USER MOD reduce.3.24.130724 H: found=0, std=0, add=780, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 782 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 97 THR OG1 : rot 75:sc= 1.99 USER MOD Set 1.2: A 112 LYS NZ :NH3+ 142:sc= 0.861 (180deg=0.934) USER MOD Set 2.1: A 73 TYR OH : rot 9:sc= 1.29 USER MOD Set 2.2: A 83 THR OG1 : rot 140:sc= 1.01 USER MOD Set 3.1: A 62 GLN : amide:sc= 0.887 K(o=1.9,f=-1.3) USER MOD Set 3.2: A 64 TYR OH : rot -6:sc= 1.03 USER MOD Set 4.1: A 57 ASN : amide:sc= 1.02 K(o=3.5,f=1.7) USER MOD Set 4.2: A 72 GLN : amide:sc= 1.75 K(o=3.5,f=1.7) USER MOD Set 4.3: A 87 SER OG : rot -153:sc= 0.764 USER MOD Set 5.1: A 42 GLN : amide:sc= 0.268 X(o=0.3,f=-0.044) USER MOD Set 5.2: A 44 SER OG : rot 180:sc= 0.0307 USER MOD Set 6.1: A 41 SER OG : rot -169:sc= 1.35 USER MOD Set 6.2: A 53 THR OG1 : rot -170:sc= 0.739 USER MOD Set 7.1: A 31 GLN : amide:sc= 0.52 X(o=1.2,f=0.92) USER MOD Set 7.2: A 47 ASN : amide:sc= 0.667 X(o=1.2,f=0.92) USER MOD Set 8.1: A 12 THR OG1 : rot 102:sc= 2.23 USER MOD Set 8.2: A 14 ASN : amide:sc= 1.05 K(o=5.1,f=-4.6) USER MOD Set 8.3: A 15 SER OG : rot 79:sc= 1.78 USER MOD Set 9.1: A 8 ASN : amide:sc= 0.682 K(o=2.4,f=0.78) USER MOD Set 9.2: A 24 ASN : amide:sc= 1.58 K(o=2.4,f=0.064) USER MOD Set 9.3: A 26 TYR OH : rot 180:sc= 0.092 USER MOD Single : A 6 ASN : amide:sc= 0.942 K(o=0.94,f=-9.2!) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 61:sc= 1.4 USER MOD Single : A 10 GLN : amide:sc=-0.00911 K(o=-0.0091,f=-3.3!) USER MOD Single : A 16 GLN : amide:sc= -0.0974 K(o=-0.097,f=-3.7!) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -149:sc= 1.25 (180deg=0.795) USER MOD Single : A 20 SER OG : rot -112:sc= 1.27 USER MOD Single : A 21 THR OG1 : rot 180:sc=-0.00938 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0.848 K(o=0.85,f=-1.4) USER MOD Single : A 30 SER OG : rot 88:sc= 2.02 USER MOD Single : A 35 THR OG1 : rot -40:sc= -0.703 USER MOD Single : A 36 SER OG : rot 83:sc= 1.39 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot -153:sc= -0.167 USER MOD Single : A 49 LYS NZ :NH3+ -137:sc= 1.21 (180deg=0.663) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 52:sc= 1.74 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 179:sc= 1.01 (180deg=0.953) USER MOD Single : A 61 SER OG : rot 69:sc= 1.74 USER MOD Single : A 66 THR OG1 : rot 77:sc= 1.45 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 66:sc= 1.53 USER MOD Single : A 74 ASN : amide:sc= 1.13 K(o=1.1,f=-0.0073) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 72:sc= 1.65 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 25:sc= 1.11 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 160:sc= 0.633 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 8:sc= 0.867 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc=-0.00093 USER MOD Single : A 121 MET CE :methyl 175:sc= 0 (180deg=-0.00566) USER MOD ----------------------------------------------------------------- ATOM 46 N VAL A 5 11.103 -2.397 -1.966 1.00 0.00 N ATOM 47 CA VAL A 5 11.862 -1.205 -2.372 1.00 0.00 C ATOM 48 C VAL A 5 13.374 -1.505 -2.360 1.00 0.00 C ATOM 49 O VAL A 5 14.163 -0.906 -1.622 1.00 0.00 O ATOM 50 CB VAL A 5 11.409 0.044 -1.570 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.921 1.343 -2.215 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.876 0.154 -1.478 1.00 0.00 C ATOM 0 HA VAL A 5 11.639 -0.946 -3.407 1.00 0.00 H new ATOM 0 HB VAL A 5 11.831 -0.083 -0.573 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.585 2.198 -1.628 1.00 0.00 H new ATOM 0 HG12 VAL A 5 13.010 1.329 -2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.530 1.424 -3.229 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.609 1.044 -0.908 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.456 0.226 -2.481 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.477 -0.730 -0.980 1.00 0.00 H new ATOM 62 N ASN A 6 13.755 -2.511 -3.156 1.00 0.00 N ATOM 63 CA ASN A 6 15.140 -2.926 -3.348 1.00 0.00 C ATOM 64 C ASN A 6 15.856 -1.875 -4.201 1.00 0.00 C ATOM 65 O ASN A 6 15.393 -1.549 -5.298 1.00 0.00 O ATOM 66 CB ASN A 6 15.169 -4.308 -4.039 1.00 0.00 C ATOM 67 CG ASN A 6 16.578 -4.858 -4.284 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.517 -4.136 -4.591 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.778 -6.155 -4.145 1.00 0.00 N ATOM 0 H ASN A 6 13.091 -3.068 -3.694 1.00 0.00 H new ATOM 0 HA ASN A 6 15.650 -3.010 -2.388 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.615 -5.019 -3.427 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.648 -4.235 -4.994 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.708 -6.546 -4.293 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.002 -6.766 -3.889 1.00 0.00 H new ATOM 76 N THR A 7 17.001 -1.400 -3.721 1.00 0.00 N ATOM 77 CA THR A 7 17.942 -0.565 -4.446 1.00 0.00 C ATOM 78 C THR A 7 19.295 -1.276 -4.330 1.00 0.00 C ATOM 79 O THR A 7 19.877 -1.319 -3.245 1.00 0.00 O ATOM 80 CB THR A 7 17.939 0.856 -3.846 1.00 0.00 C ATOM 81 OG1 THR A 7 16.617 1.356 -3.737 1.00 0.00 O ATOM 82 CG2 THR A 7 18.753 1.838 -4.696 1.00 0.00 C ATOM 0 H THR A 7 17.309 -1.599 -2.769 1.00 0.00 H new ATOM 0 HA THR A 7 17.688 -0.437 -5.498 1.00 0.00 H new ATOM 0 HB THR A 7 18.394 0.774 -2.859 1.00 0.00 H new ATOM 0 HG1 THR A 7 16.639 2.257 -3.353 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.724 2.826 -4.238 1.00 0.00 H new ATOM 0 HG22 THR A 7 19.786 1.496 -4.757 1.00 0.00 H new ATOM 0 HG23 THR A 7 18.328 1.891 -5.698 1.00 0.00 H new ATOM 90 N ASN A 8 19.761 -1.880 -5.429 1.00 0.00 N ATOM 91 CA ASN A 8 20.993 -2.675 -5.563 1.00 0.00 C ATOM 92 C ASN A 8 21.275 -3.654 -4.406 1.00 0.00 C ATOM 93 O ASN A 8 22.432 -3.906 -4.068 1.00 0.00 O ATOM 94 CB ASN A 8 22.196 -1.760 -5.864 1.00 0.00 C ATOM 95 CG ASN A 8 23.331 -2.540 -6.533 1.00 0.00 C ATOM 96 OD1 ASN A 8 23.145 -3.121 -7.599 1.00 0.00 O ATOM 97 ND2 ASN A 8 24.527 -2.565 -5.968 1.00 0.00 N ATOM 0 H ASN A 8 19.253 -1.824 -6.312 1.00 0.00 H new ATOM 0 HA ASN A 8 20.826 -3.333 -6.416 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.881 -0.943 -6.513 1.00 0.00 H new ATOM 0 HB3 ASN A 8 22.556 -1.312 -4.938 1.00 0.00 H new ATOM 0 HD21 ASN A 8 25.293 -3.066 -6.418 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.683 -2.083 -5.083 1.00 0.00 H new ATOM 104 N SER A 9 20.234 -4.186 -3.766 1.00 0.00 N ATOM 105 CA SER A 9 20.340 -5.028 -2.581 1.00 0.00 C ATOM 106 C SER A 9 20.169 -6.501 -2.935 1.00 0.00 C ATOM 107 O SER A 9 19.593 -6.847 -3.972 1.00 0.00 O ATOM 108 CB SER A 9 19.272 -4.605 -1.576 1.00 0.00 C ATOM 109 OG SER A 9 19.520 -3.273 -1.176 1.00 0.00 O ATOM 0 H SER A 9 19.271 -4.038 -4.067 1.00 0.00 H new ATOM 0 HA SER A 9 21.332 -4.903 -2.147 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.281 -4.686 -2.023 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.286 -5.267 -0.710 1.00 0.00 H new ATOM 0 HG SER A 9 19.482 -2.684 -1.958 1.00 0.00 H new ATOM 115 N GLN A 10 20.619 -7.366 -2.028 1.00 0.00 N ATOM 116 CA GLN A 10 20.562 -8.805 -2.152 1.00 0.00 C ATOM 117 C GLN A 10 19.719 -9.327 -0.996 1.00 0.00 C ATOM 118 O GLN A 10 19.961 -8.999 0.166 1.00 0.00 O ATOM 119 CB GLN A 10 22.006 -9.335 -2.170 1.00 0.00 C ATOM 120 CG GLN A 10 22.233 -10.748 -1.620 1.00 0.00 C ATOM 121 CD GLN A 10 21.648 -11.868 -2.488 1.00 0.00 C ATOM 122 OE1 GLN A 10 20.604 -11.722 -3.119 1.00 0.00 O ATOM 123 NE2 GLN A 10 22.310 -13.012 -2.555 1.00 0.00 N ATOM 0 H GLN A 10 21.049 -7.062 -1.154 1.00 0.00 H new ATOM 0 HA GLN A 10 20.092 -9.146 -3.074 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.364 -9.310 -3.199 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.628 -8.645 -1.600 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.305 -10.913 -1.509 1.00 0.00 H new ATOM 0 HG3 GLN A 10 21.796 -10.811 -0.624 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.177 -13.131 -2.030 1.00 0.00 H new ATOM 0 HE22 GLN A 10 21.954 -13.774 -3.131 1.00 0.00 H new ATOM 132 N ILE A 11 18.753 -10.165 -1.352 1.00 0.00 N ATOM 133 CA ILE A 11 17.849 -10.898 -0.483 1.00 0.00 C ATOM 134 C ILE A 11 17.821 -12.302 -1.080 1.00 0.00 C ATOM 135 O ILE A 11 17.417 -12.466 -2.236 1.00 0.00 O ATOM 136 CB ILE A 11 16.444 -10.234 -0.425 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.499 -8.744 -0.007 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.541 -10.989 0.568 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.482 -7.769 -1.191 1.00 0.00 C ATOM 0 H ILE A 11 18.569 -10.363 -2.336 1.00 0.00 H new ATOM 0 HA ILE A 11 18.176 -10.911 0.557 1.00 0.00 H new ATOM 0 HB ILE A 11 16.038 -10.286 -1.435 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.651 -8.527 0.643 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.402 -8.574 0.579 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.560 -10.515 0.600 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.433 -12.025 0.247 1.00 0.00 H new ATOM 0 HG23 ILE A 11 15.990 -10.962 1.561 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.523 -6.745 -0.820 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.344 -7.958 -1.830 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.567 -7.910 -1.766 1.00 0.00 H new ATOM 151 N THR A 12 18.318 -13.292 -0.340 1.00 0.00 N ATOM 152 CA THR A 12 18.421 -14.657 -0.859 1.00 0.00 C ATOM 153 C THR A 12 17.026 -15.278 -1.050 1.00 0.00 C ATOM 154 O THR A 12 16.029 -14.794 -0.505 1.00 0.00 O ATOM 155 CB THR A 12 19.318 -15.511 0.056 1.00 0.00 C ATOM 156 OG1 THR A 12 18.882 -15.421 1.393 1.00 0.00 O ATOM 157 CG2 THR A 12 20.786 -15.084 -0.008 1.00 0.00 C ATOM 0 H THR A 12 18.654 -13.177 0.616 1.00 0.00 H new ATOM 0 HA THR A 12 18.891 -14.626 -1.842 1.00 0.00 H new ATOM 0 HB THR A 12 19.241 -16.538 -0.302 1.00 0.00 H new ATOM 0 HG1 THR A 12 18.383 -16.230 1.629 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.378 -15.716 0.654 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.151 -15.187 -1.030 1.00 0.00 H new ATOM 0 HG23 THR A 12 20.876 -14.044 0.306 1.00 0.00 H new ATOM 165 N ALA A 13 16.954 -16.400 -1.774 1.00 0.00 N ATOM 166 CA ALA A 13 15.718 -17.151 -1.997 1.00 0.00 C ATOM 167 C ALA A 13 15.057 -17.627 -0.693 1.00 0.00 C ATOM 168 O ALA A 13 13.848 -17.861 -0.664 1.00 0.00 O ATOM 169 CB ALA A 13 16.041 -18.370 -2.863 1.00 0.00 C ATOM 0 H ALA A 13 17.767 -16.817 -2.228 1.00 0.00 H new ATOM 0 HA ALA A 13 15.012 -16.481 -2.487 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.130 -18.942 -3.040 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.453 -18.040 -3.817 1.00 0.00 H new ATOM 0 HB3 ALA A 13 16.770 -18.997 -2.351 1.00 0.00 H new ATOM 175 N ASN A 14 15.848 -17.783 0.374 1.00 0.00 N ATOM 176 CA ASN A 14 15.408 -18.243 1.694 1.00 0.00 C ATOM 177 C ASN A 14 15.280 -17.083 2.694 1.00 0.00 C ATOM 178 O ASN A 14 14.912 -17.303 3.848 1.00 0.00 O ATOM 179 CB ASN A 14 16.335 -19.358 2.218 1.00 0.00 C ATOM 180 CG ASN A 14 17.766 -18.917 2.521 1.00 0.00 C ATOM 181 OD1 ASN A 14 18.146 -17.767 2.321 1.00 0.00 O ATOM 182 ND2 ASN A 14 18.615 -19.828 2.962 1.00 0.00 N ATOM 0 H ASN A 14 16.848 -17.585 0.340 1.00 0.00 H new ATOM 0 HA ASN A 14 14.409 -18.665 1.584 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.899 -19.776 3.126 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.366 -20.160 1.481 1.00 0.00 H new ATOM 0 HD21 ASN A 14 19.588 -19.576 3.137 1.00 0.00 H new ATOM 0 HD22 ASN A 14 18.298 -20.783 3.128 1.00 0.00 H new ATOM 189 N SER A 15 15.557 -15.852 2.259 1.00 0.00 N ATOM 190 CA SER A 15 15.279 -14.631 2.999 1.00 0.00 C ATOM 191 C SER A 15 13.886 -14.111 2.606 1.00 0.00 C ATOM 192 O SER A 15 13.221 -14.709 1.752 1.00 0.00 O ATOM 193 CB SER A 15 16.369 -13.620 2.660 1.00 0.00 C ATOM 194 OG SER A 15 17.592 -14.019 3.235 1.00 0.00 O ATOM 0 H SER A 15 15.994 -15.678 1.354 1.00 0.00 H new ATOM 0 HA SER A 15 15.279 -14.807 4.075 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.476 -13.537 1.578 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.089 -12.633 3.029 1.00 0.00 H new ATOM 0 HG SER A 15 18.000 -14.719 2.683 1.00 0.00 H new ATOM 200 N GLN A 16 13.420 -13.011 3.212 1.00 0.00 N ATOM 201 CA GLN A 16 12.076 -12.500 