.814 -12.048 1.00 11.32 N ATOM 0 H HIS A 33 -2.722 -14.878 -12.129 1.00 44.21 H new ATOM 0 HA HIS A 33 -2.905 -15.899 -14.817 1.00 53.15 H new ATOM 0 HB2 HIS A 33 -4.197 -13.413 -13.645 1.00 25.23 H new ATOM 0 HB3 HIS A 33 -4.749 -14.362 -15.011 1.00 25.23 H new ATOM 0 HD2 HIS A 33 -4.956 -17.319 -13.765 1.00 52.41 H new ATOM 0 HE1 HIS A 33 -7.149 -15.536 -10.602 1.00 62.32 H new ATOM 0 HE2 HIS A 33 -6.591 -17.726 -11.775 1.00 11.32 H new ATOM 528 N ILE A 34 -1.329 -13.047 -14.264 1.00 45.34 N ATOM 529 CA ILE A 34 -0.484 -12.058 -14.922 1.00 70.43 C ATOM 530 C ILE A 34 0.748 -12.712 -15.542 1.00 54.04 C ATOM 531 O ILE A 34 1.197 -12.318 -16.617 1.00 65.32 O ATOM 532 CB ILE A 34 -0.030 -10.961 -13.941 1.00 31.53 C ATOM 533 CG1 ILE A 34 -1.234 -10.393 -13.186 1.00 42.23 C ATOM 534 CG2 ILE A 34 0.705 -9.856 -14.685 1.00 22.02 C ATOM 535 CD1 ILE A 34 -0.861 -9.360 -12.145 1.00 3.35 C ATOM 0 H ILE A 34 -1.369 -12.959 -13.249 1.00 45.34 H new ATOM 0 HA ILE A 34 -1.086 -11.603 -15.708 1.00 70.43 H new ATOM 0 HB ILE A 34 0.655 -11.402 -13.217 1.00 31.53 H new ATOM 0 HG12 ILE A 34 -1.923 -9.944 -13.902 1.00 42.23 H new ATOM 0 HG13 ILE A 34 -1.767 -11.210 -12.701 1.00 42.23 H new ATOM 0 HG21 ILE A 34 1.019 -9.088 -13.978 1.00 22.02 H new ATOM 0 HG22 ILE A 34 1.581 -10.272 -15.182 1.00 22.02 H new ATOM 0 HG23 ILE A 34 0.042 -9.415 -15.429 1.00 22.02 H new ATOM 0 HD11 ILE A 34 -1.763 -9.001 -11.649 1.00 3.35 H new ATOM 0 HD12 ILE A 34 -0.196 -9.810 -11.408 1.00 3.35 H new ATOM 0 HD13 ILE A 34 -0.355 -8.524 -12.627 1.00 3.35 H new ATOM 547 N VAL A 35 1.287 -13.713 -14.855 1.00 13.31 N ATOM 548 CA VAL A 35 2.464 -14.424 -15.338 1.00 43.13 C ATOM 549 C VAL A 35 2.090 -15.446 -16.405 1.00 64.25 C ATOM 550 O VAL A 35 2.823 -15.642 -17.376 1.00 55.41 O ATOM 551 CB VAL A 35 3.197 -15.144 -14.189 1.00 62.54 C ATOM 552 CG1 VAL A 35 4.403 -15.904 -14.718 1.00 25.31 C ATOM 553 CG2 VAL A 35 3.613 -14.147 -13.117 1.00 1.44 C ATOM 0 H VAL A 35 0.927 -14.050 -13.962 1.00 13.31 H new ATOM 0 HA VAL A 35 3.128 -13.676 -15.771 1.00 43.13 H new ATOM 0 HB VAL A 35 2.513 -15.864 -13.739 1.00 62.54 H new ATOM 0 HG11 VAL A 35 4.908 -16.406 -13.892 1.00 25.31 H new ATOM 0 HG12 VAL A 35 4.075 -16.645 -15.447 1.00 25.31 H new ATOM 0 HG13 VAL A 35 5.092 -15.207 -15.194 1.00 25.31 H new ATOM 0 HG21 VAL A 35 4.129 -14.672 -12.313 1.00 1.44 H new ATOM 0 HG22 VAL A 35 4.280 -13.403 -13.552 1.00 1.44 H new ATOM 0 HG23 VAL A 35 2.728 -13.652 -12.718 1.00 1.44 H new ATOM 563 N TRP A 36 0.946 -16.093 -16.221 1.00 12.34 N ATOM 564 CA TRP A 36 0.473 -17.096 -17.169 1.00 1.14 C ATOM 565 C TRP A 36 0.363 -16.509 -18.571 1.00 13.02 C ATOM 566 O TRP A 36 0.657 -17.181 -19.560 1.00 50.44 O ATOM 567 CB TRP A 36 -0.883 -17.648 -16.725 1.00 40.21 C ATOM 568 CG TRP A 36 -1.485 -18.604 -17.710 1.00 4.54 C ATOM 569 CD1 TRP A 36 -1.448 -19.969 -17.655 1.00 43.21 C ATOM 570 CD2 TRP A 36 -2.213 -18.269 -18.895 1.00 74.01 C ATOM 571 NE1 TRP A 36 -2.108 -20.501 -18.735 1.00 33.44 N ATOM 572 CE2 TRP A 36 -2.588 -19.480 -19.511 1.00 62.45 C ATOM 573 CE3 TRP A 36 -2.587 -17.064 -19.496 1.00 24.23 C ATOM 574 CZ2 TRP A 36 -3.316 -19.517 -20.697 1.00 64.15 C ATOM 575 CZ3 TRP A 36 -3.309 -17.103 -20.674 1.00 13.24 C ATOM 576 CH2 TRP A 36 -3.668 -18.322 -21.263 1.00 35.41 C ATOM 0 H TRP A 36 0.328 -15.942 -15.424 1.00 12.34 H new ATOM 0 HA TRP A 36 1.198 -17.910 -17.192 1.00 1.14 H new ATOM 0 HB2 TRP A 36 -0.766 -18.152 -15.765 1.00 40.21 H new ATOM 0 HB3 TRP A 36 -1.572 -16.818 -16.567 1.00 40.21 H new ATOM 0 HD1 TRP A 36 -0.970 -20.545 -16.876 1.00 43.21 H new ATOM 0 HE1 TRP A 36 -2.222 -21.496 -18.928 1.00 33.44 H new ATOM 0 HE3 TRP A 36 -2.317 -16.119 -19.048 1.00 24.23 H new ATOM 0 HZ2 TRP A 36 -3.593 -20.455 -21.154 1.00 64.15 H new ATOM 0 HZ3 TRP A 36 -3.601 -16.178 -21.148 1.00 13.24 H new ATOM 0 HH2 TRP A 36 -4.234 -18.319 -22.183 1.00 35.41 H new ATOM 587 N ALA A 37 -0.063 -15.252 -18.650 1.00 20.23 N ATOM 588 CA ALA A 37 -0.210 -14.575 -19.932 1.00 23.34 C ATOM 589 C ALA A 37 1.151 -14.279 -20.556 1.00 33.45 C ATOM 590 O ALA A 37 1.355 -14.492 -21.751 1.00 22.31 O ATOM 591 CB ALA A 37 -1.005 -13.289 -19.762 1.00 64.11 C ATOM 0 H ALA A 37 -0.312 -14.683 -17.841 1.00 20.23 H new ATOM 0 HA ALA A 37 -0.753 -15.239 -20.605 1.00 23.34 H new ATOM 0 HB1 ALA A 37 -1.107 -12.794 -20.728 1.00 64.11 H new ATOM 0 HB2 ALA A 37 -1.994 -13.522 -19.368 1.00 64.11 H new ATOM 0 HB3 ALA A 37 -0.484 -12.628 -19.069 1.00 64.11 H new ATOM 597 N SER A 38 2.076 -13.787 -19.739 1.00 24.34 N ATOM 598 CA SER A 38 3.417 -13.458 -20.212 1.00 34.22 C ATOM 599 C SER A 38 4.065 -14.663 -20.889 1.00 52.12 C ATOM 600 O SER A 38 4.743 -14.526 -21.907 1.00 71.33 O ATOM 601 CB SER A 38 4.288 -12.982 -19.049 1.00 62.11 C ATOM 602 OG SER A 38 4.172 -11.581 -18.866 1.00 62.21 O ATOM 0 H SER A 38 1.923 -13.607 -18.747 1.00 24.34 H new ATOM 0 HA SER A 38 3.331 -12.655 -20.944 1.00 34.22 H new ATOM 0 HB2 SER A 38 3.993 -13.497 -18.135 1.00 62.11 H new ATOM 0 HB3 SER A 38 5.329 -13.242 -19.240 1.00 62.11 H new ATOM 0 HG SER A 38 4.737 -11.301 -18.116 1.00 62.21 H new ATOM 608 N ARG A 39 3.851 -15.842 -20.314 1.00 22.40 N ATOM 609 CA ARG A 39 4.415 -17.070 -20.859 1.00 25.15 C ATOM 610 C ARG A 39 3.781 -17.410 -22.205 1.00 53.20 C ATOM 611 O ARG A 39 4.423 -17.998 -23.074 1.00 41.30 O ATOM 612 CB ARG A 39 4.211 -18.228 -19.881 1.00 23.03 C ATOM 613 CG ARG A 39 5.310 -19.277 -19.940 1.00 25.42 C ATOM 614 CD ARG A 39 4.881 -20.573 -19.270 1.00 65.14 C ATOM 615 NE ARG A 39 5.860 -21.639 -19.464 1.00 4.44 N ATOM 616 CZ ARG A 39 5.802 -22.812 -18.842 1.00 73.33 C ATOM 617 NH1 ARG A 39 4.818 -23.067 -17.991 1.00 33.11 N ATOM 618 NH2 ARG A 39 6.731 -23.732 -19.070 1.00 31.42 N ATOM 0 H ARG A 39 3.291 -15.972 -19.471 1.00 22.40 H new ATOM 0 HA ARG A 39 5.483 -16.913 -21.009 1.00 25.15 H new ATOM 0 HB2 ARG A 39 4.154 -17.831 -18.868 1.00 23.03 H new ATOM 0 HB3 ARG A 39 3.254 -18.705 -20.091 1.00 23.03 H new ATOM 0 HG2 ARG A 39 5.572 -19.473 -20.980 1.00 25.42 H new ATOM 0 HG3 ARG A 39 6.207 -18.894 -19.453 1.00 25.42 H new ATOM 0 HD2 ARG A 39 4.740 -20.400 -18.203 1.00 65.14 H new ATOM 0 HD3 ARG A 39 3.918 -20.888 -19.672 1.00 65.14 H new ATOM 0 HE ARG A 39 6.630 -21.474 -20.112 1.00 4.44 H new ATOM 0 HH11 ARG A 39 4.103 -22.362 -17.812 1.00 33.11 H new ATOM 0 HH12 ARG A 39 4.776 -23.968 -17.515 1.00 33.11 H new ATOM 0 HH21 ARG A 39 7.490 -23.539 -19.723 1.00 31.42 H new ATOM 0 HH22 ARG A 39 6.686 -24.632 -18.592 1.00 31.42 H new ATOM 632 N GLU A 40 2.516 -17.035 -22.369 1.00 12.32 N ATOM 633 CA GLU A 40 1.794 -17.301 -23.608 1.00 2.25 C ATOM 634 C GLU A 40 2.112 -16.243 -24.660 1.00 4.55 C ATOM 635 O GLU A 40 2.032 -16.502 -25.862 1.00 12.53 O ATOM 636 CB GLU A 40 0.287 -17.341 -23.348 1.00 31.21 C ATOM 637 CG GLU A 40 -0.444 -18.394 -24.164 1.00 43.10 C ATOM 638 CD GLU A 40 -0.518 -19.733 -23.456 1.00 14.14 C ATOM 639 OE1 GLU A 40 0.520 -20.423 -23.380 1.00 64.34 O ATOM 640 OE2 GLU A 40 -1.615 -20.091 -22.978 1.00 24.12 O ATOM 0 H GLU A 40 1.970 -16.546 -21.659 1.00 12.32 H new ATOM 0 HA GLU A 40 2.116 -18.272 -23.985 1.00 2.25 H new ATOM 0 HB2 GLU A 40 0.115 -17.530 -22.288 1.00 31.21 H new ATOM 0 HB3 GLU A 40 -0.138 -16.362 -23.570 1.00 31.21 H new ATOM 0 HG2 GLU A 40 -1.454 -18.045 -24.380 1.00 43.10 H new ATOM 0 HG3 GLU A 40 0.061 -18.521 -25.122 1.00 43.10 H new ATOM 647 N LEU A 41 2.474 -15.050 -24.201 1.00 52.21 N ATOM 648 CA LEU A 41 2.804 -13.951 -25.102 1.00 54.51 C ATOM 649 C LEU A 41 4.090 -14.243 -25.868 1.00 50.40 C ATOM 650 O LEU A 41 4.134 -14.127 -27.092 1.00 34.41 O ATOM 651 CB LEU A 41 2.950 -12.647 -24.315 1.00 1.41 C ATOM 652 CG LEU A 41 1.649 -12.006 -23.831 1.00 71.52 C ATOM 653 CD1 LEU A 41 1.938 -10.918 -22.809 1.00 63.40 C ATOM 654 CD2 LEU A 41 0.864 -11.441 -25.006 1.00 30.54 C ATOM 0 H LEU A 41 2.546 -14.819 -23.210 1.00 52.21 H new ATOM 0 HA LEU A 41 1.991 -13.845 -25.820 1.00 54.51 H new ATOM 0 HB2 LEU A 41 3.582 -12.838 -23.448 1.00 1.41 H new ATOM 0 HB3 LEU A 41 3.476 -11.926 -24.940 1.00 1.41 H new ATOM 0 HG LEU A 41 1.044 -12.775 -23.351 1.00 71.52 H new ATOM 0 HD11 LEU A 41 1.000 -10.473 -22.476 1.00 63.40 H new ATOM 0 HD12 LEU A 41 2.458 -11.351 -21.954 1.00 63.40 H new ATOM 0 HD13 LEU A 41 2.563 -10.149 -23.263 1.00 63.40 H new ATOM 0 HD21 LEU A 41 -0.059 -10.989 -24.643 1.00 30.54 H new ATOM 0 HD22 LEU A 41 1.463 -10.685 -25.514 1.00 30.54 H new ATOM 0 HD23 LEU A 41 0.625 -12.244 -25.703 1.00 30.54 H new ATOM 666 N GLU A 42 5.134 -14.624 -25.139 1.00 52.25 N ATOM 667 CA GLU A 42 6.421 -14.934 -25.751 1.00 73.11 C ATOM 668 C GLU A 42 6.267 -16.004 -26.827 1.00 64.42 C ATOM 669 O GLU A 42 7.064 -16.076 -27.764 1.00 14.14 O ATOM 670 CB GLU A 42 7.416 -15.402 -24.688 1.00 4.45 C ATOM 671 CG GLU A 42 8.489 -14.377 -24.364 1.00 65.45 C ATOM 672 CD GLU A 42 9.892 -14.910 -24.579 1.00 32.05 C ATOM 673 OE1 GLU A 42 10.385 -15.654 -23.705 1.00 43.30 O ATOM 674 OE2 GLU A 42 10.497 -14.587 -25.623 1.00 73.14 O ATOM 0 H GLU A 42 5.114 -14.725 -24.124 1.00 52.25 H new ATOM 0 HA GLU A 42 6.801 -14.026 -26.219 1.00 73.11 H new ATOM 0 HB2 GLU A 42 6.872 -15.646 -23.776 1.00 4.45 H new ATOM 0 HB3 GLU A 42 7.894 -16.320 -25.029 1.00 4.45 H new ATOM 0 HG2 GLU A 42 8.341 -13.494 -24.985 1.00 65.45 H new ATOM 0 HG3 GLU A 42 8.381 -14.059 -23.327 1.00 65.45 H new ATOM 681 N ARG A 43 5.238 -16.833 -26.687 1.00 52.45 N ATOM 682 CA ARG A 43 4.980 -17.901 -27.646 1.00 45.31 C ATOM 683 C ARG A 43 4.469 -17.333 -28.966 1.00 33.24 C ATOM 684 O ARG A 43 4.660 -17.930 -30.026 1.00 24.23 O ATOM 685 CB ARG A 43 3.965 -18.893 -27.076 1.00 52.23 C ATOM 686 CG ARG A 43 3.751 -20.116 -27.952 1.00 12.12 C ATOM 687 CD ARG A 43 3.328 -21.323 -27.129 1.00 64.15 C ATOM 688 NE ARG A 43 3.311 -22.549 -27.924 1.00 54.14 N ATOM 689 CZ ARG A 43 2.797 -23.696 -27.493 1.00 31.31 C ATOM 690 NH1 ARG A 43 2.262 -23.774 -26.283 1.00 32.43 N ATOM 691 NH2 ARG A 43 2.818 -24.768 -28.275 1.00 72.24 N ATOM 0 H ARG A 43 4.569 -16.786 -25.919 1.00 52.45 H new ATOM 0 HA ARG A 43 5.919 -18.422 -27.834 1.00 45.31 H new ATOM 0 HB2 ARG A 43 4.300 -19.217 -26.090 1.00 52.23 H new ATOM 0 HB3 ARG A 43 3.011 -18.384 -26.937 1.00 52.23 H new ATOM 0 HG2 ARG A 43 2.989 -19.900 -28.701 1.00 12.12 H new ATOM 0 HG3 ARG A 43 4.671 -20.345 -28.490 1.00 12.12 H new ATOM 0 HD2 ARG A 43 4.011 -21.446 -26.288 1.00 64.15 H new ATOM 0 HD3 ARG A 43 2.336 -21.148 -26.712 1.00 64.15 H new ATOM 0 HE ARG A 43 3.715 -22.523 -28.860 1.00 54.14 H new ATOM 0 HH11 ARG A 43 2.244 -22.952 -25.679 1.00 32.43 H new ATOM 0 HH12 ARG A 43 1.868 -24.656 -25.955 1.00 32.43 H new ATOM 0 HH21 ARG A 43 3.229 -24.711 -29.207 1.00 72.24 H new ATOM 0 HH22 ARG A 43 2.423 -25.648 -27.944 1.00 72.24 H new ATOM 705 N PHE A 44 3.815 -16.179 -28.895 1.00 42.43 N ATOM 706 CA PHE A 44 3.275 -15.531 -30.085 1.00 14.43 C ATOM 707 C PHE A 44 4.242 -14.480 -30.619 1.00 71.33 C ATOM 708 O PHE A 44 3.834 -13.519 -31.270 1.00 33.42 O ATOM 709 CB PHE A 44 1.924 -14.884 -29.769 1.00 2.23 C ATOM 710 CG PHE A 44 0.849 -15.876 -29.430 1.00 12.21 C ATOM 711 CD1 PHE A 44 0.399 -16.782 -30.377 1.00 11.41 C ATOM 712 CD2 PHE A 44 0.288 -15.903 -28.163 1.00 35.43 C ATOM 713 CE1 PHE A 44 -0.591 -17.695 -30.068 1.00 41.42 C ATOM 714 CE2 PHE A 44 -0.702 -16.815 -27.847 1.00 73.14 C ATOM 715 CZ PHE A 44 -1.141 -17.713 -28.801 1.00 74.31 C ATOM 0 H PHE A 44 3.646 -15.673 -28.026 1.00 42.43 H new ATOM 0 HA PHE A 44 3.136 -16.293 -30.852 1.00 14.43 H new ATOM 0 HB2 PHE A 44 2.047 -14.194 -28.934 1.00 2.23 H new ATOM 0 HB3 PHE A 44 1.604 -14.292 -30.627 1.00 2.23 H new ATOM 0 HD1 PHE A 44 0.827 -16.774 -31.368 1.00 11.41 H new ATOM 0 HD2 PHE A 44 0.628 -15.203 -27.414 1.00 35.43 H new ATOM 0 HE1 PHE A 44 -0.934 -18.394 -30.816 1.00 41.42 H new ATOM 0 HE2 PHE A 44 -1.131 -16.825 -26.856 1.00 73.14 H new ATOM 0 HZ PHE A 44 -1.913 -18.428 -28.556 1.00 74.31 H new ATOM 725 N ALA A 45 5.528 -14.670 -30.339 1.00 53.51 N ATOM 726 CA ALA A 45 6.554 -13.740 -30.793 1.00 12.44 C ATOM 727 C ALA A 45 6.363 -12.363 -30.166 1.00 53.30 C ATOM 728 O ALA A 45 6.856 -11.361 -30.683 1.00 61.15 O ATOM 729 CB ALA A 45 6.540 -13.638 -32.311 1.00 54.44 C ATOM 0 H ALA A 45 5.883 -15.460 -29.800 1.00 53.51 H new ATOM 0 HA ALA A 45 7.523 -14.124 -30.475 1.00 12.44 H new