2.983 1.00 0.00 C ATOM 202 C GLN A 16 12.053 -10.975 3.081 1.00 0.00 C ATOM 203 O GLN A 16 12.643 -10.399 3.996 1.00 0.00 O ATOM 204 CB GLN A 16 11.134 -13.140 4.024 1.00 0.00 C ATOM 205 CG GLN A 16 9.651 -12.755 3.906 1.00 0.00 C ATOM 206 CD GLN A 16 9.030 -13.176 2.575 1.00 0.00 C ATOM 207 OE1 GLN A 16 9.319 -12.594 1.534 1.00 0.00 O ATOM 208 NE2 GLN A 16 8.174 -14.185 2.568 1.00 0.00 N ATOM 0 H GLN A 16 13.967 -12.457 3.871 1.00 0.00 H new ATOM 0 HA GLN A 16 11.742 -12.760 1.978 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.217 -14.224 3.944 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.483 -12.867 5.020 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.095 -13.217 4.722 1.00 0.00 H new ATOM 0 HG3 GLN A 16 9.551 -11.676 4.022 1.00 0.00 H new ATOM 0 HE21 GLN A 16 7.941 -14.662 3.439 1.00 0.00 H new ATOM 0 HE22 GLN A 16 7.747 -14.486 1.692 1.00 0.00 H new ATOM 217 N CYS A 17 11.334 -10.345 2.152 1.00 0.00 N ATOM 218 CA CYS A 17 10.971 -8.935 2.149 1.00 0.00 C ATOM 219 C CYS A 17 9.542 -8.847 1.598 1.00 0.00 C ATOM 220 O CYS A 17 9.175 -9.655 0.738 1.00 0.00 O ATOM 221 CB CYS A 17 11.999 -8.126 1.346 1.00 0.00 C ATOM 222 SG CYS A 17 12.143 -8.513 -0.422 1.00 0.00 S ATOM 0 H CYS A 17 10.970 -10.837 1.336 1.00 0.00 H new ATOM 0 HA CYS A 17 10.985 -8.499 3.148 1.00 0.00 H new ATOM 0 HB2 CYS A 17 11.751 -7.069 1.444 1.00 0.00 H new ATOM 0 HB3 CYS A 17 12.977 -8.268 1.806 1.00 0.00 H new ATOM 0 HG CYS A 17 13.046 -7.749 -0.961 1.00 0.00 H new ATOM 227 N VAL A 18 8.718 -7.917 2.097 1.00 0.00 N ATOM 228 CA VAL A 18 7.270 -7.889 1.801 1.00 0.00 C ATOM 229 C VAL A 18 6.723 -6.467 1.703 1.00 0.00 C ATOM 230 O VAL A 18 5.974 -6.108 0.795 1.00 0.00 O ATOM 231 CB VAL A 18 6.479 -8.701 2.867 1.00 0.00 C ATOM 232 CG1 VAL A 18 4.999 -8.849 2.479 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.030 -10.115 3.107 1.00 0.00 C ATOM 0 H VAL A 18 9.028 -7.166 2.713 1.00 0.00 H new ATOM 0 HA VAL A 18 7.136 -8.354 0.824 1.00 0.00 H new ATOM 0 HB VAL A 18 6.591 -8.121 3.783 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.477 -9.421 3.246 1.00 0.00 H new ATOM 0 HG12 VAL A 18 4.545 -7.862 2.391 1.00 0.00 H new ATOM 0 HG13 VAL A 18 4.923 -9.369 1.524 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.426 -10.617 3.863 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.993 -10.682 2.177 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.062 -10.050 3.452 1.00 0.00 H new ATOM 243 N LYS A 19 7.150 -5.665 2.653 1.00 0.00 N ATOM 244 CA LYS A 19 6.911 -4.241 2.816 1.00 0.00 C ATOM 245 C LYS A 19 8.205 -3.829 3.488 1.00 0.00 C ATOM 246 O LYS A 19 8.385 -4.088 4.677 1.00 0.00 O ATOM 247 CB LYS A 19 5.626 -3.929 3.619 1.00 0.00 C ATOM 248 CG LYS A 19 5.352 -4.816 4.854 1.00 0.00 C ATOM 249 CD LYS A 19 4.116 -4.412 5.675 1.00 0.00 C ATOM 250 CE LYS A 19 4.200 -2.961 6.178 1.00 0.00 C ATOM 251 NZ LYS A 19 3.312 -2.688 7.334 1.00 0.00 N ATOM 0 H LYS A 19 7.732 -6.027 3.408 1.00 0.00 H new ATOM 0 HA LYS A 19 6.708 -3.693 1.896 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.673 -2.891 3.948 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.774 -4.011 2.944 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.230 -5.848 4.523 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.227 -4.791 5.504 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.221 -4.531 5.064 1.00 0.00 H new ATOM 0 HD3 LYS A 19 4.012 -5.084 6.527 1.00 0.00 H new ATOM 0 HE2 LYS A 19 5.230 -2.741 6.460 1.00 0.00 H new ATOM 0 HE3 LYS A 19 3.941 -2.286 5.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 3.000 -1.696 7.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 2.482 -3.314 7.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 3.830 -2.862 8.219 1.00 0.00 H new ATOM 265 N SER A 20 9.148 -3.318 2.710 1.00 0.00 N ATOM 266 CA SER A 20 10.511 -3.126 3.173 1.00 0.00 C ATOM 267 C SER A 20 11.184 -1.980 2.414 1.00 0.00 C ATOM 268 O SER A 20 10.571 -1.349 1.551 1.00 0.00 O ATOM 269 CB SER A 20 11.268 -4.444 2.913 1.00 0.00 C ATOM 270 OG SER A 20 10.499 -5.627 3.140 1.00 0.00 O ATOM 0 H SER A 20 8.990 -3.027 1.745 1.00 0.00 H new ATOM 0 HA SER A 20 10.520 -2.869 4.232 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.620 -4.448 1.881 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.151 -4.472 3.551 1.00 0.00 H new ATOM 0 HG SER A 20 10.855 -6.104 3.918 1.00 0.00 H new ATOM 276 N THR A 21 12.446 -1.691 2.727 1.00 0.00 N ATOM 277 CA THR A 21 13.302 -0.797 1.960 1.00 0.00 C ATOM 278 C THR A 21 14.729 -1.315 2.145 1.00 0.00 C ATOM 279 O THR A 21 15.125 -1.640 3.265 1.00 0.00 O ATOM 280 CB THR A 21 13.121 0.660 2.437 1.00 0.00 C ATOM 281 OG1 THR A 21 11.759 1.039 2.377 1.00 0.00 O ATOM 282 CG2 THR A 21 13.907 1.647 1.565 1.00 0.00 C ATOM 0 H THR A 21 12.911 -2.085 3.545 1.00 0.00 H new ATOM 0 HA THR A 21 13.049 -0.787 0.900 1.00 0.00 H new ATOM 0 HB THR A 21 13.492 0.696 3.461 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.663 1.965 2.684 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.753 2.661 1.934 1.00 0.00 H new ATOM 0 HG22 THR A 21 14.969 1.403 1.606 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.559 1.579 0.534 1.00 0.00 H new ATOM 290 N ALA A 22 15.507 -1.426 1.070 1.00 0.00 N ATOM 291 CA ALA A 22 16.865 -1.938 1.142 1.00 0.00 C ATOM 292 C ALA A 22 17.733 -1.139 0.181 1.00 0.00 C ATOM 293 O ALA A 22 17.375 -0.991 -0.987 1.00 0.00 O ATOM 294 CB ALA A 22 16.866 -3.432 0.795 1.00 0.00 C ATOM 0 H ALA A 22 15.211 -1.163 0.130 1.00 0.00 H new ATOM 0 HA ALA A 22 17.268 -1.831 2.149 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.884 -3.817 0.849 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.236 -3.970 1.503 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.478 -3.571 -0.214 1.00 0.00 H new ATOM 300 N THR A 23 18.874 -0.659 0.668 1.00 0.00 N ATOM 301 CA THR A 23 19.844 0.094 -0.111 1.00 0.00 C ATOM 302 C THR A 23 21.193 -0.610 0.042 1.00 0.00 C ATOM 303 O THR A 23 21.770 -0.621 1.129 1.00 0.00 O ATOM 304 CB THR A 23 19.866 1.561 0.359 1.00 0.00 C ATOM 305 OG1 THR A 23 18.553 2.094 0.411 1.00 0.00 O ATOM 306 CG2 THR A 23 20.694 2.444 -0.581 1.00 0.00 C ATOM 0 H THR A 23 19.154 -0.788 1.640 1.00 0.00 H new ATOM 0 HA THR A 23 19.586 0.123 -1.170 1.00 0.00 H new ATOM 0 HB THR A 23 20.316 1.561 1.352 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.590 3.025 0.713 1.00 0.00 H new ATOM 0 HG21 THR A 23 20.686 3.471 -0.217 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.720 2.079 -0.613 1.00 0.00 H new ATOM 0 HG23 THR A 23 20.265 2.411 -1.583 1.00 0.00 H new ATOM 314 N ASN A 24 21.671 -1.222 -1.047 1.00 0.00 N ATOM 315 CA ASN A 24 22.838 -2.101 -1.120 1.00 0.00 C ATOM 316 C ASN A 24 22.965 -3.038 0.095 1.00 0.00 C ATOM 317 O ASN A 24 24.043 -3.182 0.675 1.00 0.00 O ATOM 318 CB ASN A 24 24.098 -1.274 -1.430 1.00 0.00 C ATOM 319 CG ASN A 24 25.153 -2.110 -2.150 1.00 0.00 C ATOM 320 OD1 ASN A 24 25.406 -1.905 -3.334 1.00 0.00 O ATOM 321 ND2 ASN A 24 25.770 -3.063 -1.479 1.00 0.00 N ATOM 0 H ASN A 24 21.224 -1.108 -1.957 1.00 0.00 H new ATOM 0 HA ASN A 24 22.703 -2.792 -1.952 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.829 -0.416 -2.047 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.514 -0.882 -0.502 1.00 0.00 H new ATOM 0 HD21 ASN A 24 26.469 -3.643 -1.943 1.00 0.00 H new ATOM 0 HD22 ASN A 24 25.548 -3.220 -0.496 1.00 0.00 H new ATOM 328 N CYS A 25 21.850 -3.624 0.535 1.00 0.00 N ATOM 329 CA CYS A 25 21.816 -4.516 1.685 1.00 0.00 C ATOM 330 C CYS A 25 22.284 -5.906 1.251 1.00 0.00 C ATOM 331 O CYS A 25 22.222 -6.237 0.063 1.00 0.00 O ATOM 332 CB CYS A 25 20.379 -4.599 2.215 1.00 0.00 C ATOM 333 SG CYS A 25 20.262 -5.171 3.926 1.00 0.00 S ATOM 0 H CYS A 25 20.939 -3.489 0.096 1.00 0.00 H new ATOM 0 HA CYS A 25 22.471 -4.138 2.470 1.00 0.00 H new ATOM 0 HB2 CYS A 25 19.916 -3.615 2.139 1.00 0.00 H new ATOM 0 HB3 CYS A 25 19.805 -5.271 1.577 1.00 0.00 H new ATOM 338 N TYR A 26 22.639 -6.750 2.216 1.00 0.00 N ATOM 339 CA TYR A 26 22.942 -8.157 2.004 1.00 0.00 C ATOM 340 C TYR A 26 22.172 -8.935 3.066 1.00 0.00 C ATOM 341 O TYR A 26 22.332 -8.667 4.257 1.00 0.00 O ATOM 342 CB TYR A 26 24.453 -8.388 2.129 1.00 0.00 C ATOM 343 CG TYR A 26 25.319 -7.550 1.204 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.452 -7.896 -0.154 1.00 0.00 C ATOM 345 CD2 TYR A 26 26.006 -6.427 1.710 1.00 0.00 C ATOM 346 CE1 TYR A 26 26.277 -7.134 -1.002 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.843 -5.668 0.873 1.00 0.00 C ATOM 348 CZ TYR A 26 26.988 -6.025 -0.488 1.00 0.00 C ATOM 349 OH TYR A 26 27.811 -5.314 -1.311 1.00 0.00 O ATOM 0 H TYR A 26 22.725 -6.464 3.191 1.00 0.00 H new ATOM 0 HA TYR A 26 22.648 -8.488 1.008 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.750 -8.187 3.158 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.660 -9.441 1.937 1.00 0.00 H new ATOM 0 HD1 TYR A 26 24.919 -8.749 -0.547 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.888 -6.148 2.747 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.367 -7.396 -2.046 1.00 0.00 H new ATOM 0 HE2 TYR A 26 27.374 -4.815 1.268 1.00 0.00 H new ATOM 0 HH TYR A 26 28.226 -4.583 -0.807 1.00 0.00 H new ATOM 359 N ILE A 27 21.316 -9.866 2.652 1.00 0.00 N ATOM 360 CA ILE A 27 20.361 -10.533 3.529 1.00 0.00 C ATOM 361 C ILE A 27 20.404 -12.018 3.168 1.00 0.00 C ATOM 362 O ILE A 27 20.095 -12.374 2.028 1.00 0.00 O ATOM 363 CB ILE A 27 18.963 -9.889 3.335 1.00 0.00 C ATOM 364 CG1 ILE A 27 19.003 -8.373 3.641 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.881 -10.585 4.168 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.638 -7.684 3.682 1.00 0.00 C ATOM 0 H ILE A 27 21.267 -10.182 1.683 1.00 0.00 H new ATOM 0 HA ILE A 27 20.601 -10.424 4.587 1.00 0.00 H new ATOM 0 HB ILE A 27 18.696 -10.023 2.287 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.497 -8.225 4.601 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.618 -7.882 2.887 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.921 -10.098 3.998 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.813 -11.633 3.874 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.138 -10.520 5.225 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.771 -6.625 3.903 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.146 -7.794 2.716 1.00 0.00 H new ATOM 0 HD13 ILE A 27 17.023 -8.142 4.456 1.00 0.00 H new ATOM 378 N ASP A 28 20.815 -12.857 4.126 1.00 0.00 N ATOM 379 CA ASP A 28 20.971 -14.303 3.971 1.00 0.00 C ATOM 380 C ASP A 28 20.163 -15.022 5.051 1.00 0.00 C ATOM 381 O ASP A 28 20.320 -14.720 6.236 1.00 0.00 O ATOM 382 CB ASP A 28 22.451 -14.681 4.083 1.00 0.00 C ATOM 383 CG ASP A 28 22.627 -16.205 4.181 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.307 -16.918 3.205 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.121 -16.696 5.220 1.00 0.00 O ATOM 0 H ASP A 28 21.056 -12.533 5.063 1.00 0.00 H new ATOM 0 HA ASP A 28 20.604 -14.604 2.990 1.00 0.00 H new ATOM 0 HB2 ASP A 28 22.992 -14.304 3.215 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.886 -14.204 4.962 1.00 0.00 H new ATOM 390 N ASN A 29 19.304 -15.963 4.647 1.00 0.00 N ATOM 391 CA ASN A 29 18.283 -16.636 5.458 1.00 0.00 C ATOM 392 C ASN A 29 17.603 -15.719 6.491 1.00 0.00 C ATOM 393 O ASN A 29 17.385 -16.131 7.633 1.00 0.00 O ATOM 394 CB ASN A 29 18.842 -17.924 6.095 1.00 0.00 C ATOM 395 CG ASN A 29 17.705 -18.859 6.520 1.00 0.00 C ATOM 396 OD1 ASN A 29 16.889 -19.259 5.697 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.613 -19.264 7.776 1.00 0.00 N ATOM 0 H ASN A 29 19.303 -16.297 3.683 1.00 0.00 H new ATOM 0 HA ASN A 29 17.486 -16.919 4.771 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.492 -18.434 5.384 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.454 -17.671 6.961 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.868 -19.903 8.052 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.287 -18.937 8.468 1.00 0.00 H new ATOM 404 N SER A 30 17.304 -14.469 6.127 1.00 0.00 N ATOM 405 CA SER A 30 16.863 -13.446 7.068 1.00 0.00 C ATOM 406 C SER A 30 15.605 -12.726 6.588 1.00 0.00 C ATOM 407 O SER A 30 15.273 -12.751 5.404 