ATOM 0 HB1 ALA A 45 7.311 -12.940 -32.636 1.00 54.44 H new ATOM 0 HB2 ALA A 45 6.733 -14.620 -32.743 1.00 54.44 H new ATOM 0 HB3 ALA A 45 5.565 -13.281 -32.643 1.00 54.44 H new ATOM 735 N VAL A 46 5.643 -12.321 -29.050 1.00 40.42 N ATOM 736 CA VAL A 46 5.387 -11.066 -28.352 1.00 60.32 C ATOM 737 C VAL A 46 5.988 -11.083 -26.951 1.00 12.43 C ATOM 738 O VAL A 46 5.729 -11.994 -26.165 1.00 54.33 O ATOM 739 CB VAL A 46 3.877 -10.780 -28.248 1.00 53.12 C ATOM 740 CG1 VAL A 46 3.629 -9.493 -27.476 1.00 42.41 C ATOM 741 CG2 VAL A 46 3.251 -10.709 -29.633 1.00 44.12 C ATOM 0 H VAL A 46 5.226 -13.141 -28.609 1.00 40.42 H new ATOM 0 HA VAL A 46 5.860 -10.277 -28.937 1.00 60.32 H new ATOM 0 HB VAL A 46 3.407 -11.599 -27.703 1.00 53.12 H new ATOM 0 HG11 VAL A 46 2.557 -9.307 -27.413 1.00 42.41 H new ATOM 0 HG12 VAL A 46 4.041 -9.586 -26.471 1.00 42.41 H new ATOM 0 HG13 VAL A 46 4.111 -8.662 -27.990 1.00 42.41 H new ATOM 0 HG21 VAL A 46 2.184 -10.506 -29.540 1.00 44.12 H new ATOM 0 HG22 VAL A 46 3.724 -9.911 -30.205 1.00 44.12 H new ATOM 0 HG23 VAL A 46 3.396 -11.659 -30.147 1.00 44.12 H new ATOM 751 N ASN A 47 6.790 -10.070 -26.645 1.00 45.23 N ATOM 752 CA ASN A 47 7.429 -9.969 -25.337 1.00 50.12 C ATOM 753 C ASN A 47 6.392 -9.743 -24.242 1.00 1.22 C ATOM 754 O ASN A 47 5.391 -9.053 -24.433 1.00 31.30 O ATOM 755 CB ASN A 47 8.449 -8.830 -25.331 1.00 63.45 C ATOM 756 CG ASN A 47 9.728 -9.194 -26.061 1.00 62.42 C ATOM 757 OD1 ASN A 47 9.992 -10.368 -26.326 1.00 71.32 O ATOM 758 ND2 ASN A 47 10.530 -8.188 -26.390 1.00 74.13 N ATOM 0 H ASN A 47 7.014 -9.307 -27.284 1.00 45.23 H new ATOM 0 HA ASN A 47 7.943 -10.909 -25.138 1.00 50.12 H new ATOM 0 HB2 ASN A 47 8.007 -7.948 -25.795 1.00 63.45 H new ATOM 0 HB3 ASN A 47 8.685 -8.563 -24.301 1.00 63.45 H new ATOM 0 HD21 ASN A 47 11.404 -8.373 -26.882 1.00 74.13 H new ATOM 0 HD22 ASN A 47 10.272 -7.231 -26.151 1.00 74.13 H new ATOM 765 N PRO A 48 6.635 -10.338 -23.064 1.00 22.34 N ATOM 766 CA PRO A 48 5.735 -10.216 -21.914 1.00 31.31 C ATOM 767 C PRO A 48 5.744 -8.813 -21.317 1.00 73.44 C ATOM 768 O PRO A 48 4.934 -8.492 -20.448 1.00 1.00 O ATOM 769 CB PRO A 48 6.300 -11.226 -20.912 1.00 22.21 C ATOM 770 CG PRO A 48 7.740 -11.354 -21.274 1.00 53.01 C ATOM 771 CD PRO A 48 7.809 -11.175 -22.765 1.00 24.14 C ATOM 0 HA PRO A 48 4.697 -10.402 -22.188 1.00 31.31 H new ATOM 0 HB2 PRO A 48 6.179 -10.876 -19.887 1.00 22.21 H new ATOM 0 HB3 PRO A 48 5.787 -12.185 -20.984 1.00 22.21 H new ATOM 0 HG2 PRO A 48 8.340 -10.601 -20.762 1.00 53.01 H new ATOM 0 HG3 PRO A 48 8.132 -12.328 -20.979 1.00 53.01 H new ATOM 0 HD2 PRO A 48 8.736 -10.689 -23.069 1.00 24.14 H new ATOM 0 HD3 PRO A 48 7.764 -12.131 -23.287 1.00 24.14 H new ATOM 779 N GLY A 49 6.665 -7.978 -21.792 1.00 15.12 N ATOM 780 CA GLY A 49 6.761 -6.619 -21.294 1.00 51.13 C ATOM 781 C GLY A 49 5.781 -5.682 -21.973 1.00 42.11 C ATOM 782 O GLY A 49 5.872 -4.463 -21.824 1.00 71.20 O ATOM 0 H GLY A 49 7.345 -8.219 -22.512 1.00 15.12 H new ATOM 0 HA2 GLY A 49 6.578 -6.615 -20.220 1.00 51.13 H new ATOM 0 HA3 GLY A 49 7.776 -6.251 -21.445 1.00 51.13 H new ATOM 786 N LEU A 50 4.842 -6.251 -22.720 1.00 31.24 N ATOM 787 CA LEU A 50 3.842 -5.459 -23.427 1.00 21.02 C ATOM 788 C LEU A 50 2.511 -5.470 -22.679 1.00 23.44 C ATOM 789 O LEU A 50 1.452 -5.272 -23.275 1.00 54.44 O ATOM 790 CB LEU A 50 3.647 -5.994 -24.846 1.00 0.13 C ATOM 791 CG LEU A 50 4.892 -6.009 -25.734 1.00 32.54 C ATOM 792 CD1 LEU A 50 4.533 -6.442 -27.148 1.00 3.02 C ATOM 793 CD2 LEU A 50 5.554 -4.639 -25.746 1.00 25.35 C ATOM 0 H LEU A 50 4.752 -7.258 -22.852 1.00 31.24 H new ATOM 0 HA LEU A 50 4.200 -4.431 -23.480 1.00 21.02 H new ATOM 0 HB2 LEU A 50 3.260 -7.011 -24.780 1.00 0.13 H new ATOM 0 HB3 LEU A 50 2.882 -5.393 -25.337 1.00 0.13 H new ATOM 0 HG LEU A 50 5.600 -6.729 -25.324 1.00 32.54 H new ATOM 0 HD11 LEU A 50 5.431 -6.447 -27.766 1.00 3.02 H new ATOM 0 HD12 LEU A 50 4.104 -7.444 -27.124 1.00 3.02 H new ATOM 0 HD13 LEU A 50 3.807 -5.746 -27.568 1.00 3.02 H new ATOM 0 HD21 LEU A 50 6.438 -4.668 -26.383 1.00 25.35 H new ATOM 0 HD22 LEU A 50 4.853 -3.899 -26.132 1.00 25.35 H new ATOM 0 HD23 LEU A 50 5.846 -4.367 -24.732 1.00 25.35 H new ATOM 805 N LEU A 51 2.575 -5.701 -21.373 1.00 32.32 N ATOM 806 CA LEU A 51 1.375 -5.735 -20.543 1.00 3.22 C ATOM 807 C LEU A 51 1.398 -4.617 -19.507 1.00 63.14 C ATOM 808 O LEU A 51 0.351 -4.166 -19.045 1.00 52.03 O ATOM 809 CB LEU A 51 1.254 -7.091 -19.845 1.00 70.01 C ATOM 810 CG LEU A 51 1.358 -8.322 -20.746 1.00 24.14 C ATOM 811 CD1 LEU A 51 1.631 -9.568 -19.918 1.00 44.43 C ATOM 812 CD2 LEU A 51 0.088 -8.492 -21.566 1.00 2.13 C ATOM 0 H LEU A 51 3.444 -5.868 -20.865 1.00 32.32 H new ATOM 0 HA LEU A 51 0.510 -5.587 -21.190 1.00 3.22 H new ATOM 0 HB2 LEU A 51 2.032 -7.156 -19.084 1.00 70.01 H new ATOM 0 HB3 LEU A 51 0.296 -7.126 -19.326 1.00 70.01 H new ATOM 0 HG LEU A 51 2.192 -8.177 -21.432 1.00 24.14 H new ATOM 0 HD11 LEU A 51 1.702 -10.434 -20.576 1.00 44.43 H new ATOM 0 HD12 LEU A 51 2.569 -9.446 -19.376 1.00 44.43 H new ATOM 0 HD13 LEU A 51 0.818 -9.718 -19.207 1.00 44.43 H new ATOM 0 HD21 LEU A 51 0.180 -9.373 -22.201 1.00 2.13 H new ATOM 0 HD22 LEU A 51 -0.764 -8.615 -20.897 1.00 2.13 H new ATOM 0 HD23 LEU A 51 -0.064 -7.610 -22.188 1.00 2.13 H new ATOM 824 N GLU A 52 2.599 -4.173 -19.148 1.00 31.31 N ATOM 825 CA GLU A 52 2.757 -3.106 -18.167 1.00 52.22 C ATOM 826 C GLU A 52 2.415 -1.751 -18.778 1.00 55.25 C ATOM 827 O GLU A 52 2.367 -0.736 -18.081 1.00 31.34 O ATOM 828 CB GLU A 52 4.188 -3.088 -17.627 1.00 51.23 C ATOM 829 CG GLU A 52 5.208 -2.565 -18.624 1.00 41.22 C ATOM 830 CD GLU A 52 6.548 -3.266 -18.510 1.00 64.22 C ATOM 831 OE1 GLU A 52 6.577 -4.511 -18.605 1.00 42.21 O ATOM 832 OE2 GLU A 52 7.569 -2.569 -18.326 1.00 35.04 O ATOM 0 H GLU A 52 3.476 -4.536 -19.522 1.00 31.31 H new ATOM 0 HA GLU A 52 2.068 -3.298 -17.344 1.00 52.22 H new ATOM 0 HB2 GLU A 52 4.221 -2.471 -16.729 1.00 51.23 H new ATOM 0 HB3 GLU A 52 4.468 -4.099 -17.330 1.00 51.23 H new ATOM 0 HG2 GLU A 52 4.821 -2.692 -19.635 1.00 41.22 H new ATOM 0 HG3 GLU A 52 5.347 -1.495 -18.468 1.00 41.22 H new ATOM 839 N THR A 53 2.176 -1.741 -20.086 1.00 63.32 N ATOM 840 CA THR A 53 1.840 -0.511 -20.793 1.00 45.45 C ATOM 841 C THR A 53 0.468 -0.611 -21.447 1.00 34.34 C ATOM 842 O THR A 53 0.169 -1.584 -22.140 1.00 11.42 O ATOM 843 CB THR A 53 2.888 -0.178 -21.871 1.00 2.01 C ATOM 844 OG1 THR A 53 2.749 -1.073 -22.981 1.00 72.13 O ATOM 845 CG2 THR A 53 4.297 -0.278 -21.307 1.00 11.42 C ATOM 0 H THR A 53 2.209 -2.571 -20.677 1.00 63.32 H new ATOM 0 HA THR A 53 1.828 0.287 -20.051 1.00 45.45 H new ATOM 0 HB THR A 53 2.720 0.846 -22.205 1.00 2.01 H new ATOM 0 HG1 THR A 53 3.418 -0.854 -23.663 1.00 72.13 H new ATOM 0 HG21 THR A 53 5.019 -0.038 -22.087 1.00 11.42 H new ATOM 0 HG22 THR A 53 4.409 0.424 -20.481 1.00 11.42 H new ATOM 0 HG23 THR A 53 4.474 -1.292 -20.948 1.00 11.42 H new ATOM 853 N SER A 54 -0.364 0.402 -21.225 1.00 55.12 N ATOM 854 CA SER A 54 -1.708 0.427 -21.792 1.00 4.54 C ATOM 855 C SER A 54 -1.661 0.267 -23.308 1.00 61.10 C ATOM 856 O SER A 54 -2.614 -0.209 -23.923 1.00 14.42 O ATOM 857 CB SER A 54 -2.415 1.733 -21.426 1.00 31.03 C ATOM 858 OG SER A 54 -3.748 1.491 -21.008 1.00 20.21 O ATOM 0 H SER A 54 -0.131 1.216 -20.657 1.00 55.12 H new ATOM 0 HA SER A 54 -2.268 -0.409 -21.374 1.00 4.54 H new ATOM 0 HB2 SER A 54 -1.867 2.237 -20.630 1.00 31.03 H new ATOM 0 HB3 SER A 54 -2.416 2.403 -22.286 1.00 31.03 H new ATOM 0 HG SER A 54 -4.345 1.525 -21.784 1.00 20.21 H new ATOM 864 N GLU A 55 -0.543 0.670 -23.905 1.00 72.20 N ATOM 865 CA GLU A 55 -0.372 0.574 -25.350 1.00 42.41 C ATOM 866 C GLU A 55 -0.104 -0.868 -25.770 1.00 21.31 C ATOM 867 O GLU A 55 -0.716 -1.377 -26.709 1.00 2.12 O ATOM 868 CB GLU A 55 0.778 1.473 -25.811 1.00 0.32 C ATOM 869 CG GLU A 55 0.547 2.105 -27.172 1.00 73.40 C ATOM 870 CD GLU A 55 1.470 1.548 -28.238 1.00 22.41 C ATOM 871 OE1 GLU A 55 2.624 2.016 -28.327 1.00 73.12 O ATOM 872 OE2 GLU A 55 1.038 0.644 -28.984 1.00 25.02 O ATOM 0 H GLU A 55 0.257 1.066 -23.411 1.00 72.20 H new ATOM 0 HA GLU A 55 -1.296 0.907 -25.823 1.00 42.41 H new ATOM 0 HB2 GLU A 55 0.929 2.262 -25.074 1.00 0.32 H new ATOM 0 HB3 GLU A 55 1.696 0.887 -25.843 1.00 0.32 H new ATOM 0 HG2 GLU A 55 -0.488 1.943 -27.472 1.00 73.40 H new ATOM 0 HG3 GLU A 55 0.693 3.183 -27.097 1.00 73.40 H new ATOM 879 N GLY A 56 0.818 -1.522 -25.069 1.00 60.32 N ATOM 880 CA GLY A 56 1.152 -2.899 -25.385 1.00 54.40 C ATOM 881 C GLY A 56 -0.061 -3.807 -25.371 1.00 25.04 C ATOM 882 O GLY A 56 -0.301 -4.549 -26.325 1.00 74.31 O ATOM 0 H GLY A 56 1.339 -1.123 -24.288 1.00 60.32 H new ATOM 0 HA2 GLY A 56 1.621 -2.939 -26.368 1.00 54.40 H new ATOM 0 HA3 GLY A 56 1.885 -3.266 -24.667 1.00 54.40 H new ATOM 886 N CYS A 57 -0.827 -3.753 -24.287 1.00 43.40 N ATOM 887 CA CYS A 57 -2.020 -4.580 -24.151 1.00 33.15 C ATOM 888 C CYS A 57 -2.937 -4.414 -25.359 1.00 61.41 C ATOM 889 O CYS A 57 -3.483 -5.389 -25.875 1.00 3.01 O ATOM 890 CB CYS A 57 -2.774 -4.219 -22.870 1.00 21.23 C ATOM 891 SG CYS A 57 -2.336 -5.240 -21.444 1.00 54.54 S ATOM 0 H CYS A 57 -0.643 -3.145 -23.489 1.00 43.40 H new ATOM 0 HA CYS A 57 -1.705 -5.622 -24.097 1.00 33.15 H new ATOM 0 HB2 CYS A 57 -2.579 -3.174 -22.629 1.00 21.23 H new ATOM 0 HB3 CYS A 57 -3.845 -4.310 -23.053 1.00 21.23 H new ATOM 0 HG CYS A 57 -3.023 -4.858 -20.409 1.00 54.54 H new ATOM 897 N ARG A 58 -3.101 -3.173 -25.804 1.00 74.01 N ATOM 898 CA ARG A 58 -3.954 -2.879 -26.949 1.00 63.44 C ATOM 899 C ARG A 58 -3.461 -3.607 -28.196 1.00 43.50 C ATOM 900 O ARG A 58 -4.258 -4.076 -29.008 1.00 33.01 O ATOM 901 CB ARG A 58 -3.994 -1.372 -27.209 1.00 65.15 C ATOM 902 CG ARG A 58 -4.851 -0.981 -28.402 1.00 11.42 C ATOM 903 CD ARG A 58 -4.830 0.521 -28.635 1.00 54.45 C ATOM 904 NE ARG A 58 -5.954 1.192 -27.985 1.00 23.40 N ATOM 905 CZ ARG A 58 -6.277 2.462 -28.203 1.00 22.13 C ATOM 906 NH1 ARG A 58 -5.566 3.195 -29.049 1.00 30.25 N ATOM 907 NH2 ARG A 58 -7.315 3.000 -27.575 1.00 43.24 N ATOM 0 H ARG A 58 -2.655 -2.355 -25.389 1.00 74.01 H new ATOM 0 HA ARG A 58 -4.960 -3.228 -26.719 1.00 63.44 H new ATOM 0 HB2 ARG A 58 -4.373 -0.869 -26.320 1.00 65.15 H new ATOM 0 HB3 ARG A 58 -2.978 -1.013 -27.370 1.00 65.15 H new ATOM 0 HG2 ARG A 58 -4.490 -1.494 -29.294 1.00 11.42 H new ATOM 0 HG3 ARG A 58 -5.877 -1.310 -28.238 1.00 11.42 H new ATOM 0 HD2 ARG A 58 -3.894 0.933 -28.258 1.00 54.45 H new ATOM 0 HD3 ARG A 58 -4.858 0.722 -29.706 1.00 54.45 H new ATOM 0 HE ARG A 58 -6.521 0.656 -27.328 1.00 23.40 H new ATOM 0 HH11 ARG A 58 -4.769 2.784 -29.534 1.00 30.25 H new ATOM 0 HH12 ARG A 58 -5.817 4.170 -29.214 1.00 30.25 H new ATOM 0 HH21 ARG A 58 -7.865 2.438 -26.925 1.00 43.24 H new ATOM 0 HH22 ARG A 58 -7.563 3.975 -27.742 1.00 43.24 H new ATOM 921 N GLN A 59 -2.143 -3.698 -28.339 1.00 24.44 N ATOM 922 CA GLN A 59 -1.544 -4.369 -29.487 1.00 15.30 C ATOM 923 C GLN A 59 -1.798 -5.872 -29.433 1.00 51.14 C ATOM 924 O GLN A 59 -2.099 -6.497 -30.449 1.00 22.05 O ATOM 925 CB GLN A 59 -0.040 -4.094 -29.538 1.00 12.53 C ATOM 926 CG GLN A 59 0.660 -4.755 -30.714 1.00 32.12 C ATOM 927 CD GLN A 59 2.160 -4.539 -30.697 1.00 33.35 C ATOM 928 OE1 GLN A 59 2.656 -3.514 -31.164 1.00 71.41 O ATOM 929 NE2 GLN A 59 2.892 -5.507 -30.158 1.00 72.11 N ATOM 0 H GLN A 59 -1.470 -3.316 -27.675 1.00 24.44 H new ATOM 0 HA GLN A 59 -2.009 -3.974 -30.390 1.00 15.30 H new ATOM 0 HB2 GLN A 59 0.122 -3.017 -29.588 1.00 12.53 H new ATOM 0 HB3 GLN A 59 0.416 -4.443 -28.612 1.00 12.53 H new ATOM 0 HG2 GLN A 59 0.451 -5.825 -30.702 1.00 32.12 H new ATOM 0 HG3 GLN A 59 0.251 -4.361 -31.644 1.00 32.12 H new ATOM 0 HE21 GLN A 59 2.439 -6.340 -29.782 1.00 72.11 H new ATOM 0 HE22 GLN A 59 3.907 -5.417 -30.119 1.00 72.11 H new ATOM 938 N ILE A 60 -1.673 -6.445 -28.240 1.00 71.04 N ATOM 939 CA ILE A 60 -1.889 -7.874 -28.054 1.00 34.13 C ATOM 940 C ILE A 60 -3.342 -8.251 -28.326 1.00 42.13 C ATOM 941 O ILE A 60 -3.626 -9.309 -28.886 1.00 21.22 O ATOM 942 CB ILE A 60 -1.513 -8.320 -26.628 1.00 55.45 C ATOM 943 CG1 ILE A 60 -0.050 -7.984 -26.335 1.00 23.35 C ATOM 944 CG2 ILE A 60 -1.768 -9.809 -26.454 1.00 3.23 C ATOM 945 CD1 ILE A 60 0.165 -7.345 -24.981 1.00 0.20 C ATOM 0 H ILE A 60 -1.423 -5.941 -27.389 1.00 71.04 H new ATOM 0 HA ILE A 60 -1.244 -8.386 -28.768 1.00 34.13 H new ATOM 0 HB ILE A 60 -2.138 -7.780 -25.917 1.00 55.45 H new ATOM 0 HG12 ILE A 60 0.543 -8.897 -26.395 1.00 23.35 H new ATOM 0 HG13 ILE A 60 0.321 -7.311 -27.108 1.00 23.35 H new ATOM 0 HG21 ILE A 60 -1.497 -10.109 -25.442 1.00 3.23 H new ATOM 0 HG22 ILE A 60 -2.824 -10.020 -26.625 1.00 3.23 H new ATOM 0 HG23 ILE A 60 -1.166 -10.367 -27.171 1.00 3.23 H new ATOM 0 HD11 ILE A 60 1.225 -7.135 -24.842 1.00 0.20 H new ATOM 0 HD12 ILE A 60 -0.400 -6.415 -24.924 1.00 0.20 H new ATOM 0 HD13 ILE A 60 -0.175 -8.025 -24.200 1.00 0.20 H new ATOM 957 N LEU A 61 -4.258 -7.377 -27.925 1.00 71.44 N ATOM 958 CA LEU A 61 -5.684 -7.614 -28.128 1.00 2.33 C ATOM 959 C LEU A 61 -6.049 -7.513 -29.605 1.00 42.24 C ATOM 960 O LEU A 61 -7.022 -8.115 -30.057 1.00 25.32 O ATOM 961 CB LEU A 61 -6.508 -6.615 -27.316 1.00 60.04 C ATOM 962 CG LEU A 61 -6.351 -6.691 -25.797 1.00 54.21 C ATOM 963 CD1 LEU A 61 -6.857 -5.414 -25.143 1.00 34.24 C ATOM 964 CD2 LEU A 61 -7.086 -7.904 -25.245 1.00 64.32 C ATOM 0 H LEU A 61 -4.039 -6.497 -27.457 1.00 71.44 H new ATOM 0 HA LEU A 61 -5.911 -8.624 -27.786 1.00 2.33 H new ATOM 0 HB2 LEU A 61 -6.242 -5.608 -27.638 1.00 60.04 H new ATOM 0 HB3 LEU A 61 -7.560 -6.760 -27.560 1.00 60.04 H new ATOM 0 HG LEU A 61 -5.291 -6.797 -25.565 1.00 54.21 H new ATOM 0 HD11 LEU A 61 -6.737 -5.487 -24.062 1.00 34.24 H new ATOM 0 HD12 LEU A 61 -6.286 -4.564 -25.515 1.00 34.24 H new ATOM 0 HD13 LEU A 61 -7.911 -5.276 -25.383 1.00 34.24 H new ATOM 0 HD21 LEU A 61 -6.963 -7.942 -24.163 1.00 64.32 H new ATOM 0 HD22 LEU A 61 -8.146 -7.829 -25.488 1.00 64.32 H new ATOM 0 HD23 LEU A 61 -6.676 -8.811 -25.689 1.00 64.32 H new ATOM 976 N GLY A 62 -5.260 -6.747 -30.353 1.00 64.32 N ATOM 977 CA GLY A 62 -5.515 -6.582 -31.772 1.00 73.05 C ATOM 978 C GLY A 62 -5.309 -7.865 -32.552 1.00 72.12 C ATOM 979 O GLY A 62 -5.848 -8.025 -33.646 1.00 23.30 O ATOM 0 H GLY A 62 -4.449 -6.238 -30.001 1.00 64.32 H new ATOM 0 HA2 GLY A 62 -6.538 -6.233 -31.916 1.00 73.05 H new ATOM 0 HA3 GLY A 62 -4.856 -5.810 -32.169 1.00 73.05 H new ATOM 983 N GLN A 63 -4.526 -8.778 -31.987 1.00 20.30 N ATOM 984 CA GLN A 63 -4.248 -10.053 -32.639 1.00 30.23 C ATOM 985 C GLN A 63 -5.252 -11.116 -32.205 1.00 70.10 C ATOM 986 O GLN A 63 -5.515 -12.072 -32.937 1.00 50.41 O ATOM 987 CB GLN A 63 -2.827 -10.514 -32.317 1.00 3.34 C ATOM 988 CG GLN A 63 -1.835 -10.259 -33.441 1.00 1.41 C ATOM 989 CD GLN A 63 -1.608 -11.481 -34.308 1.00 21.41 C ATOM 990 OE1 GLN A 63 -2.454 -11.838 -35.130 1.00 25.10 O ATOM 991 NE2 GLN A 63 -0.464 -12.130 -34.131 1.00 61.33 N ATOM 0 H GLN A 63 -4.073 -8.659 -31.081 1.00 20.30 H new ATOM 0 HA GLN A 63 -4.341 -9.911 -33.716 1.00 30.23 H new ATOM 0 HB2 GLN A 63 -2.483 -10.003 -31.417 1.00 3.34 H new ATOM 0 HB3 GLN A 63 -2.842 -11.580 -32.092 1.00 3.34 H new ATOM 0 HG2 GLN A 63 -2.198 -9.440 -34.062 1.00 1.41 H new ATOM 0 HG3 GLN A 63 -0.884 -9.939 -33.015 1.00 1.41 H new ATOM 0 HE21 GLN A 63 0.208 -11.799 -33.439 1.00 61.33 H new ATOM 0 HE22 GLN A 63 -0.257 -12.960 -34.687 1.00 61.33 H new ATOM 1000 N LEU A 64 -5.810 -10.945 -31.012 1.00 41.35 N ATOM 1001 CA LEU A 64 -6.784 -11.890 -30.480 1.00 75.35 C ATOM 1002 C LEU A 64 -8.200 -11.506 -30.898 1.00 22.13 C ATOM 1003 O LEU A 64 -9.084 -12.358 -30.983 1.00 31.22 O ATOM 1004 CB LEU A 64 -6.690 -11.946 -28.953 1.00 22.43 C ATOM 1005 CG LEU A 64 -5.294 -12.184 -28.377 1.00 71.00 C ATOM 1006 CD1 LEU A 64 -5.246 -11.776 -26.912 1.00 22.22 C ATOM 1007 CD2 LEU A 64 -4.891 -13.642 -28.540 1.00 65.40 C ATOM 0 H LEU A 64 -5.604 -10.160 -30.394 1.00 41.35 H new ATOM 0 HA LEU A 64 -6.558 -12.875 -30.889 1.00 75.35 H new ATOM 0 HB2 LEU A 64 -7.073 -11.008 -28.550 1.00 22.43 H new ATOM 0 HB3 LEU A 64 -7.349 -12.738 -28.597 1.00 22.43 H new ATOM 0 HG LEU A 64 -4.584 -11.568 -28.929 1.00 71.00 H new ATOM 0 HD11 LEU A 64 -4.245 -11.952 -26.518 1.00 22.22 H new ATOM 0 HD12 LEU A 64 -5.491 -10.718 -26.821 1.00 22.22 H new ATOM 0 HD13 LEU A 64 -5.968 -12.365 -26.346 1.00 22.22 H new ATOM 0 HD21 LEU A 64 -3.895 -13.793 -28.124 1.00 65.40 H new ATOM 0 HD22 LEU A 64 -5.604 -14.277 -28.014 1.00 65.40 H new ATOM 0 HD23 LEU A 64 -4.886 -13.902 -29.599 1.00 65.40 H new ATOM 1019 N GLN A 65 -8.406 -10.219 -31.161 1.00 71.21 N ATOM 1020 CA GLN A 65 -9.714 -9.724 -31.572 1.00 73.42 C ATOM 1021 C GLN A 65 -10.254 -10.527 -32.750 1.00 11.23 C ATOM 1022 O GLN A 65 -11.300 -11.173 -32.665 1.00 70.15 O ATOM 1023 CB GLN A 65 -9.627 -8.243 -31.948 1.00 62.13 C ATOM 1024 CG GLN A 65 -10.425 -7.334 -31.027 1.00 33.41 C ATOM 1025 CD GLN A 65 -10.744 -5.995 -31.663 1.00 52.41 C ATOM 1026 OE1 GLN A 65 -11.898 -5.569 -31.693 1.00 74.44 O ATOM 1027 NE2 GLN A 65 -9.719 -5.323 -32.173 1.00 63.51 N ATOM 0 H GLN A 65 -7.684 -9.501 -31.097 1.00 71.21 H new ATOM 0 HA GLN A 65 -10.399 -9.840 -30.732 1.00 73.42 H new ATOM 0 HB2 GLN A 65 -8.582 -7.934 -31.934 1.00 62.13 H new ATOM 0 HB3 GLN A 65 -9.984 -8.115 -32.970 1.00 62.13 H new ATOM 0 HG2 GLN A 65 -11.355 -7.831 -30.749 1.00 33.41 H new ATOM 0 HG3 GLN A 65 -9.863 -7.171 -30.107 1.00 33.41 H new ATOM 0 HE21 GLN A 65 -8.778 -5.715 -32.126 1.00 63.51 H new ATOM 0 HE22 GLN A 65 -9.872 -4.415 -32.612 1.00 63.51 H new ATOM 1036 N PRO A 66 -9.527 -10.490 -33.877 1.00 75.54 N ATOM 1037 CA PRO A 66 -9.915 -11.209 -35.094 1.00 1.20 C ATOM 1038 C PRO A 66 -9.780 -12.720 -34.941 1.00 3.23 C ATOM 1039 O PRO A 66 -10.338 -13.486 -35.727 1.00 13.03 O ATOM 1040 CB PRO A 66 -8.931 -10.688 -36.144 1.00 51.44 C ATOM 1041 CG PRO A 66 -7.741 -10.249 -35.362 1.00 33.20 C ATOM 1042 CD PRO A 66 -8.271 -9.741 -34.050 1.00 13.04 C ATOM 0 HA PRO A 66 -10.961 -11.041 -35.351 1.00 1.20 H new ATOM 0 HB2 PRO A 66 -8.669 -11.466 -36.861 1.00 51.44 H new ATOM 0 HB3 PRO A 66 -9.359 -9.862 -36.712 1.00 51.44 H new ATOM 0 HG2 PRO A 66 -7.048 -11.076 -35.209 1.00 33.20 H new ATOM 0 HG3 PRO A 66 -7.193 -9.468 -35.890 1.00 33.20 H new ATOM 0 HD2 PRO A 66 -7.574 -9.931 -33.234 1.00 13.04 H new ATOM 0 HD3 PRO A 66 -8.445 -8.665 -34.076 1.00 13.04 H new ATOM 1050 N SER A 67 -9.035 -13.144 -33.925 1.00 60.11 N ATOM 1051 CA SER A 67 -8.824 -14.565 -33.671 1.00 63.42 C ATOM 1052 C SER A 67 -9.989 -15.155 -32.882 1.00 62.32 C ATOM 1053 O SER A 67 -10.271 -16.350 -32.971 1.00 34.01 O ATOM 1054 CB SER A 67 -7.516 -14.779 -32.908 1.00 70.34 C ATOM 1055 OG SER A 67 -6.886 -15.986 -33.303 1.00 55.30 O ATOM 0 H SER A 67 -8.567 -12.524 -33.264 1.00 60.11 H new ATOM 0 HA SER A 67 -8.764 -15.076 -34.632 1.00 63.42 H new ATOM 0 HB2 SER A 67 -6.845 -13.939 -33.088 1.00 70.34 H new ATOM 0 HB3 SER A 67 -7.716 -14.803 -31.837 1.00 70.34 H new ATOM 0 HG SER A 67 -5.933 -15.946 -33.078 1.00 55.30 H new ATOM 1061 N LEU A 68 -10.661 -14.308 -32.111 1.00 52.21 N ATOM 1062 CA LEU A 68 -11.797 -14.744 -31.305 1.00 31.50 C ATOM 1063 C LEU A 68 -12.818 -15.488 -32.161 1.00 55.12 C ATOM 1064 O LEU A 68 -13.511 -16.382 -31.677 1.00 20.53 O ATOM 1065 CB LEU A 68 -12.459 -13.542 -30.629 1.00 54.41 C ATOM 1066 CG LEU A 68 -11.720 -12.960 -29.423 1.00 74.33 C ATOM 1067 CD1 LEU A 68 -11.897 -11.450 -29.369 1.00 52.51 C ATOM 1068 CD2 LEU A 68 -12.211 -13.603 -28.135 1.00 32.22 C ATOM 0 H LEU A 68 -10.440 -13.316 -32.026 1.00 52.21 H new ATOM 0 HA LEU A 68 -11.428 -15.425 -30.539 1.00 31.50 H new ATOM 0 HB2 LEU A 68 -12.579 -12.753 -31.372 1.00 54.41 H new ATOM 0 HB3 LEU A 68 -13.459 -13.835 -30.310 1.00 54.41 H new ATOM 0 HG LEU A 68 -10.658 -13.178 -29.531 1.00 74.33 H new ATOM 0 HD11 LEU A 68 -11.365 -11.052 -28.505 1.00 52.51 H new ATOM 0 HD12 LEU A 68 -11.496 -11.004 -30.279 1.00 52.51 H new ATOM 0 HD13 LEU A 68 -12.957 -11.211 -29.284 1.00 52.51 H new ATOM 0 HD21 LEU A 68 -11.674 -13.177 -27.288 1.00 32.22 H new ATOM 0 HD22 LEU A 68 -13.279 -13.416 -28.019 1.00 32.22 H new ATOM 0 HD23 LEU A 68 -12.033 -14.678 -28.174 1.00 32.22 H new ATOM 1080 N GLN A 69 -12.903 -15.111 -33.432 1.00 5.13 N ATOM 1081 CA GLN A 69 -13.838 -15.743 -34.355 1.00 12.14 C ATOM 1082 C GLN A 69 -13.684 -17.260 -34.332 1.00 22.14 C ATOM 1083 O GLN A 69 -14.667 -17.995 -34.238 1.00 33.43 O ATOM 1084 CB GLN A 69 -13.622 -15.218 -35.775 1.00 4.31 C ATOM 1085 CG GLN A 69 -14.858 -15.312 -36.654 1.00 22.33 C ATOM 1086 CD GLN A 69 -14.532 -15.228 -38.131 1.00 64.42 C ATOM 1087 OE1 GLN A 69 -13.919 -16.134 -38.698 1.00 53.32 O ATOM 1088 NE2 GLN A 69 -14.938 -14.134 -38.767 1.00 10.01 N ATOM 0 H GLN A 69 -12.336 -14.371 -33.846 1.00 5.13 H new ATOM 0 HA GLN A 69 -14.849 -15.493 -34.034 1.00 12.14 H new ATOM 0 HB2 GLN A 69 -13.301 -14.177 -35.724 1.00 4.31 H new ATOM 0 HB3 GLN A 69 -12.812 -15.779 -36.241 1.00 4.31 H new ATOM 0 HG2 GLN A 69 -15.372 -16.252 -36.452 1.00 22.33 H new ATOM 0 HG3 GLN A 69 -15.547 -14.509 -36.392 1.00 22.33 H new ATOM 0 HE21 GLN A 69 -15.443 -13.407 -38.260 1.00 10.01 H new ATOM 0 HE22 GLN A 69 -14.745 -14.021 -39.762 1.00 10.01 H new ATOM 1097 N THR A 70 -12.441 -17.725 -34.418 1.00 33.44 N ATOM 1098 CA THR A 70 -12.157 -19.154 -34.410 1.00 31.25 C ATOM 1099 C THR A 70 -11.052 -19.489 -33.415 1.00 11.23 C ATOM 1100 O THR A 70 -10.164 -20.290 -33.704 1.00 33.23 O ATOM 1101 CB THR A 70 -11.743 -19.653 -35.807 1.00 24.32 C ATOM 1102 OG1 THR A 70 -10.805 -18.744 -36.395 1.00 51.51 O ATOM 1103 CG2 THR A 70 -12.956 -19.794 -36.714 1.00 40.21 C ATOM 0 H THR A 70 -11.615 -17.132 -34.494 1.00 33.44 H new ATOM 0 HA THR A 70 -13.077 -19.657 -34.111 1.00 31.25 H new ATOM 0 HB THR A 70 -11.278 -20.632 -35.694 1.00 24.32 H new ATOM 0 HG1 THR A 70 -10.546 -19.070 -37.282 1.00 51.51 H new ATOM 0 HG21 THR A 70 -12.638 -20.148 -37.695 1.00 40.21 H new ATOM 0 HG22 THR A 70 -13.654 -20.509 -36.279 1.00 40.21 H new ATOM 0 HG23 THR A 70 -13.446 -18.826 -36.819 1.00 40.21 H new ATOM 1111 N GLY A 71 -11.113 -18.871 -32.239 1.00 23.21 N ATOM 1112 CA GLY A 71 -10.111 -19.117 -31.219 1.00 2.03 C ATOM 1113 C GLY A 71 -10.517 -20.222 -30.263 1.00 71.23 C ATOM 1114 O GLY A 71 -11.674 -20.641 -30.243 1.00 22.32 O ATOM 0 H GLY A 71 -11.839 -18.205 -31.975 1.00 23.21 H new ATOM 0 HA2 GLY A 71 -9.168 -19.382 -31.697 1.00 2.03 H new ATOM 0 HA3 GLY A 71 -9.937 -18.200 -30.657 1.00 2.03 H new ATOM 1118 N SER A 72 -9.562 -20.696 -29.470 1.00 44.42 N ATOM 1119 CA SER A 72 -9.824 -21.763 -28.511 1.00 42.30 C ATOM 1120 C SER A 72 -9.672 -21.257 -27.080 1.00 50.30 C ATOM 1121 O SER A 72 -9.526 -20.058 -26.847 1.00 73.53 O ATOM 1122 CB SER A 72 -8.875 -22.938 -28.752 1.00 4.25 C ATOM 1123 OG SER A 72 -7.634 -22.733 -28.099 1.00 23.03 O ATOM 0 H SER A 72 -8.600 -20.358 -29.472 1.00 44.42 H new ATOM 0 HA SER A 72 -10.851 -22.100 -28.651 1.00 42.30 H new ATOM 0 HB2 SER A 72 -9.332 -23.859 -28.390 1.00 4.25 H new ATOM 0 HB3 SER A 72 -8.710 -23.063 -29.822 1.00 4.25 H new ATOM 0 HG SER A 72 -7.046 -23.499 -28.267 1.00 23.03 H new ATOM 1129 N GLU A 73 -9.708 -22.181 -26.125 1.00 34.20 N ATOM 1130 CA GLU A 73 -9.576 -21.829 -24.716 1.00 31.32 C ATOM 1131 C GLU A 73 -8.335 -20.972 -24.484 1.00 61.05 C ATOM 1132 O GLU A 73 -8.331 -20.085 -23.630 1.00 4.13 O ATOM 1133 CB GLU A 73 -9.505 -23.092 -23.856 1.00 52.42 C ATOM 1134 CG GLU A 73 -8.250 -23.918 -24.090 1.00 53.53 C ATOM 1135 CD GLU A 73 -8.437 -25.377 -23.724 1.00 25.24 C ATOM 1136 OE1 GLU A 73 -9.275 -26.047 -24.365 1.00 64.42 O ATOM 1137 OE2 GLU A 73 -7.746 -25.851 -22.798 1.00 32.04 O ATOM 0 H GLU A 73 -9.827 -23.179 -26.301 1.00 34.20 H new ATOM 0 HA GLU A 73 -10.455 -21.252 -24.428 1.00 31.32 H new ATOM 0 HB2 GLU A 73 -9.553 -22.809 -22.805 1.00 52.42 H new ATOM 0 HB3 GLU A 73 -10.380 -23.710 -24.060 1.00 52.42 H new ATOM 0 HG2 GLU A 73 -7.961 -23.844 -25.138 1.00 53.53 H new ATOM 0 HG3 GLU A 73 -7.431 -23.502 -23.503 1.00 53.53 H new ATOM 1144 N GLU A 74 -7.283 -21.245 -25.250 1.00 71.11 N ATOM 1145 CA GLU A 74 -6.035 -20.499 -25.127 1.00 12.03 C ATOM 1146 C GLU A 74 -6.235 -19.036 -25.510 1.00 31.23 C ATOM 1147 O GLU A 74 -5.629 -18.140 -24.923 1.00 64.30 O ATOM 1148 CB GLU A 74 -4.952 -21.126 -26.008 1.00 13.01 C ATOM 1149 CG GLU A 74 -4.539 -22.520 -25.565 1.00 71.33 C ATOM 1150 CD GLU A 74 -3.668 -23.222 -26.590 1.00 51.53 C ATOM 1151 OE1 GLU A 74 -2.465 -22.900 -26.666 1.00 61.40 O ATOM 1152 OE2 GLU A 74 -4.192 -24.095 -27.314 1.00 42.13 O ATOM 0 H GLU A 74 -7.270 -21.976 -25.961 1.00 71.11 H new ATOM 0 HA GLU A 74 -5.716 -20.543 -24.086 1.00 12.03 H