1.00 0.00 O ATOM 408 CB SER A 30 17.994 -12.440 7.289 1.00 0.00 C ATOM 409 OG SER A 30 19.127 -13.030 7.879 1.00 0.00 O ATOM 0 H SER A 30 17.363 -14.140 5.163 1.00 0.00 H new ATOM 0 HA SER A 30 16.612 -13.939 8.007 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.274 -11.996 6.334 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.637 -11.629 7.924 1.00 0.00 H new ATOM 0 HG SER A 30 19.712 -13.387 7.179 1.00 0.00 H new ATOM 415 N GLN A 31 14.912 -12.041 7.500 1.00 0.00 N ATOM 416 CA GLN A 31 13.666 -11.348 7.204 1.00 0.00 C ATOM 417 C GLN A 31 13.855 -9.850 7.425 1.00 0.00 C ATOM 418 O GLN A 31 14.358 -9.433 8.471 1.00 0.00 O ATOM 419 CB GLN A 31 12.519 -11.867 8.086 1.00 0.00 C ATOM 420 CG GLN A 31 12.231 -13.375 7.973 1.00 0.00 C ATOM 421 CD GLN A 31 13.177 -14.249 8.797 1.00 0.00 C ATOM 422 OE1 GLN A 31 13.941 -15.045 8.259 1.00 0.00 O ATOM 423 NE2 GLN A 31 13.137 -14.133 10.114 1.00 0.00 N ATOM 0 H GLN A 31 15.207 -11.954 8.473 1.00 0.00 H new ATOM 0 HA GLN A 31 13.403 -11.538 6.163 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.749 -11.635 9.126 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.611 -11.321 7.831 1.00 0.00 H new ATOM 0 HG2 GLN A 31 11.206 -13.564 8.292 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.298 -13.670 6.926 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.497 -13.468 10.548 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.746 -14.709 10.695 1.00 0.00 H new ATOM 432 N LEU A 32 13.394 -9.064 6.454 1.00 0.00 N ATOM 433 CA LEU A 32 13.361 -7.606 6.452 1.00 0.00 C ATOM 434 C LEU A 32 11.901 -7.237 6.226 1.00 0.00 C ATOM 435 O LEU A 32 11.452 -7.227 5.078 1.00 0.00 O ATOM 436 CB LEU A 32 14.253 -7.106 5.299 1.00 0.00 C ATOM 437 CG LEU A 32 14.179 -5.589 5.037 1.00 0.00 C ATOM 438 CD1 LEU A 32 15.033 -4.793 6.016 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.652 -5.275 3.611 1.00 0.00 C ATOM 0 H LEU A 32 13.010 -9.455 5.594 1.00 0.00 H new ATOM 0 HA LEU A 32 13.730 -7.159 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.287 -7.373 5.516 1.00 0.00 H new ATOM 0 HB3 LEU A 32 13.973 -7.632 4.387 1.00 0.00 H new ATOM 0 HG LEU A 32 13.137 -5.297 5.169 1.00 0.00 H new ATOM 0 HD11 LEU A 32 14.948 -3.730 5.791 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.688 -4.978 7.033 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.074 -5.101 5.925 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.595 -4.200 3.437 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.682 -5.609 3.488 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.015 -5.793 2.894 1.00 0.00 H new ATOM 451 N VAL A 33 11.143 -6.953 7.284 1.00 0.00 N ATOM 452 CA VAL A 33 9.691 -6.822 7.162 1.00 0.00 C ATOM 453 C VAL A 33 9.142 -5.619 7.934 1.00 0.00 C ATOM 454 O VAL A 33 9.868 -4.938 8.665 1.00 0.00 O ATOM 455 CB VAL A 33 9.024 -8.166 7.563 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.317 -9.275 6.538 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.436 -8.660 8.959 1.00 0.00 C ATOM 0 H VAL A 33 11.505 -6.810 8.227 1.00 0.00 H new ATOM 0 HA VAL A 33 9.440 -6.614 6.122 1.00 0.00 H new ATOM 0 HB VAL A 33 7.955 -7.953 7.583 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.833 -10.199 6.854 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.932 -8.979 5.562 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.393 -9.433 6.471 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.933 -9.603 9.174 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.515 -8.809 8.988 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.152 -7.919 9.706 1.00 0.00 H new ATOM 467 N ASP A 34 7.841 -5.377 7.759 1.00 0.00 N ATOM 468 CA ASP A 34 7.057 -4.317 8.393 1.00 0.00 C ATOM 469 C ASP A 34 7.692 -2.930 8.238 1.00 0.00 C ATOM 470 O ASP A 34 7.822 -2.164 9.187 1.00 0.00 O ATOM 471 CB ASP A 34 6.711 -4.693 9.837 1.00 0.00 C ATOM 472 CG ASP A 34 5.579 -3.835 10.420 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.703 -3.365 9.655 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.513 -3.745 11.667 1.00 0.00 O ATOM 0 H ASP A 34 7.274 -5.950 7.134 1.00 0.00 H new ATOM 0 HA ASP A 34 6.110 -4.231 7.859 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.421 -5.743 9.875 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.600 -4.585 10.459 1.00 0.00 H new ATOM 479 N THR A 35 8.115 -2.624 7.015 1.00 0.00 N ATOM 480 CA THR A 35 8.714 -1.380 6.592 1.00 0.00 C ATOM 481 C THR A 35 10.012 -1.051 7.348 1.00 0.00 C ATOM 482 O THR A 35 10.258 0.092 7.745 1.00 0.00 O ATOM 483 CB THR A 35 7.641 -0.281 6.525 1.00 0.00 C ATOM 484 OG1 THR A 35 6.384 -0.797 6.110 1.00 0.00 O ATOM 485 CG2 THR A 35 8.030 0.768 5.484 1.00 0.00 C ATOM 0 H THR A 35 8.039 -3.291 6.247 1.00 0.00 H new ATOM 0 HA THR A 35 9.084 -1.473 5.571 1.00 0.00 H new ATOM 0 HB THR A 35 7.568 0.141 7.527 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.520 -1.456 5.398 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.264 1.542 5.444 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.985 1.216 5.758 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.119 0.295 4.506 1.00 0.00 H new ATOM 493 N SER A 36 10.850 -2.072 7.567 1.00 0.00 N ATOM 494 CA SER A 36 12.207 -1.865 8.040 1.00 0.00 C ATOM 495 C SER A 36 13.003 -1.246 6.890 1.00 0.00 C ATOM 496 O SER A 36 12.602 -1.351 5.723 1.00 0.00 O ATOM 497 CB SER A 36 12.857 -3.198 8.419 1.00 0.00 C ATOM 498 OG SER A 36 12.173 -3.800 9.491 1.00 0.00 O ATOM 0 H SER A 36 10.602 -3.051 7.421 1.00 0.00 H new ATOM 0 HA SER A 36 12.196 -1.220 8.919 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.854 -3.867 7.558 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.899 -3.035 8.693 1.00 0.00 H new ATOM 0 HG SER A 36 11.392 -4.284 9.150 1.00 0.00 H new ATOM 504 N ILE A 37 14.166 -0.680 7.206 1.00 0.00 N ATOM 505 CA ILE A 37 15.092 -0.178 6.204 1.00 0.00 C ATOM 506 C ILE A 37 16.510 -0.645 6.506 1.00 0.00 C ATOM 507 O ILE A 37 16.918 -0.647 7.667 1.00 0.00 O ATOM 508 CB ILE A 37 14.975 1.352 6.039 1.00 0.00 C ATOM 509 CG1 ILE A 37 15.855 1.856 4.873 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.240 2.132 7.328 1.00 0.00 C ATOM 511 CD1 ILE A 37 15.534 3.288 4.427 1.00 0.00 C ATOM 0 H ILE A 37 14.489 -0.558 8.166 1.00 0.00 H new ATOM 0 HA ILE A 37 14.821 -0.599 5.236 1.00 0.00 H new ATOM 0 HB ILE A 37 13.932 1.550 5.791 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.902 1.805 5.172 1.00 0.00 H new ATOM 0 HG13 ILE A 37 15.734 1.185 4.023 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.140 3.200 7.134 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.520 1.832 8.089 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.250 1.920 7.680 1.00 0.00 H new ATOM 0 HD11 ILE A 37 16.193 3.570 3.606 1.00 0.00 H new ATOM 0 HD12 ILE A 37 14.497 3.342 4.095 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.684 3.972 5.263 1.00 0.00 H new ATOM 523 N CYS A 38 17.262 -0.978 5.456 1.00 0.00 N ATOM 524 CA CYS A 38 18.648 -1.390 5.530 1.00 0.00 C ATOM 525 C CYS A 38 19.446 -0.513 4.577 1.00 0.00 C ATOM 526 O CYS A 38 19.006 -0.292 3.447 1.00 0.00 O ATOM 527 CB CYS A 38 18.756 -2.851 5.094 1.00 0.00 C ATOM 528 SG CYS A 38 20.453 -3.456 4.977 1.00 0.00 S ATOM 0 H CYS A 38 16.902 -0.965 4.502 1.00 0.00 H new ATOM 0 HA CYS A 38 19.030 -1.290 6.546 1.00 0.00 H new ATOM 0 HB2 CYS A 38 18.207 -3.473 5.801 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.272 -2.967 4.125 1.00 0.00 H new ATOM 533 N THR A 39 20.633 -0.084 4.998 1.00 0.00 N ATOM 534 CA THR A 39 21.561 0.689 4.194 1.00 0.00 C ATOM 535 C THR A 39 22.948 0.083 4.404 1.00 0.00 C ATOM 536 O THR A 39 23.566 0.292 5.446 1.00 0.00 O ATOM 537 CB THR A 39 21.481 2.177 4.590 1.00 0.00 C ATOM 538 OG1 THR A 39 20.144 2.643 4.538 1.00 0.00 O ATOM 539 CG2 THR A 39 22.323 3.059 3.661 1.00 0.00 C ATOM 0 H THR A 39 20.981 -0.273 5.938 1.00 0.00 H new ATOM 0 HA THR A 39 21.319 0.649 3.132 1.00 0.00 H new ATOM 0 HB THR A 39 21.868 2.246 5.607 1.00 0.00 H new ATOM 0 HG1 THR A 39 20.117 3.588 4.794 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.240 4.100 3.974 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.366 2.747 3.711 1.00 0.00 H new ATOM 0 HG23 THR A 39 21.962 2.958 2.637 1.00 0.00 H new ATOM 547 N ARG A 40 23.443 -0.690 3.432 1.00 0.00 N ATOM 548 CA ARG A 40 24.767 -1.327 3.462 1.00 0.00 C ATOM 549 C ARG A 40 24.977 -2.270 4.660 1.00 0.00 C ATOM 550 O ARG A 40 26.126 -2.566 4.995 1.00 0.00 O ATOM 551 CB ARG A 40 25.881 -0.259 3.346 1.00 0.00 C ATOM 552 CG ARG A 40 25.768 0.617 2.085 1.00 0.00 C ATOM 553 CD ARG A 40 26.868 1.685 2.014 1.00 0.00 C ATOM 554 NE ARG A 40 26.718 2.709 3.069 1.00 0.00 N ATOM 555 CZ ARG A 40 27.473 2.853 4.168 1.00 0.00 C ATOM 556 NH1 ARG A 40 28.480 2.020 4.423 1.00 0.00 N ATOM 557 NH2 ARG A 40 27.212 3.844 5.017 1.00 0.00 N ATOM 0 H ARG A 40 22.922 -0.896 2.580 1.00 0.00 H new ATOM 0 HA ARG A 40 24.824 -1.979 2.590 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.851 0.382 4.227 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.851 -0.756 3.347 1.00 0.00 H new ATOM 0 HG2 ARG A 40 25.823 -0.017 1.200 1.00 0.00 H new ATOM 0 HG3 ARG A 40 24.792 1.103 2.070 1.00 0.00 H new ATOM 0 HD2 ARG A 40 27.843 1.207 2.109 1.00 0.00 H new ATOM 0 HD3 ARG A 40 26.843 2.166 1.036 1.00 0.00 H new ATOM 0 HE ARG A 40 25.958 3.379 2.948 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.687 1.258 3.778 1.00 0.00 H new ATOM 0 HH12 ARG A 40 29.044 2.144 5.264 1.00 0.00 H new ATOM 0 HH21 ARG A 40 26.443 4.487 4.829 1.00 0.00 H new ATOM 0 HH22 ARG A 40 27.781 3.961 5.855 1.00 0.00 H new ATOM 571 N SER A 41 23.914 -2.755 5.309 1.00 0.00 N ATOM 572 CA SER A 41 24.044 -3.697 6.414 1.00 0.00 C ATOM 573 C SER A 41 24.045 -5.140 5.894 1.00 0.00 C ATOM 574 O SER A 41 23.673 -5.412 4.747 1.00 0.00 O ATOM 575 CB SER A 41 22.933 -3.486 7.454 1.00 0.00 C ATOM 576 OG SER A 41 22.868 -2.130 7.864 1.00 0.00 O ATOM 0 H SER A 41 22.951 -2.506 5.083 1.00 0.00 H new ATOM 0 HA SER A 41 24.998 -3.512 6.908 1.00 0.00 H new ATOM 0 HB2 SER A 41 21.974 -3.788 7.033 1.00 0.00 H new ATOM 0 HB3 SER A 41 23.115 -4.123 8.320 1.00 0.00 H new ATOM 0 HG SER A 41 22.274 -2.051 8.639 1.00 0.00 H new ATOM 582 N GLN A 42 24.439 -6.060 6.773 1.00 0.00 N ATOM 583 CA GLN A 42 24.440 -7.503 6.560 1.00 0.00 C ATOM 584 C GLN A 42 23.454 -8.110 7.554 1.00 0.00 C ATOM 585 O GLN A 42 23.552 -7.829 8.749 1.00 0.00 O ATOM 586 CB GLN A 42 25.861 -8.048 6.799 1.00 0.00 C ATOM 587 CG GLN A 42 25.985 -9.584 6.753 1.00 0.00 C ATOM 588 CD GLN A 42 25.740 -10.180 5.364 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.418 -9.836 4.400 1.00 0.00 O ATOM 590 NE2 GLN A 42 24.790 -11.089 5.221 1.00 0.00 N ATOM 0 H GLN A 42 24.783 -5.804 7.699 1.00 0.00 H new ATOM 0 HA GLN A 42 24.145 -7.757 5.542 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.528 -7.622 6.050 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.209 -7.699 7.771 1.00 0.00 H new ATOM 0 HG2 GLN A 42 26.981 -9.869 7.091 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.274 -10.018 7.456 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.229 -11.372 6.025 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.618 -11.507 4.307 1.00 0.00 H new ATOM 599 N TYR A 43 22.532 -8.952 7.087 1.00 0.00 N ATOM 600 CA TYR A 43 21.669 -9.768 7.935 1.00 0.00 C ATOM 601 C TYR A 43 22.026 -11.219 7.626 1.00 0.00 C ATOM 602 O TYR A 43 22.148 -11.576 6.449 1.00 0.00 O ATOM 603 CB TYR A 43 20.173 -9.580 7.627 1.00 0.00 C ATOM 604 CG TYR A 43 19.496 -8.223 7.750 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.184 -7.031 8.058 1.00 0.00 C ATOM 606 CD2 TYR A 43 18.107 -8.177 7.529 1.00 0.00 C ATOM 607 CE1 TYR A 43 19.504 -5.804 8.092 1.00 0.00 C ATOM 608 CE2 TYR A 43 17.412 -6.960 7.594 1.00 0.00 C ATOM 609 CZ TYR A 43 18.112 -5.765 7.866 1.00 0.00 C ATOM 610 OH TYR A 43 17.457 -4.578 7.954 1.00 0.00 O ATOM 0 H TYR A 43 22.362 -9.087 6.090 1.00 0.00 H new ATOM 0 HA TYR A 43 21.824 -9.483 8.976 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.016 -9.920 6.603 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.628 -10.265 8.277 1.00 0.00 H new ATOM 0 HD1 TYR A 43 