new ATOM 0 HB2 GLU A 74 -5.313 -21.172 -27.035 1.00 13.01 H new ATOM 0 HB3 GLU A 74 -4.075 -20.479 -26.007 1.00 13.01 H new ATOM 0 HG2 GLU A 74 -4.000 -22.452 -24.620 1.00 71.33 H new ATOM 0 HG3 GLU A 74 -5.431 -23.118 -25.381 1.00 71.33 H new ATOM 1159 N LEU A 75 -7.090 -18.802 -26.501 1.00 11.24 N ATOM 1160 CA LEU A 75 -7.370 -17.447 -26.964 1.00 32.15 C ATOM 1161 C LEU A 75 -8.215 -16.688 -25.947 1.00 61.24 C ATOM 1162 O LEU A 75 -7.849 -15.594 -25.515 1.00 23.32 O ATOM 1163 CB LEU A 75 -8.091 -17.489 -28.313 1.00 60.32 C ATOM 1164 CG LEU A 75 -7.678 -16.422 -29.328 1.00 74.04 C ATOM 1165 CD1 LEU A 75 -7.233 -17.068 -30.630 1.00 63.32 C ATOM 1166 CD2 LEU A 75 -8.824 -15.451 -29.576 1.00 65.12 C ATOM 0 H LEU A 75 -7.600 -19.532 -26.998 1.00 11.24 H new ATOM 0 HA LEU A 75 -6.420 -16.925 -27.081 1.00 32.15 H new ATOM 0 HB2 LEU A 75 -7.927 -18.470 -28.760 1.00 60.32 H new ATOM 0 HB3 LEU A 75 -9.162 -17.396 -28.133 1.00 60.32 H new ATOM 0 HG LEU A 75 -6.837 -15.863 -28.918 1.00 74.04 H new ATOM 0 HD11 LEU A 75 -6.943 -16.293 -31.340 1.00 63.32 H new ATOM 0 HD12 LEU A 75 -6.382 -17.722 -30.439 1.00 63.32 H new ATOM 0 HD13 LEU A 75 -8.054 -17.652 -31.046 1.00 63.32 H new ATOM 0 HD21 LEU A 75 -8.513 -14.698 -30.301 1.00 65.12 H new ATOM 0 HD22 LEU A 75 -9.684 -15.995 -29.965 1.00 65.12 H new ATOM 0 HD23 LEU A 75 -9.096 -14.963 -28.640 1.00 65.12 H new ATOM 1178 N ARG A 76 -9.345 -17.275 -25.566 1.00 63.34 N ATOM 1179 CA ARG A 76 -10.240 -16.652 -24.599 1.00 13.41 C ATOM 1180 C ARG A 76 -9.482 -16.249 -23.337 1.00 31.43 C ATOM 1181 O ARG A 76 -9.646 -15.139 -22.830 1.00 25.51 O ATOM 1182 CB ARG A 76 -11.379 -17.608 -24.238 1.00 12.44 C ATOM 1183 CG ARG A 76 -12.674 -17.321 -24.981 1.00 45.40 C ATOM 1184 CD ARG A 76 -13.478 -18.592 -25.208 1.00 62.12 C ATOM 1185 NE ARG A 76 -13.758 -19.294 -23.958 1.00 65.42 N ATOM 1186 CZ ARG A 76 -14.630 -18.863 -23.054 1.00 32.01 C ATOM 1187 NH1 ARG A 76 -15.303 -17.740 -23.258 1.00 33.32 N ATOM 1188 NH2 ARG A 76 -14.829 -19.557 -21.941 1.00 53.41 N ATOM 0 H ARG A 76 -9.662 -18.181 -25.912 1.00 63.34 H new ATOM 0 HA ARG A 76 -10.658 -15.754 -25.054 1.00 13.41 H new ATOM 0 HB2 ARG A 76 -11.066 -18.630 -24.452 1.00 12.44 H new ATOM 0 HB3 ARG A 76 -11.565 -17.550 -23.166 1.00 12.44 H new ATOM 0 HG2 ARG A 76 -13.271 -16.608 -24.412 1.00 45.40 H new ATOM 0 HG3 ARG A 76 -12.449 -16.855 -25.940 1.00 45.40 H new ATOM 0 HD2 ARG A 76 -14.417 -18.343 -25.702 1.00 62.12 H new ATOM 0 HD3 ARG A 76 -12.930 -19.253 -25.880 1.00 62.12 H new ATOM 0 HE ARG A 76 -13.257 -20.162 -23.769 1.00 65.42 H new ATOM 0 HH11 ARG A 76 -15.152 -17.203 -24.112 1.00 33.32 H new ATOM 0 HH12 ARG A 76 -15.972 -17.413 -22.561 1.00 33.32 H new ATOM 0 HH21 ARG A 76 -14.312 -20.421 -21.780 1.00 53.41 H new ATOM 0 HH22 ARG A 76 -15.499 -19.226 -21.247 1.00 53.41 H new ATOM 1202 N SER A 77 -8.652 -17.158 -22.835 1.00 32.55 N ATOM 1203 CA SER A 77 -7.872 -16.899 -21.631 1.00 10.11 C ATOM 1204 C SER A 77 -7.088 -15.596 -21.762 1.00 2.03 C ATOM 1205 O SER A 77 -7.158 -14.726 -20.892 1.00 32.55 O ATOM 1206 CB SER A 77 -6.913 -18.060 -21.360 1.00 64.14 C ATOM 1207 OG SER A 77 -7.591 -19.155 -20.770 1.00 22.32 O ATOM 0 H SER A 77 -8.503 -18.080 -23.244 1.00 32.55 H new ATOM 0 HA SER A 77 -8.563 -16.805 -20.793 1.00 10.11 H new ATOM 0 HB2 SER A 77 -6.448 -18.377 -22.293 1.00 64.14 H new ATOM 0 HB3 SER A 77 -6.111 -17.727 -20.701 1.00 64.14 H new ATOM 0 HG SER A 77 -7.100 -19.455 -19.977 1.00 22.32 H new ATOM 1213 N LEU A 78 -6.342 -15.470 -22.853 1.00 70.35 N ATOM 1214 CA LEU A 78 -5.543 -14.273 -23.099 1.00 32.41 C ATOM 1215 C LEU A 78 -6.420 -13.025 -23.103 1.00 73.31 C ATOM 1216 O LEU A 78 -6.192 -12.091 -22.335 1.00 52.15 O ATOM 1217 CB LEU A 78 -4.804 -14.395 -24.433 1.00 53.31 C ATOM 1218 CG LEU A 78 -3.314 -14.724 -24.346 1.00 25.10 C ATOM 1219 CD1 LEU A 78 -2.583 -13.674 -23.523 1.00 45.03 C ATOM 1220 CD2 LEU A 78 -3.107 -16.110 -23.752 1.00 61.05 C ATOM 0 H LEU A 78 -6.273 -16.181 -23.581 1.00 70.35 H new ATOM 0 HA LEU A 78 -4.814 -14.180 -22.294 1.00 32.41 H new ATOM 0 HB2 LEU A 78 -5.292 -15.168 -25.027 1.00 53.31 H new ATOM 0 HB3 LEU A 78 -4.917 -13.457 -24.976 1.00 53.31 H new ATOM 0 HG LEU A 78 -2.901 -14.718 -25.355 1.00 25.10 H new ATOM 0 HD11 LEU A 78 -1.523 -13.925 -23.472 1.00 45.03 H new ATOM 0 HD12 LEU A 78 -2.703 -12.697 -23.991 1.00 45.03 H new ATOM 0 HD13 LEU A 78 -2.999 -13.647 -22.516 1.00 45.03 H new ATOM 0 HD21 LEU A 78 -2.040 -16.327 -23.698 1.00 61.05 H new ATOM 0 HD22 LEU A 78 -3.536 -16.144 -22.750 1.00 61.05 H new ATOM 0 HD23 LEU A 78 -3.597 -16.853 -24.382 1.00 61.05 H new ATOM 1232 N TYR A 79 -7.425 -13.017 -23.972 1.00 60.23 N ATOM 1233 CA TYR A 79 -8.336 -11.883 -24.077 1.00 51.52 C ATOM 1234 C TYR A 79 -8.906 -11.515 -22.710 1.00 45.32 C ATOM 1235 O TYR A 79 -9.218 -10.354 -22.447 1.00 20.12 O ATOM 1236 CB TYR A 79 -9.474 -12.204 -25.046 1.00 33.15 C ATOM 1237 CG TYR A 79 -9.896 -11.028 -25.896 1.00 34.22 C ATOM 1238 CD1 TYR A 79 -8.985 -10.378 -26.720 1.00 30.14 C ATOM 1239 CD2 TYR A 79 -11.206 -10.564 -25.875 1.00 34.03 C ATOM 1240 CE1 TYR A 79 -9.366 -9.302 -27.498 1.00 24.20 C ATOM 1241 CE2 TYR A 79 -11.596 -9.490 -26.651 1.00 40.24 C ATOM 1242 CZ TYR A 79 -10.673 -8.862 -27.459 1.00 21.54 C ATOM 1243 OH TYR A 79 -11.057 -7.791 -28.233 1.00 43.32 O ATOM 0 H TYR A 79 -7.629 -13.783 -24.614 1.00 60.23 H new ATOM 0 HA TYR A 79 -7.773 -11.031 -24.458 1.00 51.52 H new ATOM 0 HB2 TYR A 79 -9.165 -13.021 -25.698 1.00 33.15 H new ATOM 0 HB3 TYR A 79 -10.334 -12.558 -24.478 1.00 33.15 H new ATOM 0 HD1 TYR A 79 -7.961 -10.720 -26.753 1.00 30.14 H new ATOM 0 HD2 TYR A 79 -11.932 -11.052 -25.241 1.00 34.03 H new ATOM 0 HE1 TYR A 79 -8.645 -8.808 -28.133 1.00 24.20 H new ATOM 0 HE2 TYR A 79 -12.619 -9.144 -26.625 1.00 40.24 H new ATOM 0 HH TYR A 79 -12.009 -7.609 -28.090 1.00 43.32 H new ATOM 1253 N ASN A 80 -9.037 -12.513 -21.842 1.00 33.50 N ATOM 1254 CA ASN A 80 -9.569 -12.295 -20.502 1.00 31.12 C ATOM 1255 C ASN A 80 -8.568 -11.537 -19.635 1.00 24.55 C ATOM 1256 O ASN A 80 -8.844 -10.431 -19.171 1.00 40.41 O ATOM 1257 CB ASN A 80 -9.917 -13.633 -19.845 1.00 35.44 C ATOM 1258 CG ASN A 80 -11.414 -13.877 -19.788 1.00 62.32 C ATOM 1259 OD1 ASN A 80 -12.165 -13.390 -20.633 1.00 31.03 O ATOM 1260 ND2 ASN A 80 -11.852 -14.632 -18.789 1.00 14.43 N ATOM 0 H ASN A 80 -8.782 -13.480 -22.043 1.00 33.50 H new ATOM 0 HA ASN A 80 -10.474 -11.694 -20.591 1.00 31.12 H new ATOM 0 HB2 ASN A 80 -9.441 -14.442 -20.399 1.00 35.44 H new ATOM 0 HB3 ASN A 80 -9.509 -13.656 -18.834 1.00 35.44 H new ATOM 0 HD21 ASN A 80 -12.848 -14.830 -18.698 1.00 14.43 H new ATOM 0 HD22 ASN A 80 -11.192 -15.015 -18.112 1.00 14.43 H new ATOM 1267 N THR A 81 -7.402 -12.140 -19.423 1.00 11.03 N ATOM 1268 CA THR A 81 -6.359 -11.523 -18.613 1.00 71.02 C ATOM 1269 C THR A 81 -5.976 -10.154 -19.161 1.00 63.22 C ATOM 1270 O THR A 81 -6.017 -9.153 -18.444 1.00 54.40 O ATOM 1271 CB THR A 81 -5.100 -12.409 -18.547 1.00 33.41 C ATOM 1272 OG1 THR A 81 -5.423 -13.676 -17.965 1.00 32.20 O ATOM 1273 CG2 THR A 81 -4.006 -11.735 -17.734 1.00 40.01 C ATOM 0 H THR A 81 -7.157 -13.055 -19.801 1.00 11.03 H new ATOM 0 HA THR A 81 -6.765 -11.408 -17.608 1.00 71.02 H new ATOM 0 HB THR A 81 -4.735 -12.559 -19.563 1.00 33.41 H new ATOM 0 HG1 THR A 81 -4.618 -14.234 -17.928 1.00 32.20 H new ATOM 0 HG21 THR A 81 -3.127 -12.379 -17.702 1.00 40.01 H new ATOM 0 HG22 THR A 81 -3.742 -10.784 -18.197 1.00 40.01 H new ATOM 0 HG23 THR A 81 -4.363 -11.558 -16.720 1.00 40.01 H new ATOM 1281 N ILE A 82 -5.603 -10.115 -20.436 1.00 24.24 N ATOM 1282 CA ILE A 82 -5.213 -8.867 -21.080 1.00 11.32 C ATOM 1283 C ILE A 82 -6.274 -7.791 -20.880 1.00 75.21 C ATOM 1284 O ILE A 82 -5.955 -6.615 -20.711 1.00 71.45 O ATOM 1285 CB ILE A 82 -4.974 -9.062 -22.589 1.00 11.33 C ATOM 1286 CG1 ILE A 82 -3.888 -10.115 -22.824 1.00 41.34 C ATOM 1287 CG2 ILE A 82 -4.589 -7.742 -23.240 1.00 13.13 C ATOM 1288 CD1 ILE A 82 -3.890 -10.684 -24.225 1.00 73.43 C ATOM 0 H ILE A 82 -5.563 -10.934 -21.043 1.00 24.24 H new ATOM 0 HA ILE A 82 -4.282 -8.548 -20.612 1.00 11.32 H new ATOM 0 HB ILE A 82 -5.899 -9.413 -23.046 1.00 11.33 H new ATOM 0 HG12 ILE A 82 -2.913 -9.671 -22.623 1.00 41.34 H new ATOM 0 HG13 ILE A 82 -4.021 -10.928 -22.110 1.00 41.34 H new ATOM 0 HG21 ILE A 82 -4.424 -7.897 -24.306 1.00 13.13 H new ATOM 0 HG22 ILE A 82 -5.392 -7.019 -23.099 1.00 13.13 H new ATOM 0 HG23 ILE A 82 -3.675 -7.363 -22.782 1.00 13.13 H new ATOM 0 HD11 ILE A 82 -3.095 -11.423 -24.319 1.00 73.43 H new ATOM 0 HD12 ILE A 82 -4.851 -11.158 -24.424 1.00 73.43 H new ATOM 0 HD13 ILE A 82 -3.726 -9.881 -24.944 1.00 73.43 H new ATOM 1300 N ALA A 83 -7.537 -8.202 -20.900 1.00 33.40 N ATOM 1301 CA ALA A 83 -8.646 -7.274 -20.717 1.00 53.31 C ATOM 1302 C ALA A 83 -8.620 -6.655 -19.323 1.00 24.54 C ATOM 1303 O ALA A 83 -8.455 -5.444 -19.174 1.00 34.42 O ATOM 1304 CB ALA A 83 -9.972 -7.981 -20.958 1.00 4.35 C ATOM 0 H ALA A 83 -7.818 -9.172 -21.041 1.00 33.40 H new ATOM 0 HA ALA A 83 -8.538 -6.470 -21.445 1.00 53.31 H new ATOM 0 HB1 ALA A 83 -10.791 -7.276 -20.818 1.00 4.35 H new ATOM 0 HB2 ALA A 83 -9.998 -8.369 -21.976 1.00 4.35 H new ATOM 0 HB3 ALA A 83 -10.078 -8.805 -20.253 1.00 4.35 H new ATOM 1310 N VAL A 84 -8.783 -7.493 -18.305 1.00 35.35 N ATOM 1311 CA VAL A 84 -8.779 -7.029 -16.924 1.00 40.22 C ATOM 1312 C VAL A 84 -7.543 -6.185 -16.633 1.00 43.32 C ATOM 1313 O VAL A 84 -7.611 -5.196 -15.901 1.00 33.50 O ATOM 1314 CB VAL A 84 -8.826 -8.208 -15.934 1.00 23.42 C ATOM 1315 CG1 VAL A 84 -8.788 -7.704 -14.499 1.00 34.51 C ATOM 1316 CG2 VAL A 84 -10.064 -9.058 -16.177 1.00 30.24 C ATOM 0 H VAL A 84 -8.920 -8.498 -18.411 1.00 35.35 H new ATOM 0 HA VAL A 84 -9.673 -6.419 -16.793 1.00 40.22 H new ATOM 0 HB VAL A 84 -7.947 -8.832 -16.097 1.00 23.42 H new ATOM 0 HG11 VAL A 84 -8.822 -8.552 -13.815 1.00 34.51 H new ATOM 0 HG12 VAL A 84 -7.869 -7.142 -14.335 1.00 34.51 H new ATOM 0 HG13 VAL A 84 -9.646 -7.057 -14.318 1.00 34.51 H new ATOM 0 HG21 VAL A 84 -10.081 -9.886 -15.469 1.00 30.24 H new ATOM 0 HG22 VAL A 84 -10.957 -8.447 -16.043 1.00 30.24 H new ATOM 0 HG23 VAL A 84 -10.042 -9.450 -17.194 1.00 30.24 H new ATOM 1326 N LEU A 85 -6.414 -6.581 -17.209 1.00 44.20 N ATOM 1327 CA LEU A 85 -5.160 -5.860 -17.012 1.00 34.43 C ATOM 1328 C LEU A 85 -5.203 -4.497 -17.694 1.00 72.31 C ATOM 1329 O LEU A 85 -4.977 -3.467 -17.059 1.00 72.43 O ATOM 1330 CB LEU A 85 -3.988 -6.679 -17.557 1.00 43.31 C ATOM 1331 CG LEU A 85 -2.638 -6.453 -16.875 1.00 73.40 C ATOM 1332 CD1 LEU A 85 -2.208 -7.698 -16.116 1.00 24.53 C ATOM 1333 CD2 LEU A 85 -1.583 -6.058 -17.898 1.00 22.24 C ATOM 0 H LEU A 85 -6.340 -7.397 -17.816 1.00 44.20 H new ATOM 0 HA LEU A 85 -5.022 -5.706 -15.942 1.00 34.43 H new ATOM 0 HB2 LEU A 85 -4.241 -7.736 -17.477 1.00 43.31 H new ATOM 0 HB3 LEU A 85 -3.878 -6.457 -18.619 1.00 43.31 H new ATOM 0 HG LEU A 85 -2.746 -5.637 -16.161 1.00 73.40 H new ATOM 0 HD11 LEU A 85 -1.245 -7.518 -15.637 1.00 24.53 H new ATOM 0 HD12 LEU A 85 -2.952 -7.936 -15.356 1.00 24.53 H new ATOM 0 HD13 LEU A 85 -2.118 -8.534 -16.810 1.00 24.53 H new ATOM 0 HD21 LEU A 85 -0.629 -5.901 -17.395 1.00 22.24 H new ATOM 0 HD22 LEU A 85 -1.477 -6.852 -18.637 1.00 22.24 H new ATOM 0 HD23 LEU A 85 -1.886 -5.137 -18.396 1.00 22.24 H new ATOM 1345 N TYR A 86 -5.497 -4.499 -18.990 1.00 64.50 N ATOM 1346 CA TYR A 86 -5.570 -3.262 -19.759 1.00 71.13 C ATOM 1347 C TYR A 86 -6.489 -2.251 -19.080 1.00 14.23 C ATOM 1348 O TYR A 86 -6.151 -1.073 -18.954 1.00 31.13 O ATOM 1349 CB TYR A 86 -6.066 -3.546 -21.178 1.00 2.41 C ATOM 1350 CG TYR A 86 -6.365 -2.298 -21.976 1.00 22.13 C ATOM 1351 CD1 TYR A 86 -7.614 -1.693 -21.915 1.00 2.21 C ATOM 1352 CD2 TYR A 86 -5.399 -1.725 -22.794 1.00 74.33 C ATOM 1353 CE1 TYR A 86 -7.892 -0.553 -22.643 1.00 72.00 C ATOM 1354 CE2 TYR A 86 -5.667 -0.584 -23.525 1.00 35.41 C ATOM 1355 CZ TYR A 86 -6.915 -0.001 -23.447 1.00 14.23 C ATOM 1356 OH TYR A 86 -7.187 1.134 -24.175 1.00 13.53 O ATOM 0 H TYR A 86 -5.689 -5.343 -19.530 1.00 64.50 H new ATOM 0 HA TYR A 86 -4.567 -2.837 -19.810 1.00 71.13 H new ATOM 0 HB2 TYR A 86 -5.314 -4.133 -21.706 1.00 2.41 H new ATOM 0 HB3 TYR A 86 -6.967 -4.157 -21.123 1.00 2.41 H new ATOM 0 HD1 TYR A 86 -8.381 -2.122 -21.287 1.00 2.21 H new ATOM 0 