21.243 -7.063 8.269 1.00 0.00 H new ATOM 0 HD2 TYR A 43 17.571 -9.088 7.307 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.045 -4.891 8.291 1.00 0.00 H new ATOM 0 HE2 TYR A 43 16.344 -6.938 7.436 1.00 0.00 H new ATOM 0 HH TYR A 43 16.522 -4.738 8.201 1.00 0.00 H new ATOM 620 N SER A 44 22.166 -12.049 8.653 1.00 0.00 N ATOM 621 CA SER A 44 22.541 -13.443 8.509 1.00 0.00 C ATOM 622 C SER A 44 21.761 -14.256 9.542 1.00 0.00 C ATOM 623 O SER A 44 21.951 -14.081 10.748 1.00 0.00 O ATOM 624 CB SER A 44 24.056 -13.586 8.697 1.00 0.00 C ATOM 625 OG SER A 44 24.771 -12.753 7.792 1.00 0.00 O ATOM 0 H SER A 44 22.019 -11.764 9.621 1.00 0.00 H new ATOM 0 HA SER A 44 22.298 -13.815 7.514 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.323 -13.327 9.721 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.347 -14.625 8.545 1.00 0.00 H new ATOM 0 HG SER A 44 25.734 -12.864 7.936 1.00 0.00 H new ATOM 631 N ASP A 45 20.890 -15.147 9.066 1.00 0.00 N ATOM 632 CA ASP A 45 19.980 -15.974 9.863 1.00 0.00 C ATOM 633 C ASP A 45 19.220 -15.176 10.941 1.00 0.00 C ATOM 634 O ASP A 45 19.081 -15.621 12.081 1.00 0.00 O ATOM 635 CB ASP A 45 20.739 -17.193 10.416 1.00 0.00 C ATOM 636 CG ASP A 45 19.774 -18.260 10.954 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.848 -18.648 10.208 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.982 -18.778 12.075 1.00 0.00 O ATOM 0 H ASP A 45 20.795 -15.321 8.065 1.00 0.00 H new ATOM 0 HA ASP A 45 19.190 -16.343 9.209 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.359 -17.624 9.630 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.411 -16.874 11.213 1.00 0.00 H new ATOM 643 N ALA A 46 18.745 -13.972 10.597 1.00 0.00 N ATOM 644 CA ALA A 46 18.202 -12.987 11.530 1.00 0.00 C ATOM 645 C ALA A 46 16.819 -12.464 11.118 1.00 0.00 C ATOM 646 O ALA A 46 16.349 -12.699 10.007 1.00 0.00 O ATOM 647 CB ALA A 46 19.204 -11.828 11.616 1.00 0.00 C ATOM 0 H ALA A 46 18.729 -13.650 9.629 1.00 0.00 H new ATOM 0 HA ALA A 46 18.061 -13.467 12.498 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.828 -11.073 12.306 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.163 -12.202 11.974 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.333 -11.385 10.629 1.00 0.00 H new ATOM 653 N ASN A 47 16.170 -11.699 11.999 1.00 0.00 N ATOM 654 CA ASN A 47 14.867 -11.085 11.750 1.00 0.00 C ATOM 655 C ASN A 47 14.938 -9.615 12.108 1.00 0.00 C ATOM 656 O ASN A 47 15.468 -9.263 13.161 1.00 0.00 O ATOM 657 CB ASN A 47 13.789 -11.732 12.620 1.00 0.00 C ATOM 658 CG ASN A 47 12.383 -11.293 12.234 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.746 -11.939 11.409 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.866 -10.213 12.799 1.00 0.00 N ATOM 0 H ASN A 47 16.545 -11.486 12.923 1.00 0.00 H new ATOM 0 HA ASN A 47 14.616 -11.222 10.698 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.863 -12.816 12.537 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.970 -11.479 13.665 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.925 -9.908 12.550 1.00 0.00 H new ATOM 0 HD22 ASN A 47 12.408 -9.686 13.484 1.00 0.00 H new ATOM 667 N VAL A 48 14.344 -8.779 11.274 1.00 0.00 N ATOM 668 CA VAL A 48 14.289 -7.336 11.461 1.00 0.00 C ATOM 669 C VAL A 48 12.872 -6.872 11.119 1.00 0.00 C ATOM 670 O VAL A 48 12.355 -7.188 10.040 1.00 0.00 O ATOM 671 CB VAL A 48 15.388 -6.647 10.620 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.419 -5.145 10.920 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.790 -7.220 10.902 1.00 0.00 C ATOM 0 H VAL A 48 13.873 -9.092 10.425 1.00 0.00 H new ATOM 0 HA VAL A 48 14.494 -7.057 12.495 1.00 0.00 H new ATOM 0 HB VAL A 48 15.140 -6.831 9.575 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.197 -4.670 10.322 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.453 -4.705 10.674 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.629 -4.990 11.978 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.525 -6.702 10.286 1.00 0.00 H new ATOM 0 HG22 VAL A 48 17.035 -7.080 11.955 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.803 -8.284 10.665 1.00 0.00 H new ATOM 683 N LYS A 49 12.242 -6.139 12.048 1.00 0.00 N ATOM 684 CA LYS A 49 10.852 -5.703 11.932 1.00 0.00 C ATOM 685 C LYS A 49 10.754 -4.232 12.319 1.00 0.00 C ATOM 686 O LYS A 49 11.220 -3.836 13.394 1.00 0.00 O ATOM 687 CB LYS A 49 9.953 -6.589 12.812 1.00 0.00 C ATOM 688 CG LYS A 49 8.457 -6.338 12.554 1.00 0.00 C ATOM 689 CD LYS A 49 7.566 -7.247 13.413 1.00 0.00 C ATOM 690 CE LYS A 49 6.067 -7.122 13.090 1.00 0.00 C ATOM 691 NZ LYS A 49 5.470 -5.824 13.502 1.00 0.00 N ATOM 0 H LYS A 49 12.693 -5.831 12.910 1.00 0.00 H new ATOM 0 HA LYS A 49 10.508 -5.806 10.903 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.182 -7.638 12.622 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.175 -6.400 13.862 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.222 -5.295 12.766 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.237 -6.506 11.500 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.875 -8.283 13.272 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.724 -7.008 14.465 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.924 -7.253 12.017 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.530 -7.931 13.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.544 -5.993 13.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 6.099 -5.354 14.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.350 -5.217 12.667 1.00 0.00 H new ATOM 705 N LYS A 50 10.127 -3.441 11.444 1.00 0.00 N ATOM 706 CA LYS A 50 9.978 -1.990 11.519 1.00 0.00 C ATOM 707 C LYS A 50 11.191 -1.296 12.151 1.00 0.00 C ATOM 708 O LYS A 50 11.039 -0.517 13.090 1.00 0.00 O ATOM 709 CB LYS A 50 8.636 -1.676 12.209 1.00 0.00 C ATOM 710 CG LYS A 50 8.131 -0.249 11.940 1.00 0.00 C ATOM 711 CD LYS A 50 6.730 -0.071 12.540 1.00 0.00 C ATOM 712 CE LYS A 50 6.136 1.319 12.263 1.00 0.00 C ATOM 713 NZ LYS A 50 6.849 2.414 12.968 1.00 0.00 N ATOM 0 H LYS A 50 9.682 -3.825 10.611 1.00 0.00 H new ATOM 0 HA LYS A 50 9.950 -1.570 10.513 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.885 -2.389 11.869 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.747 -1.818 13.284 1.00 0.00 H new ATOM 0 HG2 LYS A 50 8.818 0.477 12.375 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.104 -0.059 10.867 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.066 -0.833 12.132 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.778 -0.233 13.617 1.00 0.00 H new ATOM 0 HE2 LYS A 50 6.161 1.510 11.190 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.088 1.325 12.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 6.400 3.324 12.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 6.804 2.253 13.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 7.843 2.433 12.664 1.00 0.00 H new ATOM 727 N SER A 51 12.399 -1.597 11.674 1.00 0.00 N ATOM 728 CA SER A 51 13.633 -1.108 12.274 1.00 0.00 C ATOM 729 C SER A 51 14.465 -0.408 11.210 1.00 0.00 C ATOM 730 O SER A 51 14.263 -0.615 10.015 1.00 0.00 O ATOM 731 CB SER A 51 14.392 -2.280 12.896 1.00 0.00 C ATOM 732 OG SER A 51 13.676 -2.829 13.986 1.00 0.00 O ATOM 0 H SER A 51 12.546 -2.190 10.857 1.00 0.00 H new ATOM 0 HA SER A 51 13.413 -0.389 13.063 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.560 -3.050 12.143 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.373 -1.944 13.233 1.00 0.00 H new ATOM 0 HG SER A 51 12.758 -3.030 13.707 1.00 0.00 H new ATOM 738 N VAL A 52 15.411 0.414 11.640 1.00 0.00 N ATOM 739 CA VAL A 52 16.259 1.216 10.780 1.00 0.00 C ATOM 740 C VAL A 52 17.667 0.681 10.983 1.00 0.00 C ATOM 741 O VAL A 52 18.091 0.485 12.124 1.00 0.00 O ATOM 742 CB VAL A 52 16.116 2.704 11.178 1.00 0.00 C ATOM 743 CG1 VAL A 52 17.028 3.622 10.350 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.666 3.197 11.033 1.00 0.00 C ATOM 0 H VAL A 52 15.614 0.543 12.631 1.00 0.00 H new ATOM 0 HA VAL A 52 15.992 1.155 9.725 1.00 0.00 H new ATOM 0 HB VAL A 52 16.417 2.756 12.224 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.890 4.655 10.668 1.00 0.00 H new ATOM 0 HG12 VAL A 52 18.068 3.332 10.500 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.774 3.531 9.294 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.608 4.246 11.322 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.347 3.088 9.997 1.00 0.00 H new ATOM 0 HG23 VAL A 52 14.015 2.606 11.677 1.00 0.00 H new ATOM 754 N THR A 53 18.404 0.429 9.907 1.00 0.00 N ATOM 755 CA THR A 53 19.775 -0.039 10.070 1.00 0.00 C ATOM 756 C THR A 53 20.675 0.484 8.958 1.00 0.00 C ATOM 757 O THR A 53 20.291 0.508 7.785 1.00 0.00 O ATOM 758 CB THR A 53 19.809 -1.563 10.321 1.00 0.00 C ATOM 759 OG1 THR A 53 21.087 -2.103 10.066 1.00 0.00 O ATOM 760 CG2 THR A 53 18.819 -2.409 9.535 1.00 0.00 C ATOM 0 H THR A 53 18.089 0.536 8.943 1.00 0.00 H new ATOM 0 HA THR A 53 20.210 0.389 10.973 1.00 0.00 H new ATOM 0 HB THR A 53 19.524 -1.621 11.372 1.00 0.00 H new ATOM 0 HG1 THR A 53 21.037 -3.082 10.080 1.00 0.00 H new ATOM 0 HG21 THR A 53 18.945 -3.458 9.802 1.00 0.00 H new ATOM 0 HG22 THR A 53 17.803 -2.094 9.772 1.00 0.00 H new ATOM 0 HG23 THR A 53 18.999 -2.282 8.467 1.00 0.00 H new ATOM 768 N THR A 54 21.875 0.919 9.352 1.00 0.00 N ATOM 769 CA THR A 54 22.905 1.415 8.461 1.00 0.00 C ATOM 770 C THR A 54 24.240 0.808 8.893 1.00 0.00 C ATOM 771 O THR A 54 24.604 0.889 10.071 1.00 0.00 O ATOM 772 CB THR A 54 22.937 2.955 8.505 1.00 0.00 C ATOM 773 OG1 THR A 54 21.667 3.499 8.190 1.00 0.00 O ATOM 774 CG2 THR A 54 23.956 3.544 7.521 1.00 0.00 C ATOM 0 H THR A 54 22.156 0.932 10.332 1.00 0.00 H new ATOM 0 HA THR A 54 22.701 1.125 7.430 1.00 0.00 H new ATOM 0 HB THR A 54 23.225 3.219 9.522 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.712 4.477 8.226 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.941 4.632 7.589 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.953 3.179 7.767 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.699 3.241 6.506 1.00 0.00 H new ATOM 782 N ASP A 55 24.978 0.257 7.924 1.00 0.00 N ATOM 783 CA ASP A 55 26.313 -0.328 8.064 1.00 0.00 C ATOM 784 C ASP A 55 26.412 -1.256 9.283 1.00 0.00 C ATOM 785 O ASP A 55 27.323 -1.148 10.106 1.00 0.00 O ATOM 786 CB ASP A 55 27.379 0.778 8.033 1.00 0.00 C ATOM 787 CG ASP A 55 28.814 0.218 8.033 1.00 0.00 C ATOM 788 OD1 ASP A 55 29.090 -0.774 7.322 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.694 0.817 8.692 1.00 0.00 O ATOM 0 H ASP A 55 24.638 0.205 6.964 1.00 0.00 H new ATOM 0 HA ASP A 55 26.506 -0.977 7.210 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.233 1.393 7.145 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.247 1.429 8.897 1.00 0.00 H new ATOM 794 N CYS A 56 25.422 -2.140 9.435 1.00 0.00 N ATOM 795 CA CYS A 56 25.267 -2.997 10.601 1.00 0.00 C ATOM 796 C CYS A 56 25.613 -4.434 10.212 1.00 0.00 C ATOM 797 O CYS A 56 25.620 -4.768 9.024 1.00 0.00 O ATOM 798 CB CYS A 56 23.816 -2.894 11.087 1.00 0.00 C ATOM 799 SG CYS A 56 23.445 -3.474 12.765 1.00 0.00 S ATOM 0 H CYS A 56 24.694 -2.278 8.734 1.00 0.00 H new ATOM 0 HA CYS A 56 25.935 -2.688 11.405 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.513 -1.849 11.019 1.00 0.00 H new ATOM 0 HB3 CYS A 56 23.189 -3.454 10.393 1.00 0.00 H new ATOM 804 N ASN A 57 25.827 -5.318 11.188 1.00 0.00 N ATOM 805 CA ASN A 57 25.944 -6.751 10.949 1.00 0.00 C ATOM 806 C ASN A 57 25.049 -7.415 11.974 1.00 0.00 C ATOM 807 O ASN A 57 25.252 -7.206 13.165 1.00 0.00 O ATOM 808 CB ASN A 57 27.391 -7.248 11.083 1.00 0.00 C ATOM 809 CG ASN A 57 27.452 -8.770 10.938 1.00 0.00 C ATOM 810 OD1 ASN A 57 26.698 -9.365 10.175 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.337 -9.439 11.657 1.00 0.00 N ATOM 0 H ASN A 57 25.924 -5.056 12.169 1.00 0.00 H new ATOM 0 HA ASN A 57 25.646 -6.994 9.929 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.014 -6.779 10.322 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.795 -6.953 12.052 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.395 -10.454 11.579 1.00 0.00 H new ATOM 0 HD22 ASN A 57 28.962 -8.940 12.290 1.00 0.00 H new ATOM 818 N