HD2 TYR A 86 -4.422 -2.180 -22.859 1.00 74.33 H new ATOM 0 HE1 TYR A 86 -8.869 -0.096 -22.584 1.00 72.00 H new ATOM 0 HE2 TYR A 86 -4.904 -0.151 -24.154 1.00 35.41 H new ATOM 0 HH TYR A 86 -6.392 1.393 -24.687 1.00 13.53 H new ATOM 1366 N CYS A 87 -7.652 -2.721 -18.642 1.00 31.41 N ATOM 1367 CA CYS A 87 -8.622 -1.860 -17.975 1.00 74.42 C ATOM 1368 C CYS A 87 -7.981 -1.125 -16.803 1.00 40.23 C ATOM 1369 O CYS A 87 -8.270 0.046 -16.557 1.00 54.31 O ATOM 1370 CB CYS A 87 -9.815 -2.683 -17.486 1.00 64.11 C ATOM 1371 SG CYS A 87 -11.089 -2.953 -18.739 1.00 35.43 S ATOM 0 H CYS A 87 -7.946 -3.693 -18.737 1.00 31.41 H new ATOM 0 HA CYS A 87 -8.971 -1.121 -18.696 1.00 74.42 H new ATOM 0 HB2 CYS A 87 -9.456 -3.650 -17.134 1.00 64.11 H new ATOM 0 HB3 CYS A 87 -10.264 -2.179 -16.630 1.00 64.11 H new ATOM 0 HG CYS A 87 -12.249 -3.060 -18.162 1.00 35.43 H new ATOM 1377 N VAL A 88 -7.108 -1.820 -16.081 1.00 11.31 N ATOM 1378 CA VAL A 88 -6.426 -1.234 -14.933 1.00 14.34 C ATOM 1379 C VAL A 88 -5.592 -0.027 -15.347 1.00 72.32 C ATOM 1380 O VAL A 88 -5.614 1.011 -14.686 1.00 61.35 O ATOM 1381 CB VAL A 88 -5.512 -2.262 -14.238 1.00 10.01 C ATOM 1382 CG1 VAL A 88 -4.805 -1.629 -13.050 1.00 1.15 C ATOM 1383 CG2 VAL A 88 -6.313 -3.480 -13.806 1.00 33.13 C ATOM 0 H VAL A 88 -6.856 -2.790 -16.271 1.00 11.31 H new ATOM 0 HA VAL A 88 -7.199 -0.915 -14.234 1.00 14.34 H new ATOM 0 HB VAL A 88 -4.754 -2.589 -14.950 1.00 10.01 H new ATOM 0 HG11 VAL A 88 -4.164 -2.369 -12.571 1.00 1.15 H new ATOM 0 HG12 VAL A 88 -4.198 -0.791 -13.392 1.00 1.15 H new ATOM 0 HG13 VAL A 88 -5.545 -1.273 -12.334 1.00 1.15 H new ATOM 0 HG21 VAL A 88 -5.652 -4.196 -13.317 1.00 33.13 H new ATOM 0 HG22 VAL A 88 -7.094 -3.174 -13.110 1.00 33.13 H new ATOM 0 HG23 VAL A 88 -6.768 -3.945 -14.680 1.00 33.13 H new ATOM 1393 N HIS A 89 -4.859 -0.170 -16.446 1.00 30.10 N ATOM 1394 CA HIS A 89 -4.017 0.910 -16.951 1.00 11.02 C ATOM 1395 C HIS A 89 -4.870 2.035 -17.531 1.00 24.31 C ATOM 1396 O HIS A 89 -4.309 3.106 -17.761 1.00 43.43 O ATOM 1397 CB HIS A 89 -3.056 0.381 -18.016 1.00 33.30 C ATOM 1398 CG HIS A 89 -2.114 -0.666 -17.505 1.00 24.32 C ATOM 1399 ND1 HIS A 89 -1.745 -0.764 -16.181 1.00 4.42 N ATOM 1400 CD2 HIS A 89 -1.465 -1.663 -18.151 1.00 12.14 C ATOM 1401 CE1 HIS A 89 -0.909 -1.777 -16.033 1.00 2.05 C ATOM 1402 NE2 HIS A 89 -0.723 -2.340 -17.215 1.00 12.44 N ATOM 0 H HIS A 89 -4.830 -1.023 -17.005 1.00 30.10 H new ATOM 0 HA HIS A 89 -3.438 1.308 -16.117 1.00 11.02 H new ATOM 0 HB2 HIS A 89 -3.634 -0.034 -18.842 1.00 33.30 H new ATOM 0 HB3 HIS A 89 -2.478 1.213 -18.418 1.00 33.30 H new ATOM 0 HD1 HIS A 89 -2.067 -0.151 -15.432 1.00 4.42 H new ATOM 0 HD2 HIS A 89 -1.521 -1.885 -19.207 1.00 12.14 H new ATOM 0 HE1 HIS A 89 -0.455 -2.091 -15.105 1.00 2.05 H new ATOM 1411 N GLN A 90 -6.160 1.827 -17.767 1.00 53.42 N ATOM 1412 CA GLN A 90 -7.013 2.872 -18.322 1.00 0.12 C ATOM 1413 C GLN A 90 -7.911 3.471 -17.244 1.00 35.15 C ATOM 1414 O GLN A 90 -8.989 3.989 -17.539 1.00 11.51 O ATOM 1415 CB GLN A 90 -7.867 2.312 -19.461 1.00 24.21 C ATOM 1416 CG GLN A 90 -7.131 2.234 -20.790 1.00 51.10 C ATOM 1417 CD GLN A 90 -6.682 3.593 -21.289 1.00 15.13 C ATOM 1418 OE1 GLN A 90 -7.497 4.407 -21.724 1.00 64.13 O ATOM 1419 NE2 GLN A 90 -5.380 3.845 -21.229 1.00 50.14 N ATOM 0 H GLN A 90 -6.638 0.945 -17.583 1.00 53.42 H new ATOM 0 HA GLN A 90 -6.370 3.661 -18.714 1.00 0.12 H new ATOM 0 HB2 GLN A 90 -8.214 1.315 -19.188 1.00 24.21 H new ATOM 0 HB3 GLN A 90 -8.752 2.936 -19.581 1.00 24.21 H new ATOM 0 HG2 GLN A 90 -6.262 1.585 -20.682 1.00 51.10 H new ATOM 0 HG3 GLN A 90 -7.781 1.774 -21.535 1.00 51.10 H new ATOM 0 HE21 GLN A 90 -4.741 3.141 -20.861 1.00 50.14 H new ATOM 0 HE22 GLN A 90 -5.019 4.743 -21.551 1.00 50.14 H new ATOM 1428 N ARG A 91 -7.461 3.395 -15.996 1.00 61.22 N ATOM 1429 CA ARG A 91 -8.226 3.929 -14.875 1.00 22.25 C ATOM 1430 C ARG A 91 -9.621 3.312 -14.825 1.00 23.40 C ATOM 1431 O ARG A 91 -10.559 3.918 -14.309 1.00 15.20 O ATOM 1432 CB ARG A 91 -8.333 5.450 -14.981 1.00 73.33 C ATOM 1433 CG ARG A 91 -8.079 6.172 -13.667 1.00 25.52 C ATOM 1434 CD ARG A 91 -6.593 6.406 -13.439 1.00 33.02 C ATOM 1435 NE ARG A 91 -6.219 6.218 -12.040 1.00 31.01 N ATOM 1436 CZ ARG A 91 -4.965 6.057 -11.630 1.00 51.13 C ATOM 1437 NH1 ARG A 91 -3.971 6.064 -12.508 1.00 12.24 N ATOM 1438 NH2 ARG A 91 -4.705 5.891 -10.340 1.00 64.23 N ATOM 0 H ARG A 91 -6.571 2.969 -15.735 1.00 61.22 H new ATOM 0 HA ARG A 91 -7.701 3.672 -13.955 1.00 22.25 H new ATOM 0 HB2 ARG A 91 -7.619 5.805 -15.725 1.00 73.33 H new ATOM 0 HB3 ARG A 91 -9.327 5.711 -15.343 1.00 73.33 H new ATOM 0 HG2 ARG A 91 -8.603 7.128 -13.668 1.00 25.52 H new ATOM 0 HG3 ARG A 91 -8.487 5.586 -12.844 1.00 25.52 H new ATOM 0 HD2 ARG A 91 -6.018 5.722 -14.063 1.00 33.02 H new ATOM 0 HD3 ARG A 91 -6.333 7.417 -13.751 1.00 33.02 H new ATOM 0 HE ARG A 91 -6.960 6.210 -11.339 1.00 31.01 H new ATOM 0 HH11 ARG A 91 -4.168 6.193 -13.500 1.00 12.24 H new ATOM 0 HH12 ARG A 91 -3.009 5.940 -12.191 1.00 12.24 H new ATOM 0 HH21 ARG A 91 -5.467 5.887 -9.662 1.00 64.23 H new ATOM 0 HH22 ARG A 91 -3.743 5.767 -10.026 1.00 64.23 H new ATOM 1452 N ILE A 92 -9.748 2.104 -15.366 1.00 64.22 N ATOM 1453 CA ILE A 92 -11.027 1.407 -15.383 1.00 2.52 C ATOM 1454 C ILE A 92 -11.134 0.426 -14.220 1.00 63.04 C ATOM 1455 O ILE A 92 -10.290 -0.456 -14.059 1.00 13.41 O ATOM 1456 CB ILE A 92 -11.233 0.641 -16.704 1.00 62.34 C ATOM 1457 CG1 ILE A 92 -10.935 1.551 -17.897 1.00 74.32 C ATOM 1458 CG2 ILE A 92 -12.652 0.099 -16.786 1.00 74.34 C ATOM 1459 CD1 ILE A 92 -11.100 0.866 -19.236 1.00 51.44 C ATOM 0 H ILE A 92 -8.981 1.589 -15.798 1.00 64.22 H new ATOM 0 HA ILE A 92 -11.802 2.168 -15.287 1.00 2.52 H new ATOM 0 HB ILE A 92 -10.541 -0.201 -16.731 1.00 62.34 H new ATOM 0 HG12 ILE A 92 -11.596 2.417 -17.857 1.00 74.32 H new ATOM 0 HG13 ILE A 92 -9.915 1.925 -17.813 1.00 74.32 H new ATOM 0 HG21 ILE A 92 -12.782 -0.440 -17.725 1.00 74.34 H new ATOM 0 HG22 ILE A 92 -12.832 -0.578 -15.951 1.00 74.34 H new ATOM 0 HG23 ILE A 92 -13.361 0.926 -16.741 1.00 74.34 H new ATOM 0 HD11 ILE A 92 -10.873 1.571 -20.036 1.00 51.44 H new ATOM 0 HD12 ILE A 92 -10.420 0.017 -19.296 1.00 51.44 H new ATOM 0 HD13 ILE A 92 -12.127 0.516 -19.342 1.00 51.44 H new ATOM 1471 N ASP A 93 -12.176 0.586 -13.412 1.00 72.04 N ATOM 1472 CA ASP A 93 -12.395 -0.286 -12.265 1.00 73.12 C ATOM 1473 C ASP A 93 -13.592 -1.202 -12.500 1.00 0.43 C ATOM 1474 O ASP A 93 -14.743 -0.774 -12.406 1.00 30.52 O ATOM 1475 CB ASP A 93 -12.615 0.545 -10.999 1.00 70.31 C ATOM 1476 CG ASP A 93 -13.455 1.781 -11.257 1.00 71.34 C ATOM 1477 OD1 ASP A 93 -12.889 2.800 -11.705 1.00 64.44 O ATOM 1478 OD2 ASP A 93 -14.677 1.728 -11.012 1.00 53.20 O ATOM 0 H ASP A 93 -12.883 1.312 -13.531 1.00 72.04 H new ATOM 0 HA ASP A 93 -11.506 -0.904 -12.135 1.00 73.12 H new ATOM 0 HB2 ASP A 93 -13.103 -0.071 -10.244 1.00 70.31 H new ATOM 0 HB3 ASP A 93 -11.649 0.844 -10.592 1.00 70.31 H new ATOM 1483 N VAL A 94 -13.313 -2.465 -12.806 1.00 1.22 N ATOM 1484 CA VAL A 94 -14.366 -3.442 -13.054 1.00 20.14 C ATOM 1485 C VAL A 94 -14.419 -4.487 -11.945 1.00 31.54 C ATOM 1486 O VAL A 94 -13.539 -4.543 -11.087 1.00 41.50 O ATOM 1487 CB VAL A 94 -14.165 -4.154 -14.406 1.00 42.14 C ATOM 1488 CG1 VAL A 94 -14.230 -3.153 -15.550 1.00 23.45 C ATOM 1489 CG2 VAL A 94 -12.844 -4.906 -14.419 1.00 24.24 C ATOM 0 H VAL A 94 -12.366 -2.836 -12.888 1.00 1.22 H new ATOM 0 HA VAL A 94 -15.307 -2.893 -13.077 1.00 20.14 H new ATOM 0 HB VAL A 94 -14.970 -4.877 -14.541 1.00 42.14 H new ATOM 0 HG11 VAL A 94 -14.086 -3.673 -16.497 1.00 23.45 H new ATOM 0 HG12 VAL A 94 -15.203 -2.663 -15.550 1.00 23.45 H new ATOM 0 HG13 VAL A 94 -13.447 -2.405 -15.424 1.00 23.45 H new ATOM 0 HG21 VAL A 94 -12.718 -5.403 -15.381 1.00 24.24 H new ATOM 0 HG22 VAL A 94 -12.024 -4.205 -14.263 1.00 24.24 H new ATOM 0 HG23 VAL A 94 -12.841 -5.650 -13.623 1.00 24.24 H new ATOM 1499 N LYS A 95 -15.457 -5.316 -11.970 1.00 55.13 N ATOM 1500 CA LYS A 95 -15.626 -6.362 -10.969 1.00 14.31 C ATOM 1501 C LYS A 95 -15.255 -7.727 -11.539 1.00 24.33 C ATOM 1502 O LYS A 95 -14.772 -8.601 -10.819 1.00 71.22 O ATOM 1503 CB LYS A 95 -17.070 -6.385 -10.463 1.00 54.30 C ATOM 1504 CG LYS A 95 -17.444 -5.169 -9.633 1.00 63.51 C ATOM 1505 CD LYS A 95 -18.943 -5.098 -9.390 1.00 4.10 C ATOM 1506 CE LYS A 95 -19.525 -3.781 -9.880 1.00 0.01 C ATOM 1507 NZ LYS A 95 -19.280 -2.673 -8.915 1.00 3.54 N ATOM 0 H LYS A 95 -16.195 -5.283 -12.674 1.00 55.13 H new ATOM 0 HA LYS A 95 -14.959 -6.142 -10.136 1.00 14.31 H new ATOM 0 HB2 LYS A 95 -17.744 -6.453 -11.317 1.00 54.30 H new ATOM 0 HB3 LYS A 95 -17.222 -7.283 -9.865 1.00 54.30 H new ATOM 0 HG2 LYS A 95 -16.921 -5.205 -8.677 1.00 63.51 H new ATOM 0 HG3 LYS A 95 -17.114 -4.264 -10.143 1.00 63.51 H new ATOM 0 HD2 LYS A 95 -19.435 -5.926 -9.900 1.00 4.10 H new ATOM 0 HD3 LYS A 95 -19.146 -5.213 -8.325 1.00 4.10 H new ATOM 0 HE2 LYS A 95 -19.086 -3.526 -10.845 1.00 0.01 H new ATOM 0 HE3 LYS A 95 -20.597 -3.894 -10.038 1.00 0.01 H new ATOM 0 HZ1 LYS A 95 -19.692 -1.793 -9.285 1.00 3.54 H new ATOM 0 HZ2 LYS A 95 -19.721 -2.904 -8.002 1.00 3.54 H new ATOM 0 HZ3 LYS A 95 -18.256 -2.547 -8.783 1.00 3.54 H new ATOM 1521 N ASP A 96 -15.481 -7.902 -12.837 1.00 52.41 N ATOM 1522 CA ASP A 96 -15.168 -9.160 -13.504 1.00 41.22 C ATOM 1523 C ASP A 96 -14.533 -8.907 -14.868 1.00 11.20 C ATOM 1524 O ASP A 96 -14.323 -7.761 -15.265 1.00 75.54 O ATOM 1525 CB ASP A 96 -16.432 -10.006 -13.665 1.00 73.53 C ATOM 1526 CG ASP A 96 -17.645 -9.171 -14.026 1.00 61.42 C ATOM 1527 OD1 ASP A 96 -17.852 -8.914 -15.231 1.00 60.33 O ATOM 1528 OD2 ASP A 96 -18.388 -8.775 -13.104 1.00 31.51 O ATOM 0 H ASP A 96 -15.880 -7.189 -13.447 1.00 52.41 H new ATOM 0 HA ASP A 96 -14.454 -9.703 -12.885 1.00 41.22 H new ATOM 0 HB2 ASP A 96 -16.268 -10.756 -14.439 1.00 73.53 H new ATOM 0 HB3 ASP A 96 -16.627 -10.543 -12.737 1.00 73.53 H new ATOM 1533 N THR A 97 -14.227 -9.986 -15.582 1.00 3.43 N ATOM 1534 CA THR A 97 -13.613 -9.882 -16.900 1.00 11.32 C ATOM 1535 C THR A 97 -14.662 -9.622 -17.975 1.00 40.21 C ATOM 1536 O THR A 97 -14.362 -9.050 -19.023 1.00 21.42 O ATOM 1537 CB THR A 97 -12.833 -11.161 -17.259 1.00 12.40 C ATOM 1538 OG1 THR A 97 -11.800 -11.392 -16.293 1.00 33.23 O ATOM 1539 CG2 THR A 97 -12.220 -11.049 -18.646 1.00 20.13 C ATOM 0 H THR A 97 -14.395 -10.942 -15.269 1.00 3.43 H new ATOM 0 HA THR A 97 -12.920 -9.042 -16.861 1.00 11.32 H new ATOM 0 HB THR A 97 -13.530 -11.999 -17.253 1.00 12.40 H new ATOM 0 HG1 THR A 97 -12.013 -12.194 -15.771 1.00 33.23 H new ATOM 0 HG21 THR A 97 -11.674 -11.964 -18.878 1.00 20.13 H new ATOM 0 HG22 THR A 97 -13.010 -10.902 -19.382 1.00 20.13 H new ATOM 0 HG23 THR A 97 -11.535 -10.201 -18.674 1.00 20.13 H new ATOM 1547 N LYS A 98 -15.893 -10.044 -17.709 1.00 22.21 N ATOM 1548 CA LYS A 98 -16.989 -9.855 -18.653 1.00 44.23 C ATOM 1549 C LYS A 98 -17.314 -8.374 -18.818 1.00 33.21 C ATOM 1550 O LYS A 98 -17.520 -7.896 -19.933 1.00 44.23 O ATOM 1551 CB LYS A 98 -18.232 -10.613 -18.182 1.00 43.31 C ATOM 1552 CG LYS A 98 -19.402 -10.518 -19.144 1.00 11.12 C ATOM 1553 CD LYS A 98 -19.750 -11.874 -19.735 1.00 14.12 C ATOM 1554 CE LYS A 98 -20.796 -11.752 -20.833 1.00 21.40 C ATOM 1555 NZ LYS A 98 -21.305 -13.083 -21.264 1.00 72.30 N ATOM 0 H LYS A 98 -16.158 -10.520 -16.846 1.00 22.21 H new ATOM 0 HA LYS A 98 -16.676 -10.250 -19.620 1.00 44.23 H new ATOM 0 HB2 LYS A 98 -17.975 -11.662 -18.038 1.00 43.31 H new ATOM 0 HB3 LYS A 98 -18.538 -10.224 -17.211 1.00 43.31 H new ATOM 0 HG2 LYS A 98 -20.270 -10.113 -18.624 1.00 11.12 H new ATOM 0 HG3 LYS A 98 -19.159 -9.822 -19.947 1.00 11.12 H new ATOM 0 HD2 LYS A 98 -18.850 -12.338 -20.138 1.00 14.12 H new ATOM 0 HD3 LYS A 98 -20.122 -12.530 -18.948 1.00 14.12 H new ATOM 0 HE2 LYS A 98 -21.627 -11.143 -20.477 1.00 21.40 H new ATOM 0 HE3 LYS A 98 -20.365 -11.233 -21.689 1.00 21.40 H new ATOM 0 HZ1 LYS A 98 -22.015 -12.957 -22.013 1.00 72.30 H new ATOM 0 HZ2 LYS A 98 -20.516 -13.655 -21.628 1.00 72.30 H new ATOM 0 HZ3 LYS A 98 -21.739 -13.568 -20.453 1.00 72.30 H new ATOM 1569 N GLU A 99 -17.359 -7.655 -17.701 1.00 52.13 N ATOM 1570 CA GLU A 99 -17.660 -6.228 -17.724 1.00 53.42 C ATOM 1571 C GLU A 99 -16.497 -5.436 -18.314 1.00 43.52 C ATOM 1572 O GLU A 99 -16.698 -4.502 -19.090 1.00 12.24 O ATOM 1573 CB GLU A 99 -17.968 -5.726 -16.311 1.00 31.02 C ATOM 1574 CG GLU A 99 -19.455 -5.644 -16.006 1.00 45.40 C ATOM 1575 CD GLU A 99 -20.163 -4.590 -16.834 1.00 12.15 C ATOM 1576 OE1 GLU A 99 -20.070 -3.396 -16.482 1.00 25.32 O ATOM 1577 OE2 GLU A 99 -20.811 -4.961 -17.835 1.00 33.20 O ATOM 0 H GLU A 99 -17.191 -8.036 -16.770 1.00 52.13 H new ATOM 0 HA GLU A 99 -18.536 -6.078 -18.355 1.00 53.42 H new ATOM 0 HB2 GLU A 99 -17.493 -6.388 -15.587 1.00 31.02 H new ATOM 0 HB3 GLU A 99 -17.524 -4.739 -16.180 1.00 31.02 H new ATOM 0 HG2 GLU A 99 -19.914 -6.615 -16.191 1.00 45.40 H new ATOM 0 HG3 GLU A 99 -19.593 -5.423 -14.948 1.00 45.40 H new ATOM 1584 N ALA A 100 -15.280 -5.816 -17.940 1.00 10.12 N ATOM 1585 CA ALA A 100 -14.085 -5.143 -18.432 1.00 5.44 C ATOM 1586 C ALA A 100 -13.960 -5.283 -19.945 1.00 70.51 C ATOM 1587 O ALA A 100 -13.494 -4.368 -20.627 1.00 30.13 O ATOM 1588 CB ALA A 100 -12.846 -5.699 -17.746 1.00 4.45 C ATOM 0 H ALA A 100 -15.096 -6.587 -17.298 1.00 10.12 H new ATOM 0 HA ALA A 100 -14.173 -4.082 -18.197 1.00 5.44 H new ATOM 0 HB1 ALA A 100 -11.961 -5.187 -18.123 1.00 4.45 H new ATOM 0 HB2 ALA A 100 -12.925 -5.543 -16.670 1.00 4.45 H new ATOM 0 HB3 ALA A 100 -12.764 -6.766 -17.953 1.00 4.45 H new ATOM 1594 N LEU A 101 -14.378 -6.432 -20.465 1.00 62.21 N ATOM 1595 CA LEU A 101 -14.313 -6.691 -21.899 1.00 4.14 C ATOM 1596 C LEU A 101 -15.245 -5.757 -22.665 1.00 44.12 C ATOM 1597 O LEU A 101 -14.904 -5.273 -23.744 1.00 74.40 O ATOM 1598 CB LEU A 101 -14.679 -8.147 -22.192 1.00 42.43 C ATOM 1599 CG LEU A 101 -14.019 -8.772 -23.421 1.00 41.30 C ATOM 1600 CD1 LEU A 101 -14.352 -7.971 -24.671 1.00 1.30 C ATOM 1601 CD2 LEU A 101 -12.512 -8.862 -23.229 1.00 23.03 C ATOM 0 H LEU A 101 -14.765 -7.199 -19.915 1.00 62.21 H new ATOM 0 HA LEU A 101 -13.291 -6.506 -22.230 1.00 4.14 H new ATOM 0 HB2 LEU A 101 -14.420 -8.748 -21.320 1.00 42.43 H new ATOM 0 HB3 LEU A 101 -15.760 -8.211 -22.313 1.00 42.43 H new ATOM 0 HG LEU A 101 -14.410 -9.782 -23.546 1.00 41.30 H new ATOM 0 HD11 LEU A 101 -13.874 -8.431 -25.536 1.00 1.30 H new ATOM 0 HD12 LEU A 101 -15.432 -7.958 -24.818 1.00 1.30 H new ATOM 0 HD13 LEU A 101 -13.989 -6.950 -24.556 1.00 1.30 H new ATOM 0 HD21 LEU A 101 -12.059 -9.309 -24.114 1.00 23.03 H new ATOM 0 HD22 LEU A 101 -12.104 -7.863 -23.078 1.00 23.03 H new ATOM 0 HD23 LEU A 101 -12.292 -9.479 -22.357 1.00 23.03 H new ATOM 1613 N ASP A 102 -16.418 -5.506 -22.098 1.00 54.52 N ATOM 1614 CA ASP A 102 -17.399 -4.627 -22.724 1.00 71.11 C ATOM 1615 C ASP A 102 -16.891 -3.189 -22.764 1.00 13.00 C ATOM 1616 O ASP A 102 -17.143 -2.456 -23.722 1.00 12.45 O ATOM 1617 CB ASP A 102 -18.729 -4.691 -21.971 1.00 65.02 C ATOM 1618 CG ASP A 102 -19.527 -5.935 -22.311 1.00 73.42 C ATOM 1619 OD1 ASP A 102 -19.629 -6.264 -23.511 1.00 13.23 O ATOM 1620 OD2 ASP A 102 -20.049 -6.578 -21.377 1.00 44.13 O ATOM 0 H ASP A 102 -16.714 -5.899 -21.205 1.00 54.52 H new ATOM 0 HA ASP A 102 -17.555 -4.968 -23.748 1.00 71.11 H new ATOM 0 HB2 ASP A 102 -18.537 -4.668 -20.898 1.00 65.02 H new ATOM 0 HB3 ASP A 102 -19.321 -3.807 -22.209 1.00 65.02 H new ATOM 1625 N LYS A 103 -16.177 -2.789 -21.718 1.00 4.14 N ATOM 1626 CA LYS A 103 -15.633 -1.440 -21.632 1.00 53.12 C ATOM 1627 C LYS A 103 -14.618 -1.190 -22.743 1.00 1.23 C ATOM 1628 O LYS A 103 -14.546 -0.092 -23.295 1.00 74.21 O ATOM 1629 CB LYS A 103 -14.977 -1.217 -20.268 1.00 2.41 C ATOM 1630 CG LYS A 103 -14.809 0.248 -19.905 1.00 5.31 C ATOM 1631 CD LYS A 103 -16.064 0.810 -19.261 1.00 72.45 C ATOM 1632 CE LYS A 103 -16.520 2.087 -19.953 1.00 43.24 C ATOM 1633 NZ LYS A 103 -17.910 2.458 -19.572 1.00 14.42 N ATOM 0 H LYS A 103 -15.961 -3.382 -20.916 1.00 4.14 H new ATOM 0 HA LYS A 103 -16.457 -0.736 -21.751 1.00 53.12 H new ATOM 0 HB2 LYS A 103 -15.578 -1.706 -19.501 1.00 2.41 H new ATOM 0 HB3 LYS A 103 -13.999 -1.698 -20.262 1.00 2.41 H new ATOM 0 HG2 LYS A 103 -13.967 0.360 -19.222 1.00 5.31 H new ATOM 0 HG3 LYS A 103 -14.571 0.821 -20.801 1.00 5.31 H new ATOM 0 HD2 LYS A 103 -16.860 0.067 -19.304 1.00 72.45 H new ATOM 0 HD3 LYS A 103 -15.874 1.013 -18.207 1.00 72.45 H new ATOM 0 HE2 LYS A 103 -15.843 2.901 -19.695 1.00 43.24 H new ATOM 0 HE3 LYS A 103 -16.463 1.955 -21.033 1.00 43.24 H new ATOM 0 HZ1 LYS A 103 -18.183 3.333 -20.064 1.00 14.42 H new ATOM 0 HZ2 LYS A 103 -18.560 1.692 -19.841 1.00 14.42 H new ATOM 0 HZ3 LYS A 103 -17.960 2.609 -18.544 1.00 14.42 H new ATOM 1647 N ILE A 104 -13.837 -2.216 -23.066 1.00 54.23 N ATOM 1648 CA ILE A 104 -12.828 -2.106 -24.113 1.00 0.43 C ATOM 1649 C ILE A 104 -13.466 -2.145 -25.497 1.00 53.41 C ATOM 1650 O ILE A 104 -12.942 -1.567 -26.448 1.00 33.43 O ATOM 1651 CB ILE A 104 -11.786 -3.235 -24.008 1.00 30.20 C ATOM 1652 CG1 ILE A 104 -11.111 -3.212 -22.636 1.00 51.24 C ATOM 1653 CG2 ILE A 104 -10.750 -3.103 -25.116 1.00 41.35 C ATOM 1654 CD1 ILE A 104 -10.379 -4.492 -22.300 1.00 51.24 C ATOM 0 H ILE A 104 -13.883 -3.131 -22.618 1.00 54.23 H new ATOM 0 HA ILE A 104 -12.329 -1.147 -23.973 1.00 0.43 H new ATOM 0 HB ILE A 104 -12.296 -4.191 -24.124 1.00 30.20 H new ATOM 0 HG12 ILE A 104 -10.407 -2.381 -22.601 1.00 51.24 H new ATOM 0 HG13 ILE A 104 -11.865 -3.024 -21.872 1.00 51.24 H new ATOM 0 HG21 ILE A 104 -10.020 -3.908 -25.029 1.00 41.35 H new ATOM 0 HG22 ILE A 104 -11.244 -3.165 -26.086 1.00 41.35 H new ATOM 0 HG23 ILE A 104 -10.243 -2.142 -25.028 1.00 41.35 H new ATOM 0 HD11 ILE A 104 -9.925 -4.403 -21.313 1.00 51.24 H new ATOM 0 HD12 ILE A 104 -11.082 -5.325 -22.302 1.00 51.24 H new ATOM 0 HD13 ILE A 104 -9.601 -4.672 -23.042 1.00 51.24 H new ATOM 1666 N GLU A 105 -14.602 -2.829 -25.601 1.00 55.23 N ATOM 1667 CA GLU A 105 -15.312 -2.941 -26.869 1.00 2.00 C ATOM 1668 C GLU A 105 -16.103 -1.671 -27.165 1.00 55.51 C ATOM 1669 O GLU A 105 -16.259 -1.279 -28.320 1.00 34.11 O ATOM 1670 CB GLU A 105 -16.253 -4.148 -26.846 1.00 72.53 C ATOM 1671 CG GLU A 105 -16.853 -4.477 -28.203 1.00 2.21 C ATOM 1672 CD GLU A 105 -17.246 -5.937 -28.329 1.00 62.22 C ATOM 1673 OE1 GLU A 105 -18.380 -6.282 -27.937 1.00 24.44 O ATOM 1674 OE2 GLU A 105 -16.418 -6.732 -28.819 1.00 23.01 O ATOM 0 H GLU A 105 -15.049 -3.313 -24.823 1.00 55.23 H new ATOM 0 HA GLU A 105 -14.573 -3.079 -27.659 1.00 2.00 H new ATOM 0 HB2 GLU A 105 -15.707 -5.017 -26.479 1.00 72.53 H new ATOM 0 HB3 GLU A 105 -17.059 -3.956 -26.138 1.00 72.53 H new ATOM 0 HG2 GLU A 105 -17.731 -3.853 -28.369 1.00 2.21 H new ATOM 0 HG3 GLU A 105 -16.134 -4.230 -28.984 1.00 2.21 H new ATOM 1681 N GLU A 106 -16.601 -1.032 -26.110 1.00 63.13 N ATOM 1682 CA GLU A 106 -17.377 0.194 -26.257 1.00 50.41 C ATOM 1683 C GLU A 106 -16.460 1.410 -26.356 1.00 0.45 C ATOM 1684 O GLU A 106 -16.748 2.358 -27.086 1.00 51.04 O ATOM 1685 CB GLU A 106 -18.337 0.361 -25.076 1.00 24.04 C ATOM 1686 CG GLU A 106 -19.793 0.130 -25.439 1.00 13.00 C ATOM 1687 CD GLU A 106 -20.607 -0.403 -24.276 1.00 31.43 C ATOM 1688 OE1 GLU A 106 -20.582 0.225 -23.197 1.00 53.03 O ATOM 1689 OE2 GLU A 106 -21.269 -1.449 -24.444 1.00 60.44 O ATOM 0 H GLU A 106 -16.481 -1.343 -25.146 1.00 63.13 H new ATOM 0 HA GLU A 106 -17.954 0.120 -27.178 1.00 50.41 H new ATOM 0 HB2 GLU A 106 -18.053 -0.335 -24.287 1.00 24.04 H new ATOM 0 HB3 GLU A 106 -18.228 1.366 -24.669 1.00 24.04 H new ATOM 0 HG2 GLU A 106 -20.230 1.067 -25.785 1.00 13.00 H new ATOM 0 HG3 GLU A 106 -19.849 -0.574 -26.270 1.00 13.00 H new ATOM 1696 N GLU A 107 -15.356 1.374 -25.617 1.00 22.25 N ATOM 1697 CA GLU A 107 -14.398 2.472 -25.621 1.00 73.23 C ATOM 1698 C GLU A 107 -13.695 2.577 -26.973 1.00 15.41 C ATOM 1699 O GLU A 107 -13.575 3.664 -27.538 1.00 12.41 O ATOM 1700 CB GLU A 107 -13.364 2.282 -24.510 1.00 4.30 C ATOM 1701 CG GLU A 107 -12.225 3.286 -24.559 1.00 65.13 C ATOM 1702 CD GLU A 107 -11.174 3.030 -23.496 1.00 22.23 C ATOM 1703 OE1 GLU A 107 -10.511 1.974 -23.562 1.00 23.14 O ATOM 1704 OE2 GLU A 107 -11.016 3.883 -22.599 1.00 73.53 O ATOM 0 H GLU A 107 -15.103 0.596 -25.008 1.00 22.25 H new ATOM 0 HA GLU A 107 -14.946 3.397 -25.443 1.00 73.23 H new ATOM 0 HB2 GLU A 107 -13.863 2.359 -23.544 1.00 4.30 H new ATOM 0 HB3 GLU A 107 -12.952 1.275 -24.577 1.00 4.30 H new ATOM 0 HG2 GLU A 107 -11.757 3.251 -25.543 1.00 65.13 H new ATOM 0 HG3 GLU A 107 -12.626 4.291 -24.433 1.00 65.13 H new ATOM 1711 N GLN A 108 -13.234 1.440 -27.482 1.00 1.13 N ATOM 1712 CA GLN A 108 -12.543 1.404 -28.765 1.00 22.34 C ATOM 1713 C GLN A 108 -13.392 2.045 -29.859 1.00 31.14 C ATOM 1714 O GLN A 108 -12.865 2.641 -30.797 1.00 12.04 O ATOM 1715 CB GLN A 108 -12.205 -0.039 -29.146 1.00 72.25 C ATOM 1716 CG GLN A 108 -11.325 -0.152 -30.381 1.00 72.21 C ATOM 1717 CD GLN A 108 -10.249 -1.209 -30.236 1.00 41.11 C ATOM 1718 OE1 GLN A 108 -9.082 -0.971 -30.551 1.00 40.01 O ATOM 1719 NE2 GLN A 108 -10.634 -2.385 -29.756 1.00 34.22 N ATOM 0 H GLN A 108 -13.326 0.532 -27.026 1.00 1.13 H new ATOM 0 HA GLN A 108 -11.618 1.973 -28.667 1.00 22.34 H new ATOM 0 HB2 GLN A 108 -11.702 -0.519 -28.307 1.00 72.25 H new ATOM 0 HB3 GLN A 108 -13.131 -0.587 -29.319 1.00 72.25 H new ATOM 0 HG2 GLN A 108 -11.946 -0.388 -31.245 1.00 72.21 H new ATOM 0 HG3 GLN A 108 -10.857 0.812 -30.579 1.00 72.21 H new ATOM 0 HE21 GLN A 108 -11.611 -2.539 -29.508 1.00 34.22 H new ATOM 0 HE22 GLN A 108 -9.953 -3.134 -29.635 1.00 34.22 H new ATOM 1728 N ASN A 109 -14.708 1.916 -29.731 1.00 55.52 N ATOM 1729 CA ASN A 109 -15.630 2.483 -30.709 1.00 10.04 C ATOM 1730 C ASN A 109 -15.792 3.985 -30.499 1.00 44.52 C ATOM 1731 O ASN A 109 -15.902 4.749 -31.457 1.00 34.31 O ATOM 1732 CB ASN A 109 -16.993 1.794 -30.615 1.00 15.51 C ATOM 1733 CG ASN A 109 -17.580 1.484 -31.978 1.00 61.13 C ATOM 1734 OD1 ASN A 109 -17.206 2.093 -32.981 1.00 41.23 O ATOM 1735 ND2 ASN A 109 -18.505 0.533 -32.022 1.00 14.10 N ATOM 0 H ASN A 109 -15.160 1.424 -28.960 1.00 55.52 H new ATOM 0 HA ASN A 109 -15.213 2.316 -31.702 1.00 10.04 H new ATOM 0 HB2 ASN A 109 -16.891 0.869 -30.048 1.00 15.51 H new ATOM 0 HB3 ASN A 109 -17.682 2.432 -30.062 1.00 15.51 H new ATOM 0 HD21 ASN A 109 -18.936 0.281 -32.912 1.00 14.10 H new ATOM 0 HD22 ASN A 109 -18.785 0.054 -31.166 1.00 14.10 H new ATOM 1742 N LYS A 110 -15.802 4.402 -29.237 1.00 33.30 N ATOM 1743 CA LYS A 110 -15.948 5.813 -28.899 1.00 11.11 C ATOM 1744 C LYS A 110 -14.747 6.617 -29.388 1.00 3.13 C ATOM 1745 O LYS A 110 -14.883 7.774 -29.785 1.00 25.41 O ATOM 1746 CB LYS A 110 -16.107 5.983 -27.386 1.00 4.32 C ATOM 1747 CG LYS A 110 -17.538 5.828 -26.904 1.00 11.41 C ATOM 1748 CD LYS A 110 -18.139 7.164 -26.501 1.00 44.54 C ATOM 1749 CE LYS A 110 -18.092 7.364 -24.993 1.00 2.52 C ATOM 1750 NZ LYS A 110 -19.433 7.198 -24.369 1.00 34.33 N ATOM 0 H LYS A 110 -15.711 3.783 -28.432 1.00 33.30 H new ATOM 0 HA LYS A 110 -16.842 6.189 -29.397 1.00 11.11 H new ATOM 0 HB2 LYS A 110 -15.480 5.250 -26.879 1.00 4.32 H new ATOM 0 HB3 LYS A 110 -15.741 6.969 -27.099 1.00 4.32 H new ATOM 0 HG2 LYS A 110 -18.142 5.380 -27.693 1.00 11.41 H new ATOM 0 HG3 LYS A 110 -17.565 5.145 -26.055 1.00 11.41 H new ATOM 0 HD2 LYS A 110 -17.597 7.971 -26.993 1.00 44.54 H new ATOM 0 HD3 LYS A 110 -19.172 7.218 -26.844 1.00 44.54 H new ATOM 0 HE2 LYS A 110 -17.396 6.649 -24.554 1.00 2.52 H new ATOM 0 HE3 LYS A 110 -17.709 8.360 -24.771 1.00 2.52 H new ATOM 0 HZ1 LYS A 110 -19.358 7.342 -23.342 1.00 34.33 H new ATOM 0 HZ2 LYS A 110 -20.091 7.897 -24.770 1.00 34.33 H new ATOM 0 HZ3 LYS A 110 -19.788 6.239 -24.559 1.00 34.33 H new ATOM 1764 N SER A 111 -13.573 5.995 -29.357 1.00 43.52 N ATOM 1765 CA SER A 111 -12.347 6.654 -29.794 1.00 32.44 C ATOM 1766 C SER A 111 -12.451 7.075 -31.257 1.00 44.11 C ATOM 1767 O SER A 111 -11.856 8.070 -31.672 1.00 62.11 O ATOM 1768 CB SER A 111 -11.148 5.724 -29.604 1.00 44.22 C ATOM 1769 OG SER A 111 -10.091 6.386 -28.930 1.00 61.13 O ATOM 0 H SER A 111 -13.444 5.036 -29.034 1.00 43.52 H new ATOM 0 HA SER A 111 -12.205 7.547 -29.185 1.00 32.44 H new ATOM 0 HB2 SER A 111 -11.452 4.845 -29.036 1.00 44.22 H new ATOM 0 HB3 SER A 111 -10.800 5.371 -30.575 1.00 44.22 H new ATOM 0 HG SER A 111 -9.337 5.770 -28.819 1.00 61.13 H new ATOM 1775 N LYS A 112 -13.210 6.311 -32.034 1.00 75.51 N ATOM 1776 CA LYS A 112 -13.394 6.604 -33.451 1.00 33.33 C ATOM 1777 C LYS A 112 -14.117 7.933 -33.643 1.00 12.22 C ATOM 1778 O LYS A 112 -13.878 8.647 -34.617 