ILE A 58 24.044 -8.157 11.529 1.00 0.00 N ATOM 819 CA ILE A 58 22.982 -8.678 12.372 1.00 0.00 C ATOM 820 C ILE A 58 23.015 -10.186 12.169 1.00 0.00 C ATOM 821 O ILE A 58 22.540 -10.685 11.148 1.00 0.00 O ATOM 822 CB ILE A 58 21.627 -8.017 12.009 1.00 0.00 C ATOM 823 CG1 ILE A 58 21.706 -6.477 12.142 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.511 -8.589 12.902 1.00 0.00 C ATOM 825 CD1 ILE A 58 20.411 -5.731 11.803 1.00 0.00 C ATOM 0 H ILE A 58 23.944 -8.418 10.548 1.00 0.00 H new ATOM 0 HA ILE A 58 23.117 -8.448 13.429 1.00 0.00 H new ATOM 0 HB ILE A 58 21.396 -8.245 10.968 1.00 0.00 H new ATOM 0 HG12 ILE A 58 21.993 -6.230 13.164 1.00 0.00 H new ATOM 0 HG13 ILE A 58 22.500 -6.111 11.491 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.561 -8.121 12.642 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.439 -9.666 12.749 1.00 0.00 H new ATOM 0 HG23 ILE A 58 20.742 -8.386 13.948 1.00 0.00 H new ATOM 0 HD11 ILE A 58 20.566 -4.659 11.926 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.129 -5.941 10.771 1.00 0.00 H new ATOM 0 HD13 ILE A 58 19.615 -6.061 12.471 1.00 0.00 H new ATOM 837 N ASP A 59 23.613 -10.907 13.115 1.00 0.00 N ATOM 838 CA ASP A 59 23.856 -12.336 12.993 1.00 0.00 C ATOM 839 C ASP A 59 23.005 -13.058 14.026 1.00 0.00 C ATOM 840 O ASP A 59 23.050 -12.710 15.207 1.00 0.00 O ATOM 841 CB ASP A 59 25.348 -12.604 13.210 1.00 0.00 C ATOM 842 CG ASP A 59 25.623 -14.101 13.343 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.568 -14.827 12.325 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.912 -14.558 14.468 1.00 0.00 O ATOM 0 H ASP A 59 23.944 -10.509 13.994 1.00 0.00 H new ATOM 0 HA ASP A 59 23.585 -12.700 12.002 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.919 -12.199 12.375 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.687 -12.087 14.108 1.00 0.00 H new ATOM 849 N LYS A 60 22.214 -14.047 13.602 1.00 0.00 N ATOM 850 CA LYS A 60 21.421 -14.928 14.473 1.00 0.00 C ATOM 851 C LYS A 60 20.545 -14.163 15.481 1.00 0.00 C ATOM 852 O LYS A 60 20.273 -14.675 16.569 1.00 0.00 O ATOM 853 CB LYS A 60 22.349 -15.961 15.149 1.00 0.00 C ATOM 854 CG LYS A 60 23.135 -16.813 14.139 1.00 0.00 C ATOM 855 CD LYS A 60 24.146 -17.727 14.844 1.00 0.00 C ATOM 856 CE LYS A 60 25.144 -18.332 13.846 1.00 0.00 C ATOM 857 NZ LYS A 60 26.159 -17.346 13.396 1.00 0.00 N ATOM 0 H LYS A 60 22.102 -14.266 12.612 1.00 0.00 H new ATOM 0 HA LYS A 60 20.707 -15.462 13.847 1.00 0.00 H new ATOM 0 HB2 LYS A 60 23.051 -15.440 15.800 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.753 -16.617 15.783 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.442 -17.418 13.554 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.658 -16.161 13.440 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.686 -17.159 15.602 1.00 0.00 H new ATOM 0 HD3 LYS A 60 23.617 -18.527 15.362 1.00 0.00 H new ATOM 0 HE2 LYS A 60 25.646 -19.182 14.308 1.00 0.00 H new ATOM 0 HE3 LYS A 60 24.603 -18.714 12.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.820 -17.805 12.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 25.685 -16.554 12.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 26.684 -16.988 14.219 1.00 0.00 H new ATOM 871 N SER A 61 20.114 -12.944 15.149 1.00 0.00 N ATOM 872 CA SER A 61 19.464 -12.030 16.084 1.00 0.00 C ATOM 873 C SER A 61 18.042 -11.694 15.634 1.00 0.00 C ATOM 874 O SER A 61 17.665 -11.946 14.488 1.00 0.00 O ATOM 875 CB SER A 61 20.314 -10.760 16.221 1.00 0.00 C ATOM 876 OG SER A 61 21.593 -11.059 16.750 1.00 0.00 O ATOM 0 H SER A 61 20.209 -12.561 14.209 1.00 0.00 H new ATOM 0 HA SER A 61 19.385 -12.515 17.057 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.422 -10.284 15.247 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.806 -10.047 16.870 1.00 0.00 H new ATOM 0 HG SER A 61 22.108 -11.571 16.092 1.00 0.00 H new ATOM 882 N GLN A 62 17.260 -11.083 16.523 1.00 0.00 N ATOM 883 CA GLN A 62 15.929 -10.572 16.240 1.00 0.00 C ATOM 884 C GLN A 62 15.896 -9.109 16.673 1.00 0.00 C ATOM 885 O GLN A 62 16.378 -8.769 17.756 1.00 0.00 O ATOM 886 CB GLN A 62 14.855 -11.375 16.978 1.00 0.00 C ATOM 887 CG GLN A 62 14.818 -12.870 16.621 1.00 0.00 C ATOM 888 CD GLN A 62 13.659 -13.603 17.306 1.00 0.00 C ATOM 889 OE1 GLN A 62 12.723 -13.001 17.830 1.00 0.00 O ATOM 890 NE2 GLN A 62 13.691 -14.927 17.322 1.00 0.00 N ATOM 0 H GLN A 62 17.549 -10.928 17.489 1.00 0.00 H new ATOM 0 HA GLN A 62 15.716 -10.663 15.175 1.00 0.00 H new ATOM 0 HB2 GLN A 62 15.018 -11.275 18.051 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.880 -10.939 16.761 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.727 -12.981 15.540 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.761 -13.334 16.911 1.00 0.00 H new ATOM 0 HE21 GLN A 62 14.468 -15.424 16.887 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.938 -15.450 17.770 1.00 0.00 H new ATOM 899 N VAL A 63 15.323 -8.256 15.831 1.00 0.00 N ATOM 900 CA VAL A 63 15.384 -6.811 15.954 1.00 0.00 C ATOM 901 C VAL A 63 13.981 -6.267 15.690 1.00 0.00 C ATOM 902 O VAL A 63 13.369 -6.623 14.678 1.00 0.00 O ATOM 903 CB VAL A 63 16.413 -6.292 14.923 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.567 -4.772 14.983 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.799 -6.941 15.078 1.00 0.00 C ATOM 0 H VAL A 63 14.787 -8.565 15.020 1.00 0.00 H new ATOM 0 HA VAL A 63 15.700 -6.485 16.945 1.00 0.00 H new ATOM 0 HB VAL A 63 16.008 -6.577 13.952 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.299 -4.451 14.242 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.607 -4.300 14.772 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.905 -4.479 15.977 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.477 -6.536 14.326 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.191 -6.728 16.073 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.713 -8.019 14.945 1.00 0.00 H new ATOM 915 N TYR A 64 13.481 -5.403 16.576 1.00 0.00 N ATOM 916 CA TYR A 64 12.135 -4.843 16.486 1.00 0.00 C ATOM 917 C TYR A 64 12.193 -3.358 16.832 1.00 0.00 C ATOM 918 O TYR A 64 12.780 -3.015 17.858 1.00 0.00 O ATOM 919 CB TYR A 64 11.213 -5.567 17.485 1.00 0.00 C ATOM 920 CG TYR A 64 11.123 -7.074 17.311 1.00 0.00 C ATOM 921 CD1 TYR A 64 12.024 -7.923 17.983 1.00 0.00 C ATOM 922 CD2 TYR A 64 10.130 -7.626 16.482 1.00 0.00 C ATOM 923 CE1 TYR A 64 11.944 -9.317 17.812 1.00 0.00 C ATOM 924 CE2 TYR A 64 10.050 -9.018 16.298 1.00 0.00 C ATOM 925 CZ TYR A 64 10.960 -9.872 16.961 1.00 0.00 C ATOM 926 OH TYR A 64 10.869 -11.218 16.772 1.00 0.00 O ATOM 0 H TYR A 64 14.007 -5.070 17.384 1.00 0.00 H new ATOM 0 HA TYR A 64 11.746 -4.972 15.476 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.562 -5.355 18.496 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.211 -5.147 17.399 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.778 -7.502 18.631 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.425 -6.977 15.984 1.00 0.00 H new ATOM 0 HE1 TYR A 64 12.635 -9.964 18.331 1.00 0.00 H new ATOM 0 HE2 TYR A 64 9.293 -9.434 15.650 1.00 0.00 H new ATOM 0 HH TYR A 64 11.616 -11.663 17.223 1.00 0.00 H new ATOM 936 N LEU A 65 11.562 -2.472 16.051 1.00 0.00 N ATOM 937 CA LEU A 65 11.461 -1.030 16.357 1.00 0.00 C ATOM 938 C LEU A 65 12.810 -0.378 16.746 1.00 0.00 C ATOM 939 O LEU A 65 12.831 0.604 17.490 1.00 0.00 O ATOM 940 CB LEU A 65 10.388 -0.813 17.453 1.00 0.00 C ATOM 941 CG LEU A 65 8.949 -1.170 17.042 1.00 0.00 C ATOM 942 CD1 LEU A 65 8.050 -1.197 18.284 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.382 -0.159 16.039 1.00 0.00 C ATOM 0 H LEU A 65 11.101 -2.734 15.179 1.00 0.00 H new ATOM 0 HA LEU A 65 11.159 -0.524 15.440 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.658 -1.408 18.326 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.412 0.232 17.760 1.00 0.00 H new ATOM 0 HG LEU A 65 8.972 -2.151 16.567 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.031 -1.450 17.990 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.421 -1.944 18.986 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.057 -0.216 18.760 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.364 -0.443 15.772 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.375 0.834 16.488 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.003 -0.148 15.143 1.00 0.00 H new ATOM 955 N THR A 66 13.940 -0.899 16.262 1.00 0.00 N ATOM 956 CA THR A 66 15.278 -0.535 16.726 1.00 0.00 C ATOM 957 C THR A 66 16.054 0.222 15.639 1.00 0.00 C ATOM 958 O THR A 66 15.671 0.206 14.467 1.00 0.00 O ATOM 959 CB THR A 66 15.930 -1.843 17.225 1.00 0.00 C ATOM 960 OG1 THR A 66 15.299 -2.220 18.435 1.00 0.00 O ATOM 961 CG2 THR A 66 17.439 -1.843 17.484 1.00 0.00 C ATOM 0 H THR A 66 13.949 -1.600 15.521 1.00 0.00 H new ATOM 0 HA THR A 66 15.263 0.175 17.553 1.00 0.00 H new ATOM 0 HB THR A 66 15.790 -2.533 16.393 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.424 -2.615 18.238 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.749 -2.829 17.829 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.966 -1.599 16.562 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.677 -1.101 18.246 1.00 0.00 H new ATOM 969 N THR A 67 17.142 0.898 16.022 1.00 0.00 N ATOM 970 CA THR A 67 17.965 1.720 15.144 1.00 0.00 C ATOM 971 C THR A 67 19.432 1.295 15.302 1.00 0.00 C ATOM 972 O THR A 67 20.048 1.588 16.329 1.00 0.00 O ATOM 973 CB THR A 67 17.727 3.208 15.464 1.00 0.00 C ATOM 974 OG1 THR A 67 16.346 3.522 15.382 1.00 0.00 O ATOM 975 CG2 THR A 67 18.474 4.133 14.496 1.00 0.00 C ATOM 0 H THR A 67 17.481 0.884 16.984 1.00 0.00 H new ATOM 0 HA THR A 67 17.694 1.577 14.098 1.00 0.00 H new ATOM 0 HB THR A 67 18.101 3.367 16.475 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.213 4.470 15.590 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.277 5.172 14.760 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.545 3.939 14.561 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.133 3.946 13.478 1.00 0.00 H new ATOM 983 N CYS A 68 19.995 0.603 14.303 1.00 0.00 N ATOM 984 CA CYS A 68 21.408 0.233 14.280 1.00 0.00 C ATOM 985 C CYS A 68 22.179 1.229 13.413 1.00 0.00 C ATOM 986 O CYS A 68 21.801 1.460 12.261 1.00 0.00 O ATOM 987 CB CYS A 68 21.605 -1.179 13.704 1.00 0.00 C ATOM 988 SG CYS A 68 23.319 -1.762 13.855 1.00 0.00 S ATOM 0 H CYS A 68 19.476 0.284 13.485 1.00 0.00 H new ATOM 0 HA CYS A 68 21.779 0.248 15.305 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.942 -1.874 14.220 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.315 -1.183 12.653 1.00 0.00 H new ATOM 993 N THR A 69 23.296 1.749 13.918 1.00 0.00 N ATOM 994 CA THR A 69 24.190 2.612 13.162 1.00 0.00 C ATOM 995 C THR A 69 25.619 2.125 13.406 1.00 0.00 C ATOM 996 O THR A 69 26.114 2.196 14.534 1.00 0.00 O ATOM 997 CB THR A 69 23.993 4.078 13.602 1.00 0.00 C ATOM 998 OG1 THR A 69 22.621 4.433 13.622 1.00 0.00 O ATOM 999 CG2 THR A 69 24.714 5.051 12.663 1.00 0.00 C ATOM 0 H THR A 69 23.606 1.579 14.875 1.00 0.00 H new ATOM 0 HA THR A 69 23.977 2.570 12.094 1.00 0.00 H new ATOM 0 HB THR A 69 24.413 4.151 14.605 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.529 5.366 13.906 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.553 6.073 13.005 1.00 0.00 H new ATOM 0 HG22 THR A 69 25.782 4.833 12.663 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.321 4.940 11.652 1.00 0.00 H new ATOM 1007 N GLY A 70 26.282 1.612 12.366 1.00 0.00 N ATOM 1008 CA GLY A 70 27.699 1.260 12.416 1.00 0.00 C ATOM 1009 C GLY A 70 28.026 0.284 13.549 1.00 0.00 C ATOM 1010 O GLY A 70 29.057 0.446 14.203 1.00 0.00 O ATOM 0 H GLY A 70 25.846 1.429 11.462 1.00 0.00 H new ATOM 0 HA2 GLY A 70 27.993 0.817 11.464 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.290 2.167 12.541 1.00 0.00 H new ATOM 1014 N SER A 71 27.135 -0.670 13.827 1.00 0.00 N ATOM 1015 CA SER A 71 27.194 -1.540 14.997 1.00 0.00 C ATOM 1016 C SER A 71 26.986 -3.002 14.585 1.00 0.00 C ATOM 1017 O SER A 71 26.785 -3.303 13.408 1.00 0.00 O ATOM 1018 CB SER A 71 26.152 -1.079 16.032 1.00 0.00 C ATOM 1019 OG SER A 71 26.414 0.238 16.470 1.00 0.00 O ATOM 0 H SER A 71 26.333 -0.861 13.227 1.00 0.00 H new ATOM 0 HA SER A 71 28.180 -1.473 15.457 1.00 0.00 H new ATOM 0 HB2 SER A 71 25.155 -1.128 15.594 1.00 0.00 H new ATOM 0 HB3 SER A 71 26.159 -1.757 16.886 1.00 0.00 H new ATOM 0 HG SER A 71 26.286 0.862 15.725 1.00 0.00 H new ATOM 1025 N GLN A 72 27.043 -3.931 15.536 1.00 0.00 N ATOM 1026 CA GLN A 72 26.953 -5.358 15.268 1.00 0.00 C ATOM 1027 C GLN A 72 26.116 -6.026 16.350 1.00 0.00 C ATOM 1028 O GLN A 72 26.257 -5.700 17.529 1.00 0.00 O ATOM 1029 CB GLN A 72 28.381 -5.920 15.190 1.00 0.00 C ATOM 1030 CG GLN A 72 28.457 -7.448 15.109 1.00 0.00 C ATOM 1031 CD GLN A 72 29.865 -7.901 14.727 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.097 -8.355 13.610 1.00 0.00 O ATOM 1033 NE2 GLN A 72 30.831 -7.770 15.621 1.00 0.00 N ATOM 0 H GLN A 72 27.154 -3.708 16.525 1.00 0.00 H new ATOM 0 HA GLN A 72 26.456 -5.556 14.318 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.878 -5.497 14.317 1.00 0.00 H new ATOM 0 HB3 GLN A 72 28.938 -5.587 16.066 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.178 -7.882 16.069 1.00 0.00 H new ATOM 0 HG3 GLN A 72 27.740 -7.814 14.374 1.00 0.00 H new ATOM 0 HE21 GLN A 72 30.623 -7.391 16.545 1.00 0.00 H new ATOM 0 HE22 GLN A 72 31.784 -8.048 15.386 1.00 0.00 H new ATOM 1042 N TYR A 73 25.286 -6.990 15.951 1.00 0.00 N ATOM 1043 CA TYR A 73 24.486 -7.830 16.825 1.00 0.00 C ATOM 1044 C TYR A 73 24.853 -9.272 16.488 1.00 0.00 C ATOM 1045 O TYR A 73 24.911 -9.624 15.307 1.00 0.00 O ATOM 1046 CB TYR A 73 22.984 -7.627 16.555 1.00 0.00 C ATOM 1047 CG TYR A 73 22.390 -6.228 16.667 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.986 -5.219 17.447 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.192 -5.948 15.983 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.430 -3.931 17.486 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.613 -4.669 16.035 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.240 -3.647 16.776 1.00 0.00 C ATOM 1053 OH TYR A 73 20.691 -2.404 16.797 1.00 0.00 O ATOM 0 H TYR A 73 25.151 -7.212 14.965 1.00 0.00 H new ATOM 0 HA TYR A 73 24.679 -7.584 17.869 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.780 -7.990 15.548 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.437 -8.272 17.243 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.876 -5.437 18.019 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.711 -6.727 15.410 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.912 -3.154 18.060 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.691 -4.470 15.509 1.00 0.00 H new ATOM 0 HH TYR A 73 21.313 -1.779 17.224 1.00 0.00 H new ATOM 1063 N ASN A 74 25.078 -10.112 17.494 1.00 0.00 N ATOM 1064 CA ASN A 74 25.270 -11.548 17.323 1.00 0.00 C ATOM 1065 C ASN A 74 24.467 -12.269 18.407 1.00 0.00 C ATOM 1066 O ASN A 74 24.757 -12.103 19.592 1.00 0.00 O ATOM 1067 CB ASN A 74 26.767 -11.903 17.419 1.00 0.00 C ATOM 1068 CG ASN A 74 27.004 -13.335 17.905 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.480 -13.547 19.017 1.00 0.00 O ATOM 1070 ND2 ASN A 74 26.683 -14.350 17.120 1.00 0.00 N ATOM 0 H ASN A 74 25.133 -9.809 18.466 1.00 0.00 H new ATOM 0 HA ASN A 74 24.921 -11.861 16.339 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.230 -11.774 16.441 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.259 -11.207 18.099 1.00 0.00 H new ATOM 0 HD21 ASN A 74 26.831 -15.308 17.438 1.00 0.00 H new ATOM 0 HD22 ASN A 74 26.288 -14.175 16.196 1.00 0.00 H new ATOM 1077 N GLY A 75 23.492 -13.089 18.018 1.00 0.00 N ATOM 1078 CA GLY A 75 22.712 -13.905 18.939 1.00 0.00 C ATOM 1079 C GLY A 75 21.951 -13.084 19.985 1.00 0.00 C ATOM 1080 O GLY A 75 22.013 -13.428 21.170 1.00 0.00 O ATOM 0 H GLY A 75 23.220 -13.205 17.042 1.00 0.00 H new ATOM 0 HA2 GLY A 75 22.001 -14.503 18.370 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.378 -14.601 19.449 1.00 0.00 H new ATOM 1084 N ILE A 76 21.259 -12.006 19.587 1.00 0.00 N ATOM 1085 CA ILE A 76 20.536 -11.134 20.518 1.00 0.00 C ATOM 1086 C ILE A 76 19.062 -10.987 20.130 1.00 0.00 C ATOM 1087 O ILE A 76 18.668 -11.245 18.994 1.00 0.00 O ATOM 1088 CB ILE A 76 21.231 -9.751 20.682 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.771 -8.687 19.657 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.769 -9.867 20.691 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.425 -7.313 19.854 1.00 0.00 C ATOM 0 H ILE A 76 21.186 -11.717 18.612 1.00 0.00 H new ATOM 0 HA ILE A 76 20.565 -11.620 21.493 1.00 0.00 H new ATOM 0 HB ILE A 76 20.906 -9.397 21.660 1.00 0.00 H new ATOM 0 HG12 ILE A 76 20.994 -9.044 18.652 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.689 -8.577 19.723 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.208 -8.876 20.808 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.081 -10.502 21.520 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.106 -10.305 19.752 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.053 -6.621 19.098 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.181 -6.933 20.846 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.507 -7.408 19.758 1.00 0.00 H new ATOM 1103 N TYR A 77 18.265 -10.490 21.067 1.00 0.00 N ATOM 1104 CA TYR A 77 16.895 -10.053 20.884 1.00 0.00 C ATOM 1105 C TYR A 77 16.907 -8.600 21.352 1.00 0.00 C ATOM 1106 O TYR A 77 17.317 -8.331 22.485 1.00 0.00 O ATOM 1107 CB TYR A 77 15.961 -10.934 21.725 1.00 0.00 C ATOM 1108 CG TYR A 77 14.515 -10.471 21.765 1.00 0.00 C ATOM 1109 CD1 TYR A 77 14.122 -9.469 22.675 1.00 0.00 C ATOM 1110 CD2 TYR A 77 13.557 -11.057 20.916 1.00 0.00 C ATOM 1111 CE1 TYR A 77 12.784 -9.042 22.728 1.00 0.00 C ATOM 1112 CE2 TYR A 77 12.213 -10.643 20.971 1.00 0.00 C ATOM 1113 CZ TYR A 77 11.821 -9.626 21.872 1.00 0.00 C ATOM 1114 OH TYR A 77 10.525 -9.210 21.937 1.00 0.00 O ATOM 0 H TYR A 77 18.580 -10.376 22.030 1.00 0.00 H new ATOM 0 HA TYR A 77 16.535 -10.133 19.858 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.992 -11.950 21.332 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.343 -10.975 22.745 1.00 0.00 H new ATOM 0 HD1 TYR A 77 14.853 -9.027 23.335 1.00 0.00 H new ATOM 0 HD2 TYR A 77 13.855 -11.827 20.220 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.491 -8.268 23.422 1.00 0.00 H new ATOM 0 HE2 TYR A 77 11.480 -11.103 20.324 1.00 0.00 H new ATOM 0 HH TYR A 77 9.989 -9.707 21.285 1.00 0.00 H new ATOM 1124 N ILE A 78 16.510 -7.659 20.499 1.00 0.00 N ATOM 1125 CA ILE A 78 16.569 -6.237 20.812 1.00 0.00 C ATOM 1126 C ILE A 78 15.290 -5.567 20.319 1.00 0.00 C ATOM 1127 O ILE A 78 14.859 -5.791 19.180 1.00 0.00 O ATOM 1128 CB ILE A 78 17.881 -5.619 20.270 1.00 0.00 C ATOM 1129 CG1 ILE A 78 17.966 -4.125 20.642 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.080 -5.828 18.757 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.372 -3.530 20.474 1.00 0.00 C ATOM 0 H ILE A 78 16.138 -7.863 19.571 1.00 0.00 H new ATOM 0 HA ILE A 78 16.607 -6.070 21.889 1.00 0.00 H new ATOM 0 HB ILE A 78 18.699 -6.154 20.752 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.267 -3.564 20.022 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.648 -3.998 21.677 1.00 0.00 H new ATOM 0 HG21 ILE A 78 19.019 -5.369 18.447 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.108 -6.895 18.538 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.254 -5.367 18.214 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.357 -2.477 20.754 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.073 -4.066 21.115 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.685 -3.625 19.434 1.00 0.00 H new ATOM 1143 N ARG A 79 14.669 -4.758 21.184 1.00 0.00 N ATOM 1144 CA ARG A 79 13.437 -4.057 20.854 1.00 0.00 C ATOM 1145 C ARG A 79 13.489 -2.600 21.293 1.00 0.00 C ATOM 1146 O ARG A 79 14.008 -2.277 22.369 1.00 0.00 O ATOM 1147 CB ARG A 79 12.200 -4.804 21.384 1.00 0.00 C ATOM 1148 CG ARG A 79 12.214 -5.070 22.896 1.00 0.00 C ATOM 1149 CD ARG A 79 10.939 -5.784 23.358 1.00 0.00 C ATOM 1150 NE ARG A 79 9.773 -4.884 23.384 1.00 0.00 N ATOM 1151 CZ ARG A 79 9.420 -4.092 24.405 1.00 0.00 C ATOM 1152 NH1 ARG A 79 10.167 -4.025 25.505 1.00 0.00 N ATOM 1153 NH2 ARG A 79 8.311 -3.364 24.318 1.00 0.00 N ATOM 0 H ARG A 79 15.010 -4.575 22.128 1.00 0.00 H new ATOM 0 HA ARG A 79 13.340 -4.044 19.768 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.309 -4.226 21.138 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.115 -5.757 20.861 1.00 0.00 H new ATOM 0 HG2 ARG A 79 13.083 -5.676 23.151 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.316 -4.126 23.431 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.733 -6.623 22.693 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.098 -6.199 24.354 1.00 0.00 H new ATOM 0 HE ARG A 79 9.183 -4.862 22.552 1.00 0.00 H new ATOM 0 HH11 ARG A 79 11.019 -4.581 25.577 1.00 0.00 H new ATOM 0 HH12 ARG A 79 9.887 -3.418 26.275 1.00 0.00 H new ATOM 0 HH21 ARG A 79 7.735 -3.411 23.478 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.036 -2.759 25.092 1.00 0.00 H new ATOM 1167 N SER A 80 12.912 -1.734 20.464 1.00 0.00 N ATOM 1168 CA SER A 80 12.697 -0.319 20.736 1.00 0.00 C ATOM 1169 C SER A 80 13.973 0.427 21.169 1.00 0.00 C ATOM 1170 O SER A 80 13.889 1.373 21.955 1.00 0.00 O ATOM 1171 CB SER A 80 11.541 -0.198 21.741 1.00 0.00 C ATOM 1172 OG SER A 80 10.409 -0.935 21.298 1.00 0.00 O ATOM 0 H SER A 80 12.567 -2.013 19.545 1.00 0.00 H new ATOM 0 HA SER A 80 12.420 0.186 19.810 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.861 -0.565 22.716 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.271 0.850 21.868 1.00 0.00 H new ATOM 0 HG SER A 80 9.685 -0.847 21.952 1.00 0.00 H new ATOM 1178 N SER A 81 15.151 0.014 20.685 1.00 0.00 N ATOM 1179 CA SER A 81 16.447 0.487 21.176 1.00 0.00 C ATOM 1180 C SER A 81 17.267 1.164 20.069 1.00 0.00 C ATOM 1181 O SER A 81 16.874 1.166 18.901 1.00 0.00 O ATOM 1182 CB SER A 81 17.190 -0.709 21.777 1.00 0.00 C ATOM 1183 OG SER A 81 16.488 -1.235 22.889 1.00 0.00 O ATOM 0 H SER A 81 15.229 -0.668 19.931 1.00 0.00 H new ATOM 0 HA SER A 81 16.292 1.250 21.939 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.312 -1.484 21.020 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.190 -0.403 22.085 1.00 0.00 H new ATOM 0 HG SER A 81 15.686 -1.705 22.577 1.00 0.00 H new ATOM 1189 N THR A 82 18.423 1.732 20.418 1.00 0.00 N ATOM 1190 CA THR A 82 19.338 2.375 19.479 1.00 0.00 C ATOM 1191 C THR A 82 20.768 1.962 19.836 1.00 0.00 C ATOM 1192 O THR A 82 21.119 1.913 21.018 1.00 0.00 O ATOM 1193 CB THR A 82 19.143 3.903 19.543 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.805 4.253 19.240 1.00 0.00 O ATOM 1195 CG2 THR A 82 20.050 4.665 18.569 1.00 0.00 C ATOM 0 H THR A 82 18.754 1.757 21.382 1.00 0.00 H new ATOM 0 HA THR A 82 19.136 2.061 18.455 1.00 0.00 H new ATOM 0 HB THR A 82 19.403 4.186 20.563 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.703 5.226 19.288 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.866 5.735 18.662 1.00 0.00 H new ATOM 0 HG22 THR A 82 21.094 4.455 18.804 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.836 4.347 17.549 1.00 0.00 H new ATOM 1203 N THR A 83 21.605 1.688 18.837 1.00 0.00 N ATOM 1204 CA THR A 83 22.980 1.255 19.042 1.00 0.00 C ATOM 1205 C THR A 83 23.874 1.968 18.025 1.00 0.00 C ATOM 1206 O THR A 83 23.568 1.964 16.827 1.00 0.00 O ATOM 1207 CB THR A 83 23.062 -0.277 18.920 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.535 -0.692 17.680 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.273 -1.006 20.017 1.00 0.00 C ATOM 0 H THR A 83 21.342 1.762 17.854 1.00 0.00 H new ATOM 0 HA THR A 83 23.327 1.517 20.042 1.00 0.00 H new ATOM 0 HB THR A 83 24.118 -0.531 19.016 1.00 0.00 H new ATOM 0 HG1 THR A 83 23.089 -1.413 17.314 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.368 -2.083 19.879 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.668 -0.729 20.994 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.222 -0.724 19.958 1.00 0.00 H new ATOM 1217 N THR A 84 24.972 2.563 18.494 1.00 0.00 N ATOM 1218 CA THR A 84 25.877 3.359 17.682 1.00 0.00 C ATOM 1219 C THR A 84 27.313 2.917 17.975 1.00 0.00 C ATOM 