1.00 70.10 O ATOM 1779 CB LYS A 112 -14.182 5.480 -34.127 1.00 13.30 C ATOM 1780 CG LYS A 112 -13.975 5.410 -35.630 1.00 24.43 C ATOM 1781 CD LYS A 112 -12.655 4.742 -35.981 1.00 51.54 C ATOM 1782 CE LYS A 112 -12.847 3.625 -36.995 1.00 54.13 C ATOM 1783 NZ LYS A 112 -13.208 4.153 -38.339 1.00 54.10 N ATOM 0 H LYS A 112 -13.708 5.483 -31.707 1.00 75.51 H new ATOM 0 HA LYS A 112 -12.409 6.677 -33.912 1.00 33.33 H new ATOM 0 HB2 LYS A 112 -13.892 4.527 -33.684 1.00 13.30 H new ATOM 0 HB3 LYS A 112 -15.244 5.617 -33.921 1.00 13.30 H new ATOM 0 HG2 LYS A 112 -14.796 4.857 -36.086 1.00 24.43 H new ATOM 0 HG3 LYS A 112 -13.997 6.416 -36.049 1.00 24.43 H new ATOM 0 HD2 LYS A 112 -11.966 5.485 -36.383 1.00 51.54 H new ATOM 0 HD3 LYS A 112 -12.198 4.339 -35.077 1.00 51.54 H new ATOM 0 HE2 LYS A 112 -11.930 3.040 -37.069 1.00 54.13 H new ATOM 0 HE3 LYS A 112 -13.629 2.950 -36.648 1.00 54.13 H new ATOM 0 HZ1 LYS A 112 -13.330 3.361 -39.002 1.00 54.10 H new ATOM 0 HZ2 LYS A 112 -14.096 4.690 -38.274 1.00 54.10 H new ATOM 0 HZ3 LYS A 112 -12.450 4.777 -38.682 1.00 54.10 H new ATOM 1797 N LYS A 113 -15.002 8.259 -32.707 1.00 64.44 N ATOM 1798 CA LYS A 113 -15.758 9.504 -32.771 1.00 53.55 C ATOM 1799 C LYS A 113 -15.021 10.628 -32.049 1.00 4.30 C ATOM 1800 O LYS A 113 -15.185 11.803 -32.374 1.00 34.31 O ATOM 1801 CB LYS A 113 -17.147 9.314 -32.156 1.00 41.42 C ATOM 1802 CG LYS A 113 -18.245 9.111 -33.185 1.00 14.41 C ATOM 1803 CD LYS A 113 -18.008 7.860 -34.014 1.00 22.14 C ATOM 1804 CE LYS A 113 -17.911 8.185 -35.497 1.00 53.10 C ATOM 1805 NZ LYS A 113 -16.976 7.267 -36.205 1.00 33.41 N ATOM 0 H LYS A 113 -15.213 7.678 -31.895 1.00 64.44 H new ATOM 0 HA LYS A 113 -15.866 9.780 -33.820 1.00 53.55 H new ATOM 0 HB2 LYS A 113 -17.124 8.454 -31.487 1.00 41.42 H new ATOM 0 HB3 LYS A 113 -17.388 10.185 -31.547 1.00 41.42 H new ATOM 0 HG2 LYS A 113 -19.208 9.037 -32.681 1.00 14.41 H new ATOM 0 HG3 LYS A 113 -18.295 9.980 -33.842 1.00 14.41 H new ATOM 0 HD2 LYS A 113 -17.089 7.373 -33.686 1.00 22.14 H new ATOM 0 HD3 LYS A 113 -18.820 7.153 -33.848 1.00 22.14 H new ATOM 0 HE2 LYS A 113 -18.900 8.116 -35.950 1.00 53.10 H new ATOM 0 HE3 LYS A 113 -17.574 9.214 -35.622 1.00 53.10 H new ATOM 0 HZ1 LYS A 113 -16.937 7.521 -37.213 1.00 33.41 H new ATOM 0 HZ2 LYS A 113 -16.026 7.351 -35.790 1.00 33.41 H new ATOM 0 HZ3 LYS A 113 -17.311 6.287 -36.107 1.00 33.41 H new ATOM 1819 N LYS A 114 -14.206 10.257 -31.066 1.00 62.35 N ATOM 1820 CA LYS A 114 -13.439 11.232 -30.299 1.00 72.11 C ATOM 1821 C LYS A 114 -11.972 11.221 -30.716 1.00 11.20 C ATOM 1822 O LYS A 114 -11.088 11.515 -29.913 1.00 24.31 O ATOM 1823 CB LYS A 114 -13.557 10.940 -28.802 1.00 73.10 C ATOM 1824 CG LYS A 114 -13.879 12.166 -27.965 1.00 63.44 C ATOM 1825 CD LYS A 114 -14.345 11.784 -26.571 1.00 71.25 C ATOM 1826 CE LYS A 114 -13.717 12.675 -25.510 1.00 11.02 C ATOM 1827 NZ LYS A 114 -14.593 12.815 -24.313 1.00 21.34 N ATOM 0 H LYS A 114 -14.060 9.288 -30.782 1.00 62.35 H new ATOM 0 HA LYS A 114 -13.849 12.221 -30.504 1.00 72.11 H new ATOM 0 HB2 LYS A 114 -14.333 10.191 -28.647 1.00 73.10 H new ATOM 0 HB3 LYS A 114 -12.621 10.506 -28.450 1.00 73.10 H new ATOM 0 HG2 LYS A 114 -12.996 12.800 -27.893 1.00 63.44 H new ATOM 0 HG3 LYS A 114 -14.653 12.752 -28.460 1.00 63.44 H new ATOM 0 HD2 LYS A 114 -15.431 11.860 -26.516 1.00 71.25 H new ATOM 0 HD3 LYS A 114 -14.088 10.743 -26.373 1.00 71.25 H new ATOM 0 HE2 LYS A 114 -12.755 12.259 -25.209 1.00 11.02 H new ATOM 0 HE3 LYS A 114 -13.520 13.660 -25.933 1.00 11.02 H new ATOM 0 HZ1 LYS A 114 -14.129 13.429 -23.614 1.00 21.34 H new ATOM 0 HZ2 LYS A 114 -15.502 13.235 -24.595 1.00 21.34 H new ATOM 0 HZ3 LYS A 114 -14.760 11.878 -23.894 1.00 21.34 H new ATOM 1841 N ALA A 115 -11.723 10.883 -31.977 1.00 10.45 N ATOM 1842 CA ALA A 115 -10.363 10.838 -32.500 1.00 0.03 C ATOM 1843 C ALA A 115 -9.794 12.242 -32.672 1.00 2.33 C ATOM 1844 O ALA A 115 -8.585 12.447 -32.567 1.00 53.43 O ATOM 1845 CB ALA A 115 -10.332 10.088 -33.824 1.00 21.21 C ATOM 0 H ALA A 115 -12.444 10.637 -32.655 1.00 10.45 H new ATOM 0 HA ALA A 115 -9.740 10.308 -31.779 1.00 0.03 H new ATOM 0 HB1 ALA A 115 -9.311 10.062 -34.204 1.00 21.21 H new ATOM 0 HB2 ALA A 115 -10.689 9.069 -33.674 1.00 21.21 H new ATOM 0 HB3 ALA A 115 -10.974 10.595 -34.544 1.00 21.21 H new ATOM 1851 N GLN A 116 -10.672 13.203 -32.939 1.00 12.54 N ATOM 1852 CA GLN A 116 -10.256 14.588 -33.126 1.00 23.15 C ATOM 1853 C GLN A 116 -10.457 15.395 -31.848 1.00 31.30 C ATOM 1854 O GLN A 116 -10.747 16.589 -31.898 1.00 71.35 O ATOM 1855 CB GLN A 116 -11.037 15.226 -34.276 1.00 4.33 C ATOM 1856 CG GLN A 116 -10.318 16.398 -34.924 1.00 43.41 C ATOM 1857 CD GLN A 116 -11.202 17.621 -35.063 1.00 13.15 C ATOM 1858 OE1 GLN A 116 -12.119 17.648 -35.884 1.00 23.12 O ATOM 1859 NE2 GLN A 116 -10.932 18.642 -34.258 1.00 61.41 N ATOM 0 H GLN A 116 -11.676 13.048 -33.031 1.00 12.54 H new ATOM 0 HA GLN A 116 -9.194 14.592 -33.372 1.00 23.15 H new ATOM 0 HB2 GLN A 116 -11.235 14.468 -35.034 1.00 4.33 H new ATOM 0 HB3 GLN A 116 -12.004 15.565 -33.904 1.00 4.33 H new ATOM 0 HG2 GLN A 116 -9.441 16.654 -34.330 1.00 43.41 H new ATOM 0 HG3 GLN A 116 -9.960 16.100 -35.909 1.00 43.41 H new ATOM 0 HE21 GLN A 116 -10.162 18.577 -33.592 1.00 61.41 H new ATOM 0 HE22 GLN A 116 -11.494 19.492 -34.306 1.00 61.41 H new ATOM 1868 N GLN A 117 -10.302 14.733 -30.705 1.00 34.41 N ATOM 1869 CA GLN A 117 -10.469 15.391 -29.415 1.00 5.03 C ATOM 1870 C GLN A 117 -9.503 14.816 -28.383 1.00 2.21 C ATOM 1871 O GLN A 117 -8.793 15.556 -27.704 1.00 51.03 O ATOM 1872 CB GLN A 117 -11.909 15.238 -28.923 1.00 25.13 C ATOM 1873 CG GLN A 117 -12.787 16.441 -29.229 1.00 45.24 C ATOM 1874 CD GLN A 117 -13.655 16.844 -28.053 1.00 0.32 C ATOM 1875 OE1 GLN A 117 -14.871 16.649 -28.068 1.00 3.23 O ATOM 1876 NE2 GLN A 117 -13.033 17.408 -27.024 1.00 14.12 N ATOM 0 H GLN A 117 -10.062 13.743 -30.647 1.00 34.41 H new ATOM 0 HA GLN A 117 -10.248 16.450 -29.544 1.00 5.03 H new ATOM 0 HB2 GLN A 117 -12.349 14.352 -29.381 1.00 25.13 H new ATOM 0 HB3 GLN A 117 -11.900 15.069 -27.846 1.00 25.13 H new ATOM 0 HG2 GLN A 117 -12.157 17.283 -29.516 1.00 45.24 H new ATOM 0 HG3 GLN A 117 -13.423 16.214 -30.084 1.00 45.24 H new ATOM 0 HE21 GLN A 117 -12.023 17.551 -27.054 1.00 14.12 H new ATOM 0 HE22 GLN A 117 -13.565 17.699 -26.204 1.00 14.12 H new ATOM 1885 N ALA A 118 -9.483 13.492 -28.272 1.00 53.23 N ATOM 1886 CA ALA A 118 -8.604 12.818 -27.324 1.00 31.42 C ATOM 1887 C ALA A 118 -7.153 13.243 -27.525 1.00 42.23 C ATOM 1888 O ALA A 118 -6.410 13.422 -26.560 1.00 13.02 O ATOM 1889 CB ALA A 118 -8.738 11.309 -27.462 1.00 40.42 C ATOM 0 H ALA A 118 -10.065 12.865 -28.827 1.00 53.23 H new ATOM 0 HA ALA A 118 -8.904 13.108 -26.317 1.00 31.42 H new ATOM 0 HB1 ALA A 118 -8.076 10.818 -26.748 1.00 40.42 H new ATOM 0 HB2 ALA A 118 -9.769 11.015 -27.262 1.00 40.42 H new ATOM 0 HB3 ALA A 118 -8.465 11.011 -28.474 1.00 40.42 H new ATOM 1895 N ALA A 119 -6.756 13.402 -28.783 1.00 21.03 N ATOM 1896 CA ALA A 119 -5.394 13.807 -29.108 1.00 63.44 C ATOM 1897 C ALA A 119 -5.034 15.122 -28.426 1.00 34.30 C ATOM 1898 O ALA A 119 -3.871 15.370 -28.109 1.00 42.33 O ATOM 1899 CB ALA A 119 -5.226 13.929 -30.616 1.00 63.32 C ATOM 0 H ALA A 119 -7.358 13.257 -29.594 1.00 21.03 H new ATOM 0 HA ALA A 119 -4.715 13.039 -28.738 1.00 63.44 H new ATOM 0 HB1 ALA A 119 -4.204 14.232 -30.845 1.00 63.32 H new ATOM 0 HB2 ALA A 119 -5.433 12.967 -31.084 1.00 63.32 H new ATOM 0 HB3 ALA A 119 -5.921 14.676 -31.000 1.00 63.32 H new ATOM 1905 N ALA A 120 -6.040 15.962 -28.203 1.00 5.40 N ATOM 1906 CA ALA A 120 -5.829 17.252 -27.557 1.00 22.03 C ATOM 1907 C ALA A 120 -6.377 17.249 -26.134 1.00 54.12 C ATOM 1908 O ALA A 120 -6.884 18.263 -25.652 1.00 3.32 O ATOM 1909 CB ALA A 120 -6.474 18.362 -28.372 1.00 51.32 C ATOM 0 H ALA A 120 -7.009 15.772 -28.460 1.00 5.40 H new ATOM 0 HA ALA A 120 -4.755 17.433 -27.504 1.00 22.03 H new ATOM 0 HB1 ALA A 120 -6.309 19.319 -27.878 1.00 51.32 H new ATOM 0 HB2 ALA A 120 -6.032 18.386 -29.368 1.00 51.32 H new ATOM 0 HB3 ALA A 120 -7.545 18.177 -28.455 1.00 51.32 H new ATOM 1915 N ASP A 121 -6.275 16.105 -25.467 1.00 21.21 N ATOM 1916 CA ASP A 121 -6.760 15.970 -24.099 1.00 54.24 C ATOM 1917 C ASP A 121 -5.883 15.010 -23.302 1.00 33.23 C ATOM 1918 O ASP A 121 -6.370 14.274 -22.443 1.00 72.43 O ATOM 1919 CB ASP A 121 -8.209 15.480 -24.096 1.00 15.21 C ATOM 1920 CG ASP A 121 -8.912 15.760 -22.782 1.00 34.12 C ATOM 1921 OD1 ASP A 121 -8.921 16.933 -22.352 1.00 75.01 O ATOM 1922 OD2 ASP A 121 -9.454 14.806 -22.184 1.00 62.44 O ATOM 0 H ASP A 121 -5.860 15.257 -25.852 1.00 21.21 H new ATOM 0 HA ASP A 121 -6.715 16.951 -23.625 1.00 54.24 H new ATOM 0 HB2 ASP A 121 -8.755 15.963 -24.907 1.00 15.21 H new ATOM 0 HB3 ASP A 121 -8.227 14.408 -24.293 1.00 15.21 H new ATOM 1927 N THR A 122 -4.587 15.020 -23.595 1.00 2.42 N ATOM 1928 CA THR A 122 -3.642 14.149 -22.908 1.00 45.42 C ATOM 1929 C THR A 122 -3.307 14.684 -21.520 1.00 73.41 C ATOM 1930 O THR A 122 -2.772 15.784 -21.381 1.00 24.24 O ATOM 1931 CB THR A 122 -2.337 13.990 -23.712 1.00 51.52 C ATOM 1932 OG1 THR A 122 -1.603 15.219 -23.702 1.00 63.11 O ATOM 1933 CG2 THR A 122 -2.633 13.581 -25.147 1.00 44.22 C ATOM 0 H THR A 122 -4.168 15.622 -24.304 1.00 2.42 H new ATOM 0 HA THR A 122 -4.123 13.176 -22.813 1.00 45.42 H new ATOM 0 HB THR A 122 -1.740 13.208 -23.244 1.00 51.52 H new ATOM 0 HG1 THR A 122 -1.789 15.704 -22.871 1.00 63.11 H new ATOM 0 HG21 THR A 122 -1.697 13.475 -25.695 1.00 44.22 H new ATOM 0 HG22 THR A 122 -3.166 12.630 -25.152 1.00 44.22 H new ATOM 0 HG23 THR A 122 -3.248 14.344 -25.623 1.00 44.22 H new ATOM 1941 N GLY A 123 -3.627 13.901 -20.495 1.00 4.51 N ATOM 1942 CA GLY A 123 -3.352 14.313 -19.131 1.00 62.32 C ATOM 1943 C GLY A 123 -1.915 14.054 -18.725 1.00 52.22 C ATOM 1944 O GLY A 123 -1.238 13.212 -19.315 1.00 55.03 O ATOM 0 H GLY A 123 -4.072 12.988 -20.585 1.00 4.51 H new ATOM 0 HA2 GLY A 123 -3.570 15.376 -19.025 1.00 62.32 H new ATOM 0 HA3 GLY A 123 -4.019 13.781 -18.453 1.00 62.32 H new ATOM 1948 N ASN A 124 -1.447 14.780 -17.715 1.00 44.34 N ATOM 1949 CA ASN A 124 -0.079 14.626 -17.232 1.00 31.11 C ATOM 1950 C ASN A 124 -0.060 13.984 -15.848 1.00 13.33 C ATOM 1951 O ASN A 124 -1.109 13.712 -15.265 1.00 45.23 O ATOM 1952 CB ASN A 124 0.625 15.984 -17.186 1.00 34.54 C ATOM 1953 CG ASN A 124 1.911 15.995 -17.989 1.00 72.15 C ATOM 1954 OD1 ASN A 124 2.906 15.387 -17.596 1.00 24.04 O ATOM 1955 ND2 ASN A 124 1.896 16.691 -19.121 1.00 11.53 N ATOM 0 H ASN A 124 -1.994 15.481 -17.215 1.00 44.34 H new ATOM 0 HA ASN A 124 0.452 13.973 -17.924 1.00 31.11 H new ATOM 0 HB2 ASN A 124 -0.047 16.752 -17.570 1.00 34.54 H new ATOM 0 HB3 ASN A 124 0.844 16.242 -16.150 1.00 34.54 H new ATOM 0 HD21 ASN A 124 2.732 16.736 -19.703 1.00 11.53 H new ATOM 0 HD22 ASN A 124 1.048 17.180 -19.408 1.00 11.53 H new ATOM 1962 N ASN A 125 1.139 13.745 -15.329 1.00 41.32 N ATOM 1963 CA ASN A 125 1.295 13.135 -14.013 1.00 13.30 C ATOM 1964 C ASN A 125 0.587 13.961 -12.943 1.00 64.12 C ATOM 1965 O ASN A 125 0.550 15.189 -13.016 1.00 64.12 O ATOM 1966 CB ASN A 125 2.778 12.994 -13.665 1.00 63.12 C ATOM 1967 CG ASN A 125 3.005 12.748 -12.187 1.00 45.30 C ATOM 1968 OD1 ASN A 125 3.470 13.629 -11.463 1.00 65.40 O ATOM 1969 ND2 ASN A 125 2.676 11.545 -11.730 1.00 42.01 N ATOM 0 H ASN A 125 2.017 13.964 -15.799 1.00 41.32 H new ATOM 0 HA ASN A 125 0.840 12.145 -14.043 1.00 13.30 H new ATOM 0 HB2 ASN A 125 3.206 12.171 -14.237 1.00 63.12 H new ATOM 0 HB3 ASN A 125 3.306 13.899 -13.965 1.00 63.12 H new ATOM 0 HD21 ASN A 125 2.806 11.321 -10.743 1.00 42.01 H new ATOM 0 HD22 ASN A 125 2.294 10.845 -12.366 1.00 42.01 H new ATOM 1976 N SER A 126 0.026 13.278 -11.951 1.00 71.11 N ATOM 1977 CA SER A 126 -0.685 13.947 -10.867 1.00 61.41 C ATOM 1978 C SER A 126 0.000 13.690 -9.529 1.00 41.11 C ATOM 1979 O SER A 126 0.874 12.830 -9.423 1.00 62.23 O ATOM 1980 CB SER A 126 -2.137 13.471 -10.811 1.00 30.15 C ATOM 1981 OG SER A 126 -2.957 14.230 -11.682 1.00 34.34 O ATOM 0 H SER A 126 0.050 12.261 -11.875 1.00 71.11 H new ATOM 0 HA SER A 126 -0.670 15.019 -11.062 1.00 61.41 H new ATOM 0 HB2 SER A 126 -2.188 12.417 -11.085 1.00 30.15 H new ATOM 0 HB3 SER A 126 -2.511 13.554 -9.790 