1220 O THR A 84 27.726 2.874 19.137 1.00 0.00 O ATOM 1221 CB THR A 84 25.659 4.855 17.981 1.00 0.00 C ATOM 1222 OG1 THR A 84 24.281 5.192 17.954 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.375 5.748 16.963 1.00 0.00 C ATOM 0 H THR A 84 25.258 2.500 19.471 1.00 0.00 H new ATOM 0 HA THR A 84 25.681 3.208 16.620 1.00 0.00 H new ATOM 0 HB THR A 84 26.070 5.025 18.976 1.00 0.00 H new ATOM 0 HG1 THR A 84 24.174 6.146 18.149 1.00 0.00 H new ATOM 0 HG21 THR A 84 26.197 6.795 17.209 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.446 5.546 16.991 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.993 5.540 15.964 1.00 0.00 H new ATOM 1231 N GLY A 85 28.084 2.606 16.932 1.00 0.00 N ATOM 1232 CA GLY A 85 29.495 2.253 17.036 1.00 0.00 C ATOM 1233 C GLY A 85 29.795 1.134 18.036 1.00 0.00 C ATOM 1234 O GLY A 85 30.862 1.170 18.648 1.00 0.00 O ATOM 0 H GLY A 85 27.735 2.593 15.974 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.855 1.951 16.052 1.00 0.00 H new ATOM 0 HA3 GLY A 85 30.059 3.141 17.323 1.00 0.00 H new ATOM 1238 N THR A 86 28.908 0.155 18.239 1.00 0.00 N ATOM 1239 CA THR A 86 29.042 -0.849 19.301 1.00 0.00 C ATOM 1240 C THR A 86 28.872 -2.268 18.740 1.00 0.00 C ATOM 1241 O THR A 86 28.385 -2.452 17.628 1.00 0.00 O ATOM 1242 CB THR A 86 28.061 -0.471 20.430 1.00 0.00 C ATOM 1243 OG1 THR A 86 28.210 -1.259 21.596 1.00 0.00 O ATOM 1244 CG2 THR A 86 26.588 -0.517 20.019 1.00 0.00 C ATOM 0 H THR A 86 28.071 0.035 17.668 1.00 0.00 H new ATOM 0 HA THR A 86 30.045 -0.855 19.728 1.00 0.00 H new ATOM 0 HB THR A 86 28.336 0.561 20.649 1.00 0.00 H new ATOM 0 HG1 THR A 86 29.121 -1.619 21.633 1.00 0.00 H new ATOM 0 HG21 THR A 86 25.964 -0.238 20.868 1.00 0.00 H new ATOM 0 HG22 THR A 86 26.417 0.181 19.199 1.00 0.00 H new ATOM 0 HG23 THR A 86 26.332 -1.526 19.696 1.00 0.00 H new ATOM 1252 N SER A 87 29.258 -3.291 19.501 1.00 0.00 N ATOM 1253 CA SER A 87 29.072 -4.687 19.146 1.00 0.00 C ATOM 1254 C SER A 87 28.433 -5.352 20.360 1.00 0.00 C ATOM 1255 O SER A 87 28.893 -5.152 21.486 1.00 0.00 O ATOM 1256 CB SER A 87 30.420 -5.299 18.750 1.00 0.00 C ATOM 1257 OG SER A 87 30.264 -6.606 18.221 1.00 0.00 O ATOM 0 H SER A 87 29.719 -3.163 20.402 1.00 0.00 H new ATOM 0 HA SER A 87 28.422 -4.826 18.282 1.00 0.00 H new ATOM 0 HB2 SER A 87 30.906 -4.662 18.011 1.00 0.00 H new ATOM 0 HB3 SER A 87 31.074 -5.334 19.621 1.00 0.00 H new ATOM 0 HG SER A 87 31.083 -7.121 18.375 1.00 0.00 H new ATOM 1263 N ILE A 88 27.366 -6.113 20.127 1.00 0.00 N ATOM 1264 CA ILE A 88 26.512 -6.705 21.143 1.00 0.00 C ATOM 1265 C ILE A 88 26.430 -8.199 20.818 1.00 0.00 C ATOM 1266 O ILE A 88 26.222 -8.579 19.660 1.00 0.00 O ATOM 1267 CB ILE A 88 25.101 -6.063 21.117 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.024 -4.527 20.913 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.324 -6.463 22.381 1.00 0.00 C ATOM 1270 CD1 ILE A 88 25.631 -3.658 22.021 1.00 0.00 C ATOM 0 H ILE A 88 27.063 -6.342 19.180 1.00 0.00 H new ATOM 0 HA ILE A 88 26.916 -6.539 22.141 1.00 0.00 H new ATOM 0 HB ILE A 88 24.647 -6.467 20.212 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.523 -4.282 19.975 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.976 -4.250 20.798 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.333 -6.009 22.358 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.226 -7.548 22.419 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.861 -6.116 23.264 1.00 0.00 H new ATOM 0 HD11 ILE A 88 25.515 -2.605 21.762 1.00 0.00 H new ATOM 0 HD12 ILE A 88 25.119 -3.859 22.962 1.00 0.00 H new ATOM 0 HD13 ILE A 88 26.691 -3.891 22.127 1.00 0.00 H new ATOM 1282 N SER A 89 26.558 -9.037 21.840 1.00 0.00 N ATOM 1283 CA SER A 89 26.697 -10.479 21.727 1.00 0.00 C ATOM 1284 C SER A 89 25.812 -11.171 22.770 1.00 0.00 C ATOM 1285 O SER A 89 25.319 -10.524 23.700 1.00 0.00 O ATOM 1286 CB SER A 89 28.174 -10.856 21.913 1.00 0.00 C ATOM 1287 OG SER A 89 29.008 -10.161 20.997 1.00 0.00 O ATOM 0 H SER A 89 26.568 -8.715 22.808 1.00 0.00 H new ATOM 0 HA SER A 89 26.373 -10.810 20.740 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.483 -10.628 22.933 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.297 -11.930 21.775 1.00 0.00 H new ATOM 0 HG SER A 89 29.942 -10.421 21.142 1.00 0.00 H new ATOM 1321 N CYS A 93 21.178 -12.778 24.923 1.00 0.00 N ATOM 1322 CA CYS A 93 21.033 -11.346 25.052 1.00 0.00 C ATOM 1323 C CYS A 93 19.623 -10.897 24.710 1.00 0.00 C ATOM 1324 O CYS A 93 19.076 -11.266 23.672 1.00 0.00 O ATOM 1325 CB CYS A 93 22.078 -10.667 24.174 1.00 0.00 C ATOM 1326 SG CYS A 93 22.082 -8.861 24.216 1.00 0.00 S ATOM 0 HA CYS A 93 21.199 -11.055 26.089 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.064 -11.021 24.474 1.00 0.00 H new ATOM 0 HB3 CYS A 93 21.924 -10.988 23.144 1.00 0.00 H new ATOM 1331 N SER A 94 19.080 -10.061 25.583 1.00 0.00 N ATOM 1332 CA SER A 94 17.739 -9.528 25.548 1.00 0.00 C ATOM 1333 C SER A 94 17.866 -8.059 25.948 1.00 0.00 C ATOM 1334 O SER A 94 18.444 -7.765 26.996 1.00 0.00 O ATOM 1335 CB SER A 94 16.897 -10.316 26.558 1.00 0.00 C ATOM 1336 OG SER A 94 16.803 -11.686 26.199 1.00 0.00 O ATOM 0 H SER A 94 19.606 -9.718 26.387 1.00 0.00 H new ATOM 0 HA SER A 94 17.261 -9.609 24.572 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.340 -10.228 27.550 1.00 0.00 H new ATOM 0 HB3 SER A 94 15.898 -9.884 26.616 1.00 0.00 H new ATOM 0 HG SER A 94 16.262 -12.162 26.863 1.00 0.00 H new ATOM 1342 N ILE A 95 17.371 -7.143 25.112 1.00 0.00 N ATOM 1343 CA ILE A 95 17.509 -5.699 25.282 1.00 0.00 C ATOM 1344 C ILE A 95 16.154 -5.075 24.959 1.00 0.00 C ATOM 1345 O ILE A 95 15.548 -5.401 23.935 1.00 0.00 O ATOM 1346 CB ILE A 95 18.631 -5.153 24.357 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.001 -5.729 24.770 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.697 -3.614 24.386 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.194 -5.275 23.925 1.00 0.00 C ATOM 0 H ILE A 95 16.848 -7.396 24.274 1.00 0.00 H new ATOM 0 HA ILE A 95 17.796 -5.447 26.303 1.00 0.00 H new ATOM 0 HB ILE A 95 18.391 -5.468 23.342 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.191 -5.457 25.808 1.00 0.00 H new ATOM 0 HG13 ILE A 95 19.944 -6.817 24.730 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.494 -3.272 23.726 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.745 -3.203 24.049 1.00 0.00 H new ATOM 0 HG23 ILE A 95 18.898 -3.278 25.403 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.105 -5.740 24.302 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.039 -5.571 22.888 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.289 -4.191 23.983 1.00 0.00 H new ATOM 1361 N SER A 96 15.714 -4.138 25.797 1.00 0.00 N ATOM 1362 CA SER A 96 14.542 -3.316 25.560 1.00 0.00 C ATOM 1363 C SER A 96 14.862 -1.867 25.904 1.00 0.00 C ATOM 1364 O SER A 96 15.466 -1.592 26.948 1.00 0.00 O ATOM 1365 CB SER A 96 13.375 -3.793 26.427 1.00 0.00 C ATOM 1366 OG SER A 96 12.855 -5.035 25.983 1.00 0.00 O ATOM 0 H SER A 96 16.179 -3.929 26.681 1.00 0.00 H new ATOM 0 HA SER A 96 14.262 -3.396 24.510 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.707 -3.888 27.461 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.584 -3.043 26.414 1.00 0.00 H new ATOM 0 HG SER A 96 12.354 -5.459 26.711 1.00 0.00 H new ATOM 1372 N THR A 97 14.392 -0.960 25.044 1.00 0.00 N ATOM 1373 CA THR A 97 14.376 0.488 25.256 1.00 0.00 C ATOM 1374 C THR A 97 15.714 1.073 25.757 1.00 0.00 C ATOM 1375 O THR A 97 15.729 1.995 26.576 1.00 0.00 O ATOM 1376 CB THR A 97 13.123 0.878 26.081 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.900 0.022 27.186 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.849 0.792 25.238 1.00 0.00 C ATOM 0 H THR A 97 13.996 -1.227 24.143 1.00 0.00 H new ATOM 0 HA THR A 97 14.282 0.977 24.286 1.00 0.00 H new ATOM 0 HB THR A 97 13.326 1.895 26.418 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.545 0.228 27.895 1.00 0.00 H new ATOM 0 HG21 THR A 97 10.990 1.072 25.848 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.928 1.471 24.389 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.720 -0.228 24.876 1.00 0.00 H new ATOM 1386 N CYS A 98 16.845 0.552 25.267 1.00 0.00 N ATOM 1387 CA CYS A 98 18.181 1.039 25.598 1.00 0.00 C ATOM 1388 C CYS A 98 18.726 1.930 24.483 1.00 0.00 C ATOM 1389 O CYS A 98 18.296 1.850 23.331 1.00 0.00 O ATOM 1390 CB CYS A 98 19.135 -0.151 25.784 1.00 0.00 C ATOM 1391 SG CYS A 98 18.853 -1.168 27.254 1.00 0.00 S ATOM 0 H CYS A 98 16.853 -0.234 24.618 1.00 0.00 H new ATOM 0 HA CYS A 98 18.112 1.618 26.519 1.00 0.00 H new ATOM 0 HB2 CYS A 98 19.063 -0.790 24.904 1.00 0.00 H new ATOM 0 HB3 CYS A 98 20.156 0.229 25.819 1.00 0.00 H new ATOM 1396 N THR A 99 19.742 2.722 24.813 1.00 0.00 N ATOM 1397 CA THR A 99 20.545 3.470 23.860 1.00 0.00 C ATOM 1398 C THR A 99 21.985 3.115 24.229 1.00 0.00 C ATOM 1399 O THR A 99 22.326 3.117 25.413 1.00 0.00 O ATOM 1400 CB THR A 99 20.229 4.971 23.953 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.854 5.199 23.698 1.00 0.00 O ATOM 1402 CG2 THR A 99 21.037 5.798 22.946 1.00 0.00 C ATOM 0 H THR A 99 20.035 2.863 25.780 1.00 0.00 H new ATOM 0 HA THR A 99 20.345 3.220 22.818 1.00 0.00 H new ATOM 0 HB THR A 99 20.497 5.282 24.963 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.664 6.158 23.762 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.779 6.852 23.050 1.00 0.00 H new ATOM 0 HG22 THR A 99 22.102 5.665 23.137 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.806 5.466 21.934 1.00 0.00 H new ATOM 1410 N ILE A 100 22.812 2.734 23.256 1.00 0.00 N ATOM 1411 CA ILE A 100 24.149 2.205 23.512 1.00 0.00 C ATOM 1412 C ILE A 100 25.091 2.871 22.516 1.00 0.00 C ATOM 1413 O ILE A 100 24.801 2.900 21.319 1.00 0.00 O ATOM 1414 CB ILE A 100 24.172 0.656 23.402 1.00 0.00 C ATOM 1415 CG1 ILE A 100 23.006 -0.013 24.175 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.530 0.109 23.888 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.978 -1.545 24.119 1.00 0.00 C ATOM 0 H ILE A 100 22.572 2.784 22.266 1.00 0.00 H new ATOM 0 HA ILE A 100 24.469 2.429 24.530 1.00 0.00 H new ATOM 0 HB ILE A 100 24.037 0.405 22.350 1.00 0.00 H new ATOM 0 HG12 ILE A 100 23.060 0.295 25.219 1.00 0.00 H new ATOM 0 HG13 ILE A 100 22.064 0.366 23.779 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.535 -0.978 23.806 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.330 0.522 23.274 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.686 0.395 24.928 1.00 0.00 H new ATOM 0 HD11 ILE A 100 22.126 -1.914 24.690 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.889 -1.870 23.082 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.900 -1.942 24.545 1.00 0.00 H new ATOM 1429 N THR A 101 26.224 3.376 23.000 1.00 0.00 N ATOM 1430 CA THR A 101 27.236 4.021 22.179 1.00 0.00 C ATOM 1431 C THR A 101 28.582 3.404 22.556 1.00 0.00 C ATOM 1432 O THR A 101 28.952 3.429 23.729 1.00 0.00 O ATOM 1433 CB THR A 101 27.195 5.546 22.399 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.879 6.044 22.218 1.00 0.00 O ATOM 1435 CG2 THR A 101 28.108 6.290 21.418 1.00 0.00 C ATOM 0 H THR A 101 26.465 3.346 23.991 1.00 0.00 H new ATOM 0 HA THR A 101 27.059 3.863 21.115 1.00 0.00 H new ATOM 0 HB THR A 101 27.537 5.718 23.420 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.873 7.013 22.364 1.00 0.00 H new ATOM 0 HG21 THR A 101 28.049 7.362 21.608 1.00 0.00 H new ATOM 0 HG22 THR A 101 29.136 5.954 21.551 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.789 6.084 20.396 1.00 0.00 H new ATOM 1443 N ARG A 102 29.305 2.836 21.581 1.00 0.00 N ATOM 1444 CA ARG A 102 30.648 2.251 21.741 1.00 0.00 C ATOM 1445 C ARG A 102 30.795 1.384 23.009 1.00 0.00 C ATOM 1446 O ARG A 102 31.809 1.458 23.704 1.00 0.00 O ATOM 1447 CB ARG A 102 31.706 3.372 21.676 1.00 0.00 C ATOM 1448 CG ARG A 102 31.689 4.163 20.353 1.00 0.00 C ATOM 1449 CD ARG A 102 32.818 5.199 20.282 1.00 0.00 C ATOM 1450 NE ARG A 102 32.676 6.266 21.293 1.00 0.00 N ATOM 1451 CZ ARG A 102 33.568 7.237 21.530 1.00 0.00 C ATOM 1452 NH1 ARG A 102 34.697 7.307 20.828 1.00 0.00 N ATOM 1453 NH2 ARG A 102 33.326 