1.00 30.15 H new ATOM 0 HG SER A 126 -3.880 13.905 -11.629 1.00 34.34 H new ATOM 1987 N GLN A 127 -0.405 14.441 -8.510 1.00 14.11 N ATOM 1988 CA GLN A 127 0.169 14.295 -7.177 1.00 33.42 C ATOM 1989 C GLN A 127 -0.028 12.876 -6.653 1.00 45.41 C ATOM 1990 O GLN A 127 -0.781 12.090 -7.226 1.00 33.14 O ATOM 1991 CB GLN A 127 -0.464 15.300 -6.214 1.00 41.32 C ATOM 1992 CG GLN A 127 -0.262 16.749 -6.627 1.00 61.34 C ATOM 1993 CD GLN A 127 1.128 17.260 -6.301 1.00 55.20 C ATOM 1994 OE1 GLN A 127 1.493 17.399 -5.133 1.00 33.11 O ATOM 1995 NE2 GLN A 127 1.912 17.545 -7.334 1.00 1.31 N ATOM 0 H GLN A 127 -1.128 15.157 -8.582 1.00 14.11 H new ATOM 0 HA GLN A 127 1.239 14.492 -7.245 1.00 33.42 H new ATOM 0 HB2 GLN A 127 -1.533 15.097 -6.141 1.00 41.32 H new ATOM 0 HB3 GLN A 127 -0.043 15.152 -5.219 1.00 41.32 H new ATOM 0 HG2 GLN A 127 -0.439 16.846 -7.698 1.00 61.34 H new ATOM 0 HG3 GLN A 127 -1.001 17.373 -6.125 1.00 61.34 H new ATOM 0 HE21 GLN A 127 1.569 17.415 -8.286 1.00 1.31 H new ATOM 0 HE22 GLN A 127 2.857 17.894 -7.176 1.00 1.31 H new ATOM 2004 N VAL A 128 0.656 12.555 -5.559 1.00 54.33 N ATOM 2005 CA VAL A 128 0.555 11.232 -4.956 1.00 44.03 C ATOM 2006 C VAL A 128 -0.868 10.943 -4.495 1.00 73.41 C ATOM 2007 O VAL A 128 -1.704 11.845 -4.424 1.00 70.11 O ATOM 2008 CB VAL A 128 1.510 11.089 -3.755 1.00 75.00 C ATOM 2009 CG1 VAL A 128 2.959 11.139 -4.215 1.00 31.02 C ATOM 2010 CG2 VAL A 128 1.233 12.171 -2.723 1.00 50.23 C ATOM 0 H VAL A 128 1.286 13.193 -5.073 1.00 54.33 H new ATOM 0 HA VAL A 128 0.837 10.513 -5.725 1.00 44.03 H new ATOM 0 HB VAL A 128 1.335 10.120 -3.288 1.00 75.00 H new ATOM 0 HG11 VAL A 128 3.618 11.036 -3.353 1.00 31.02 H new ATOM 0 HG12 VAL A 128 3.147 10.324 -4.914 1.00 31.02 H new ATOM 0 HG13 VAL A 128 3.152 12.092 -4.708 1.00 31.02 H new ATOM 0 HG21 VAL A 128 1.916 12.055 -1.882 1.00 50.23 H new ATOM 0 HG22 VAL A 128 1.378 13.152 -3.176 1.00 50.23 H new ATOM 0 HG23 VAL A 128 0.205 12.083 -2.370 1.00 50.23 H new ATOM 2020 N SER A 129 -1.139 9.680 -4.184 1.00 35.21 N ATOM 2021 CA SER A 129 -2.465 9.271 -3.734 1.00 70.53 C ATOM 2022 C SER A 129 -2.437 7.850 -3.180 1.00 63.21 C ATOM 2023 O SER A 129 -1.435 7.145 -3.304 1.00 44.24 O ATOM 2024 CB SER A 129 -3.469 9.361 -4.886 1.00 65.20 C ATOM 2025 OG SER A 129 -2.859 9.027 -6.121 1.00 71.13 O ATOM 0 H SER A 129 -0.459 8.922 -4.235 1.00 35.21 H new ATOM 0 HA SER A 129 -2.775 9.947 -2.937 1.00 70.53 H new ATOM 0 HB2 SER A 129 -4.306 8.689 -4.697 1.00 65.20 H new ATOM 0 HB3 SER A 129 -3.877 10.370 -4.939 1.00 65.20 H new ATOM 0 HG SER A 129 -3.521 9.090 -6.841 1.00 71.13 H new ATOM 2031 N GLN A 130 -3.542 7.437 -2.569 1.00 63.12 N ATOM 2032 CA GLN A 130 -3.644 6.101 -1.996 1.00 50.31 C ATOM 2033 C GLN A 130 -2.628 5.912 -0.873 1.00 33.55 C ATOM 2034 O GLN A 130 -1.444 5.693 -1.125 1.00 64.31 O ATOM 2035 CB GLN A 130 -3.429 5.040 -3.077 1.00 54.33 C ATOM 2036 CG GLN A 130 -4.600 4.082 -3.230 1.00 40.24 C ATOM 2037 CD GLN A 130 -5.619 4.564 -4.245 1.00 11.31 C ATOM 2038 OE1 GLN A 130 -5.860 5.764 -4.379 1.00 43.20 O ATOM 2039 NE2 GLN A 130 -6.224 3.627 -4.966 1.00 23.24 N ATOM 0 H GLN A 130 -4.379 8.009 -2.458 1.00 63.12 H new ATOM 0 HA GLN A 130 -4.645 5.987 -1.580 1.00 50.31 H new ATOM 0 HB2 GLN A 130 -3.249 5.536 -4.031 1.00 54.33 H new ATOM 0 HB3 GLN A 130 -2.531 4.469 -2.840 1.00 54.33 H new ATOM 0 HG2 GLN A 130 -4.227 3.103 -3.532 1.00 40.24 H new ATOM 0 HG3 GLN A 130 -5.088 3.953 -2.264 1.00 40.24 H new ATOM 0 HE21 GLN A 130 -5.993 2.644 -4.822 1.00 23.24 H new ATOM 0 HE22 GLN A 130 -6.919 3.890 -5.664 1.00 23.24 H new ATOM 2048 N ASN A 131 -3.100 5.998 0.366 1.00 3.34 N ATOM 2049 CA ASN A 131 -2.232 5.837 1.527 1.00 34.22 C ATOM 2050 C ASN A 131 -1.841 4.374 1.716 1.00 63.15 C ATOM 2051 O ASN A 131 -2.242 3.509 0.937 1.00 5.21 O ATOM 2052 CB ASN A 131 -2.929 6.357 2.786 1.00 1.42 C ATOM 2053 CG ASN A 131 -2.436 7.731 3.194 1.00 53.55 C ATOM 2054 OD1 ASN A 131 -1.706 7.875 4.176 1.00 53.00 O ATOM 2055 ND2 ASN A 131 -2.834 8.750 2.441 1.00 3.12 N ATOM 0 H ASN A 131 -4.078 6.178 0.592 1.00 3.34 H new ATOM 0 HA ASN A 131 -1.325 6.417 1.355 1.00 34.22 H new ATOM 0 HB2 ASN A 131 -4.004 6.397 2.612 1.00 1.42 H new ATOM 0 HB3 ASN A 131 -2.764 5.657 3.605 1.00 1.42 H new ATOM 0 HD21 ASN A 131 -2.535 9.699 2.667 1.00 3.12 H new ATOM 0 HD22 ASN A 131 -3.439 8.584 1.637 1.00 3.12 H new ATOM 2062 N TYR A 132 -1.056 4.107 2.753 1.00 12.42 N ATOM 2063 CA TYR A 132 -0.609 2.750 3.044 1.00 33.02 C ATOM 2064 C TYR A 132 -1.786 1.860 3.434 1.00 2.01 C ATOM 2065 O TYR A 132 -2.908 2.353 3.532 1.00 53.41 O ATOM 2066 CB TYR A 132 0.429 2.761 4.167 1.00 61.23 C ATOM 2067 CG TYR A 132 1.483 1.686 4.028 1.00 31.43 C ATOM 2068 CD1 TYR A 132 2.508 1.804 3.097 1.00 54.13 C ATOM 2069 CD2 TYR A 132 1.455 0.551 4.829 1.00 35.01 C ATOM 2070 CE1 TYR A 132 3.472 0.824 2.967 1.00 53.03 C ATOM 2071 CE2 TYR A 132 2.415 -0.435 4.707 1.00 62.43 C ATOM 2072 CZ TYR A 132 3.421 -0.294 3.774 1.00 51.13 C ATOM 2073 OH TYR A 132 4.381 -1.272 3.649 1.00 34.42 O ATOM 0 H TYR A 132 -0.716 4.812 3.407 1.00 12.42 H new ATOM 0 HA TYR A 132 -0.153 2.345 2.141 1.00 33.02 H new ATOM 0 HB2 TYR A 132 0.917 3.735 4.190 1.00 61.23 H new ATOM 0 HB3 TYR A 132 -0.081 2.637 5.123 1.00 61.23 H new ATOM 0 HD1 TYR A 132 2.551 2.678 2.464 1.00 54.13 H new ATOM 0 HD2 TYR A 132 0.668 0.438 5.560 1.00 35.01 H new ATOM 0 HE1 TYR A 132 4.261 0.932 2.238 1.00 53.03 H new ATOM 0 HE2 TYR A 132 2.378 -1.311 5.338 1.00 62.43 H new ATOM 0 HH TYR A 132 4.201 -1.991 4.291 1.00 34.42 H new TER 2083 TYR A 132 HETATM 2084 C1 MYR A 1 2.220 6.956 -15.394 1.00 62.23 C HETATM 2085 O1 MYR A 1 2.613 7.849 -14.644 1.00 34.35 O HETATM 2086 C2 MYR A 1 0.738 6.923 -15.771 1.00 61.43 C HETATM 2087 C3 MYR A 1 0.245 8.165 -16.551 1.00 43.53 C HETATM 2088 C4 MYR A 1 -1.230 8.036 -16.973 1.00 11.53 C HETATM 2089 C5 MYR A 1 -2.188 8.641 -15.929 1.00 61.22 C HETATM 2090 C6 MYR A 1 -2.969 9.846 -16.486 1.00 65.43 C HETATM 2091 C7 MYR A 1 -4.401 9.922 -15.924 1.00 71.22 C HETATM 2092 C8 MYR A 1 -4.420 9.998 -14.385 1.00 24.20 C HETATM 2093 C9 MYR A 1 -5.548 10.906 -13.861 1.00 50.20 C HETATM 2094 C10 MYR A 1 -6.948 10.345 -14.186 1.00 51.11 C HETATM 2095 C11 MYR A 1 -7.848 11.310 -14.985 1.00 35.14 C HETATM 2096 C12 MYR A 1 -8.666 10.633 -16.106 1.00 63.32 C HETATM 2097 C13 MYR A 1 -9.967 11.393 -16.417 1.00 33.10 C HETATM 2098 C14 MYR A 1 -10.048 11.807 -17.893 1.00 14.12 C HETATM 0 H143 MYR A 1 -9.207 12.457 -18.135 1.00 14.12 H new HETATM 0 H142 MYR A 1 -10.013 10.918 -18.523 1.00 14.12 H new HETATM 0 H141 MYR A 1 -10.982 12.341 -18.070 1.00 14.12 H new HETATM 0 H132 MYR A 1 -10.823 10.765 -16.168 1.00 33.10 H new HETATM 0 H131 MYR A 1 -10.029 12.280 -15.787 1.00 33.10 H new HETATM 0 H122 MYR A 1 -8.059 10.571 -17.009 1.00 63.32 H new HETATM 0 H121 MYR A 1 -8.906 9.611 -15.812 1.00 63.32 H new HETATM 0 H112 MYR A 1 -8.535 11.802 -14.296 1.00 35.14 H new HETATM 0 H111 MYR A 1 -7.225 12.089 -15.425 1.00 35.14 H new HETATM 0 H102 MYR A 1 -6.834 9.420 -14.752 1.00 51.11 H new HETATM 0 H101 MYR A 1 -7.449 10.088 -13.253 1.00 51.11 H new HETATM 0 H92 MYR A 1 -5.447 11.022 -12.782 1.00 50.20 H new HETATM 0 H91 MYR A 1 -5.446 11.899 -14.299 1.00 50.20 H new HETATM 0 H82 MYR A 1 -4.543 8.996 -13.975 1.00 24.20 H new HETATM 0 H81 MYR A 1 -3.460 10.372 -14.030 1.00 24.20 H new HETATM 0 H72 MYR A 1 -4.905 10.797 -16.335 1.00 71.22 H new HETATM 0 H71 MYR A 1 -4.964 9.047 -16.250 1.00 71.22 H new HETATM 0 H62 MYR A 1 -2.436 10.765 -16.244 1.00 65.43 H new HETATM 0 H61 MYR A 1 -3.010 9.779 -17.573 1.00 65.43 H new HETATM 0 H52 MYR A 1 -2.891 7.877 -15.597 1.00 61.22 H new HETATM 0 H51 MYR A 1 -1.619 8.952 -15.053 1.00 61.22 H new HETATM 0 H42 MYR A 1 -1.377 8.535 -17.931 1.00 11.53 H new HETATM 0 H41 MYR A 1 -1.473 6.984 -17.121 1.00 11.53 H new HETATM 0 H32 MYR A 1 0.368 9.054 -15.932 1.00 43.53 H new HETATM 0 H31 MYR A 1 0.864 8.305 -17.437 1.00 43.53 H new HETATM 0 H22 MYR A 1 0.549 6.034 -16.372 1.00 61.43 H new HETATM 0 H21 MYR A 1 0.147 6.824 -14.861 1.00 61.43 H new HETATM 2126 P1 PBU A 300 -6.444 -22.417 -14.455 1.00 61.25 P HETATM 2127 P4 PBU A 300 -14.699 -20.288 -15.632 1.00 13.33 P HETATM 2128 P5 PBU A 300 -12.593 -20.299 -19.361 1.00 34.23 P HETATM 2129 C3' PBU A 300 -4.929 -21.721 -16.333 1.00 44.50 C HETATM 2130 C2' PBU A 300 -4.544 -20.285 -15.899 1.00 22.03 C HETATM 2131 O2' PBU A 300 -4.254 -19.526 -17.060 1.00 65.50 O HETATM 2132 C1' PBU A 300 -3.308 -20.273 -14.967 1.00 33.11 C HETATM 2133 O1' PBU A 300 -2.456 -21.346 -15.310 1.00 41.22 O HETATM 2134 C1 PBU A 300 -8.938 -21.397 -15.613 1.00 54.03 C HETATM 2135 O1 PBU A 300 -7.666 -22.254 -15.583 1.00 31.11 O HETATM 2136 C2 PBU A 300 -9.917 -21.603 -14.406 1.00 63.44 C HETATM 2137 O2 PBU A 300 -10.321 -22.958 -14.240 1.00 44.43 O HETATM 2138 C3 PBU A 300 -11.174 -20.719 -14.569 1.00 62.03 C HETATM 2139 O3 PBU A 300 -12.027 -20.958 -13.441 1.00 1.41 O HETATM 2140 C4 PBU A 300 -11.906 -21.011 -15.936 1.00 55.42 C HETATM 2141 O4 PBU A 300 -13.104 -20.087 -16.074 1.00 12.22 O HETATM 2142 C5 PBU A 300 -10.883 -20.784 -17.119 1.00 41.01 C HETATM 2143 O5 PBU A 300 -11.548 -21.114 -18.381 1.00 25.23 O HETATM 2144 C6 PBU A 300 -9.608 -21.652 -16.976 1.00 35.24 C HETATM 2145 O6 PBU A 300 -8.633 -21.358 -17.986 1.00 63.40 O HETATM 2146 C7 PBU A 300 -5.341 -18.912 -17.729 1.00 42.21 C HETATM 2147 O7 PBU A 300 -5.686 -19.298 -18.823 1.00 11.20 O HETATM 2148 C8 PBU A 300 -6.098 -17.757 -17.050 1.00 74.43 C HETATM 2149 C9 PBU A 300 -6.456 -16.674 -18.086 1.00 24.30 C HETATM 2150 C10 PBU A 300 -7.458 -15.683 -17.466 1.00 70.33 C HETATM 2151 C11 PBU A 300 -2.233 -22.430 -14.438 1.00 30.32 C HETATM 2152 O11 PBU A 300 -2.429 -22.402 -13.238 1.00 73.41 O HETATM 2153 C12 PBU A 300 -1.641 -23.707 -15.100 1.00 42.24 C HETATM 2154 C13 PBU A 300 -1.300 -24.816 -14.090 1.00 30.11 C HETATM 2155 C14 PBU A 300 -0.626 -26.012 -14.787 1.00 74.20 C HETATM 2156 O41 PBU A 300 -15.316 -20.380 -17.025 1.00 70.33 O HETATM 2157 O42 PBU A 300 -14.740 -21.569 -14.843 1.00 54.21 O HETATM 2158 O43 PBU A 300 -15.154 -19.108 -14.788 1.00 22.43 O HETATM 2159 O51 PBU A 300 -13.676 -21.346 -19.534 1.00 10.40 O HETATM 2160 O52 PBU A 300 -12.937 -19.058 -18.554 1.00 5.13 O HETATM 2161 O53 PBU A 300 -11.774 -20.044 -20.605 1.00 62.14 O HETATM 2162 OP1 PBU A 300 -5.158 -22.556 -15.216 1.00 21.15 O HETATM 2163 OP2 PBU A 300 -6.546 -21.120 -13.649 1.00 0.10 O HETATM 2164 OP3 PBU A 300 -6.772 -23.701 -13.740 1.00 70.02 O HETATM 0 H3'2 PBU A 300 -5.825 -21.687 -16.953 1.00 44.50 H new HETATM 0 H3'1 PBU A 300 -4.133 -22.143 -16.947 1.00 44.50 H new HETATM 0 H143 PBU A 300 -1.300 -26.421 -15.540 1.00 74.20 H new HETATM 0 H142 PBU A 300 0.296 -25.682 -15.266 1.00 74.20 H new HETATM 0 H141 PBU A 300 -0.396 -26.781 -14.049 1.00 74.20 H new HETATM 0 H132 PBU A 300 -0.638 -24.420 -13.320 1.00 30.11 H new HETATM 0 H131 PBU A 300 -2.209 -25.148 -13.589 1.00 30.11 H new HETATM 0 H122 PBU A 300 -2.355 -24.095 -15.827 1.00 42.24 H new HETATM 0 H121 PBU A 300 -0.740 -23.437 -15.651 1.00 42.24 H new HETATM 0 H1'2 PBU A 300 -2.776 -19.326 -15.061 1.00 33.11 H new HETATM 0 H1'1 PBU A 300 -3.621 -20.360 -13.927 1.00 33.11 H new HETATM 0 H92 PBU A 300 -5.556 -16.147 -18.403 1.00 24.30 H new HETATM 0 H91 PBU A 300 -6.886 -17.134 -18.975 1.00 24.30 H new HETATM 0 H82 PBU A 300 -7.006 -18.134 -16.579 1.00 74.43 H new HETATM 0 H81 PBU A 300 -5.484 -17.325 -16.259 1.00 74.43 H new HETATM 0 H6 PBU A 300 -9.933 -22.688 -17.075 1.00 35.24 H new HETATM 0 H5 PBU A 300 -10.570 -19.740 -17.095 1.00 41.01 H new HETATM 0 H4 PBU A 300 -12.261 -22.041 -15.966 1.00 55.42 H new HETATM 0 H3 PBU A 300 -10.894 -19.666 -14.598 1.00 62.03 H new HETATM 0 H2' PBU A 300 -5.382 -19.859 -15.347 1.00 22.03 H new HETATM 0 H2 PBU A 300 -9.362 -21.311 -13.515 1.00 63.44 H new HETATM 0 H13 PBU A 300 -8.362 -16.216 -17.171 1.00 70.33 H new HETATM 0 H12 PBU A 300 -7.011 -15.214 -16.590 1.00 70.33 H new HETATM 0 H11 PBU A 300 -7.712 -14.916 -18.198 1.00 70.33 H new HETATM 0 H1 PBU A 300 -8.656 -20.351 -15.496 1.00 54.03 H new HETATM 0 H06 PBU A 300 -9.023 -21.511 -18.872 1.00 63.40 H new HETATM 0 H03 PBU A 300 -12.916 -21.228 -13.754 1.00 1.41 H new HETATM 0 H02 PBU A 300 -11.226 -22.986 -13.864 1.00 44.43 H new