8.139 22.475 1.00 0.00 N ATOM 0 H ARG A 102 28.960 2.768 20.624 1.00 0.00 H new ATOM 0 HA ARG A 102 30.809 1.559 20.914 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.543 4.062 22.504 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.695 2.935 21.815 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.781 3.470 19.516 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.729 4.667 20.245 1.00 0.00 H new ATOM 0 HD2 ARG A 102 33.776 4.697 20.421 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.834 5.646 19.288 1.00 0.00 H new ATOM 0 HE ARG A 102 31.827 6.263 21.859 1.00 0.00 H new ATOM 0 HH11 ARG A 102 34.890 6.617 20.102 1.00 0.00 H new ATOM 0 HH12 ARG A 102 35.369 8.050 21.016 1.00 0.00 H new ATOM 0 HH21 ARG A 102 32.463 8.091 23.017 1.00 0.00 H new ATOM 0 HH22 ARG A 102 34.003 8.880 22.658 1.00 0.00 H new ATOM 1467 N GLY A 103 29.789 0.563 23.328 1.00 0.00 N ATOM 1468 CA GLY A 103 29.851 -0.377 24.443 1.00 0.00 C ATOM 1469 C GLY A 103 29.458 0.246 25.784 1.00 0.00 C ATOM 1470 O GLY A 103 29.709 -0.365 26.822 1.00 0.00 O ATOM 0 H GLY A 103 28.907 0.535 22.816 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.192 -1.220 24.235 1.00 0.00 H new ATOM 0 HA3 GLY A 103 30.863 -0.774 24.518 1.00 0.00 H new ATOM 1474 N VAL A 104 28.842 1.431 25.788 1.00 0.00 N ATOM 1475 CA VAL A 104 28.353 2.101 26.987 1.00 0.00 C ATOM 1476 C VAL A 104 26.856 2.339 26.776 1.00 0.00 C ATOM 1477 O VAL A 104 26.464 3.105 25.893 1.00 0.00 O ATOM 1478 CB VAL A 104 29.154 3.402 27.238 1.00 0.00 C ATOM 1479 CG1 VAL A 104 28.733 4.062 28.560 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.671 3.148 27.288 1.00 0.00 C ATOM 0 H VAL A 104 28.667 1.961 24.934 1.00 0.00 H new ATOM 0 HA VAL A 104 28.494 1.498 27.884 1.00 0.00 H new ATOM 0 HB VAL A 104 28.931 4.062 26.400 1.00 0.00 H new ATOM 0 HG11 VAL A 104 29.311 4.974 28.712 1.00 0.00 H new ATOM 0 HG12 VAL A 104 27.672 4.307 28.522 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.917 3.374 29.385 1.00 0.00 H new ATOM 0 HG21 VAL A 104 31.192 4.089 27.466 1.00 0.00 H new ATOM 0 HG22 VAL A 104 30.897 2.450 28.094 1.00 0.00 H new ATOM 0 HG23 VAL A 104 31.001 2.725 26.339 1.00 0.00 H new ATOM 1490 N ALA A 105 26.015 1.633 27.541 1.00 0.00 N ATOM 1491 CA ALA A 105 24.579 1.885 27.575 1.00 0.00 C ATOM 1492 C ALA A 105 24.306 3.178 28.351 1.00 0.00 C ATOM 1493 O ALA A 105 25.052 3.521 29.274 1.00 0.00 O ATOM 1494 CB ALA A 105 23.856 0.701 28.226 1.00 0.00 C ATOM 0 H ALA A 105 26.315 0.873 28.151 1.00 0.00 H new ATOM 0 HA ALA A 105 24.204 1.999 26.558 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.784 0.897 28.248 1.00 0.00 H new ATOM 0 HB2 ALA A 105 24.048 -0.204 27.650 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.221 0.567 29.244 1.00 0.00 H new ATOM 1548 N ALA A 110 14.770 3.477 31.447 1.00 0.00 N ATOM 1549 CA ALA A 110 14.094 2.804 30.345 1.00 0.00 C ATOM 1550 C ALA A 110 14.916 1.619 29.828 1.00 0.00 C ATOM 1551 O ALA A 110 14.328 0.629 29.387 1.00 0.00 O ATOM 1552 CB ALA A 110 13.839 3.801 29.211 1.00 0.00 C ATOM 0 HA ALA A 110 13.143 2.417 30.712 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.334 3.295 28.388 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.213 4.615 29.576 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.789 4.204 28.860 1.00 0.00 H new ATOM 1558 N CYS A 111 16.249 1.685 29.894 1.00 0.00 N ATOM 1559 CA CYS A 111 17.097 0.613 29.402 1.00 0.00 C ATOM 1560 C CYS A 111 16.925 -0.607 30.305 1.00 0.00 C ATOM 1561 O CYS A 111 17.083 -0.510 31.526 1.00 0.00 O ATOM 1562 CB CYS A 111 18.557 1.080 29.347 1.00 0.00 C ATOM 1563 SG CYS A 111 19.757 -0.162 28.784 1.00 0.00 S ATOM 0 H CYS A 111 16.759 2.476 30.286 1.00 0.00 H new ATOM 0 HA CYS A 111 16.807 0.337 28.388 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.619 1.945 28.686 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.850 1.417 30.341 1.00 0.00 H new ATOM 1568 N LYS A 112 16.634 -1.760 29.701 1.00 0.00 N ATOM 1569 CA LYS A 112 16.509 -3.048 30.373 1.00 0.00 C ATOM 1570 C LYS A 112 17.312 -4.043 29.544 1.00 0.00 C ATOM 1571 O LYS A 112 17.162 -4.078 28.321 1.00 0.00 O ATOM 1572 CB LYS A 112 15.027 -3.455 30.445 1.00 0.00 C ATOM 1573 CG LYS A 112 14.202 -2.561 31.392 1.00 0.00 C ATOM 1574 CD LYS A 112 12.693 -2.853 31.318 1.00 0.00 C ATOM 1575 CE LYS A 112 12.058 -2.471 29.969 1.00 0.00 C ATOM 1576 NZ LYS A 112 12.029 -1.005 29.737 1.00 0.00 N ATOM 0 H LYS A 112 16.474 -1.822 28.696 1.00 0.00 H new ATOM 0 HA LYS A 112 16.883 -3.012 31.396 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.595 -3.412 29.445 1.00 0.00 H new ATOM 0 HB3 LYS A 112 14.956 -4.490 30.778 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.547 -2.707 32.416 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.378 -1.515 31.143 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.527 -3.915 31.501 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.186 -2.310 32.116 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.614 -2.950 29.163 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.041 -2.860 29.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.224 -0.808 28.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.091 -0.633 29.986 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.752 -0.546 30.327 1.00 0.00 H new ATOM 1590 N ILE A 113 18.171 -4.826 30.195 1.00 0.00 N ATOM 1591 CA ILE A 113 19.114 -5.725 29.548 1.00 0.00 C ATOM 1592 C ILE A 113 19.252 -6.997 30.387 1.00 0.00 C ATOM 1593 O ILE A 113 19.142 -6.942 31.616 1.00 0.00 O ATOM 1594 CB ILE A 113 20.445 -4.963 29.350 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.421 -5.776 28.478 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.127 -4.539 30.667 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.504 -4.916 27.812 1.00 0.00 C ATOM 0 H ILE A 113 18.229 -4.850 31.213 1.00 0.00 H new ATOM 0 HA ILE A 113 18.770 -6.043 28.564 1.00 0.00 H new ATOM 0 HB ILE A 113 20.179 -4.040 28.835 1.00 0.00 H new ATOM 0 HG12 ILE A 113 21.900 -6.537 29.094 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.857 -6.299 27.706 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.054 -4.011 30.443 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.461 -3.882 31.227 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.349 -5.424 31.263 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.156 -5.552 27.213 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.034 -4.172 27.170 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.092 -4.413 28.580 1.00 0.00 H new ATOM 1609 N SER A 114 19.490 -8.144 29.752 1.00 0.00 N ATOM 1610 CA SER A 114 19.826 -9.407 30.408 1.00 0.00 C ATOM 1611 C SER A 114 20.551 -10.315 29.409 1.00 0.00 C ATOM 1612 O SER A 114 20.279 -10.248 28.209 1.00 0.00 O ATOM 1613 CB SER A 114 18.543 -10.098 30.897 1.00 0.00 C ATOM 1614 OG SER A 114 17.910 -9.351 31.922 1.00 0.00 O ATOM 0 H SER A 114 19.453 -8.222 28.736 1.00 0.00 H new ATOM 0 HA SER A 114 20.473 -9.212 31.264 1.00 0.00 H new ATOM 0 HB2 SER A 114 17.856 -10.226 30.061 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.783 -11.095 31.267 1.00 0.00 H new ATOM 0 HG SER A 114 18.353 -8.482 32.015 1.00 0.00 H new ATOM 1620 N GLY A 115 21.443 -11.180 29.904 1.00 0.00 N ATOM 1621 CA GLY A 115 22.065 -12.254 29.130 1.00 0.00 C ATOM 1622 C GLY A 115 23.018 -11.780 28.030 1.00 0.00 C ATOM 1623 O GLY A 115 23.280 -12.547 27.101 1.00 0.00 O ATOM 0 H GLY A 115 21.757 -11.150 30.874 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.613 -12.904 29.812 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.280 -12.858 28.676 1.00 0.00 H new ATOM 1627 N CYS A 116 23.507 -10.536 28.100 1.00 0.00 N ATOM 1628 CA CYS A 116 24.286 -9.902 27.041 1.00 0.00 C ATOM 1629 C CYS A 116 25.746 -9.700 27.440 1.00 0.00 C ATOM 1630 O CYS A 116 26.093 -9.664 28.625 1.00 0.00 O ATOM 1631 CB CYS A 116 23.714 -8.506 26.748 1.00 0.00 C ATOM 1632 SG CYS A 116 21.999 -8.415 26.194 1.00 0.00 S ATOM 0 H CYS A 116 23.367 -9.934 28.912 1.00 0.00 H new ATOM 0 HA CYS A 116 24.231 -10.562 26.175 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.809 -7.906 27.653 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.339 -8.038 25.988 1.00 0.00 H new ATOM 1637 N SER A 117 26.560 -9.456 26.419 1.00 0.00 N ATOM 1638 CA SER A 117 27.938 -8.999 26.488 1.00 0.00 C ATOM 1639 C SER A 117 28.034 -7.914 25.411 1.00 0.00 C ATOM 1640 O SER A 117 27.431 -8.066 24.344 1.00 0.00 O ATOM 1641 CB SER A 117 28.903 -10.160 26.219 1.00 0.00 C ATOM 1642 OG SER A 117 28.793 -11.158 27.224 1.00 0.00 O ATOM 0 H SER A 117 26.250 -9.582 25.455 1.00 0.00 H new ATOM 0 HA SER A 117 28.210 -8.614 27.471 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.689 -10.596 25.243 1.00 0.00 H new ATOM 0 HB3 SER A 117 29.926 -9.786 26.184 1.00 0.00 H new ATOM 0 HG SER A 117 29.417 -11.888 27.029 1.00 0.00 H new ATOM 1648 N LEU A 118 28.722 -6.803 25.676 1.00 0.00 N ATOM 1649 CA LEU A 118 28.816 -5.694 24.728 1.00 0.00 C ATOM 1650 C LEU A 118 30.163 -4.984 24.832 1.00 0.00 C ATOM 1651 O LEU A 118 30.824 -5.036 25.873 1.00 0.00 O ATOM 1652 CB LEU A 118 27.611 -4.734 24.845 1.00 0.00 C ATOM 1653 CG LEU A 118 27.128 -4.313 26.250 1.00 0.00 C ATOM 1654 CD1 LEU A 118 28.176 -3.553 27.066 1.00 0.00 C ATOM 1655 CD2 LEU A 118 25.883 -3.430 26.106 1.00 0.00 C ATOM 0 H LEU A 118 29.227 -6.647 26.549 1.00 0.00 H new ATOM 0 HA LEU A 118 28.767 -6.110 23.722 1.00 0.00 H new ATOM 0 HB2 LEU A 118 27.858 -3.826 24.295 1.00 0.00 H new ATOM 0 HB3 LEU A 118 26.769 -5.198 24.332 1.00 0.00 H new ATOM 0 HG LEU A 118 26.914 -5.234 26.792 1.00 0.00 H new ATOM 0 HD11 LEU A 118 27.760 -3.293 28.039 1.00 0.00 H new ATOM 0 HD12 LEU A 118 29.056 -4.181 27.203 1.00 0.00 H new ATOM 0 HD13 LEU A 118 28.459 -2.643 26.537 1.00 0.00 H new ATOM 0 HD21 LEU A 118 25.535 -3.128 27.094 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.131 -2.544 25.522 1.00 0.00 H new ATOM 0 HD23 LEU A 118 25.097 -3.990 25.600 1.00 0.00 H new ATOM 1667 N SER A 119 30.558 -4.337 23.735 1.00 0.00 N ATOM 1668 CA SER A 119 31.880 -3.766 23.520 1.00 0.00 C ATOM 1669 C SER A 119 31.796 -2.628 22.497 1.00 0.00 C ATOM 1670 O SER A 119 30.757 -2.416 21.858 1.00 0.00 O ATOM 1671 CB SER A 119 32.816 -4.858 22.958 1.00 0.00 C ATOM 1672 OG SER A 119 32.871 -6.017 23.778 1.00 0.00 O ATOM 0 H SER A 119 29.935 -4.193 22.940 1.00 0.00 H new ATOM 0 HA SER A 119 32.262 -3.384 24.467 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.478 -5.141 21.961 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.820 -4.448 22.850 1.00 0.00 H new ATOM 0 HG SER A 119 33.475 -6.675 23.375 1.00 0.00 H new ATOM 1678 N ALA A 120 32.890 -1.881 22.334 1.00 0.00 N ATOM 1679 CA ALA A 120 33.016 -0.937 21.233 1.00 0.00 C ATOM 1680 C ALA A 120 33.140 -1.748 19.935 1.00 0.00 C ATOM 1681 O ALA A 120 33.682 -2.858 19.935 1.00 0.00 O ATOM 1682 CB ALA A 120 34.240 -0.039 21.440 1.00 0.00 C ATOM 0 H ALA A 120 33.700 -1.915 22.954 1.00 0.00 H new ATOM 0 HA ALA A 120 32.143 -0.287 21.182 1.00 0.00 H new ATOM 0 HB1 ALA A 120 34.322 0.662 20.609 1.00 0.00 H new ATOM 0 HB2 ALA A 120 34.131 0.515 22.373 1.00 0.00 H new ATOM 0 HB3 ALA A 120 35.139 -0.654 21.486 1.00 0.00 H new ATOM 1688 N MET A 121 32.634 -1.194 18.835 1.00 0.00 N ATOM 1689 CA MET A 121 32.741 -1.792 17.512 1.00 0.00 C ATOM 1690 C MET A 121 34.212 -1.848 17.102 1.00 0.00 C ATOM 1691 O MET A 121 34.678 -2.925 16.679 1.00 0.00 O ATOM 1692 CB MET A 121 31.895 -0.958 16.548 1.00 0.00 C ATOM 1693 CG MET A 121 31.807 -1.528 15.129 1.00 0.00 C ATOM 1694 SD MET A 121 30.870 -3.080 15.006 1.00 0.00 S ATOM 1695 CE MET A 121 30.573 -3.102 13.218 1.00 0.00 C ATOM 1696 OXT MET A 121 34.911 -0.817 17.216 1.00 0.00 O ATOM 0 H MET A 121 32.132 -0.306 18.841 1.00 0.00 H new ATOM 0 HA MET A 121 32.367 -2.816 17.500 1.00 0.00 H new ATOM 0 HB2 MET A 121 30.887 -0.867 16.953 1.00 0.00 H new ATOM 0 HB3 MET A 121 32.310 0.049 16.497 1.00 0.00 H new ATOM 0 HG2 MET A 121 31.344 -0.785 14.479 1.00 0.00 H new ATOM 0 HG3 MET A 121 32.817 -1.696 14.754 1.00 0.00 H new ATOM 0 HE1 MET A 121 30.082 -4.035 12.942 1.00 0.00 H new ATOM 0 HE2 MET A 121 29.934 -2.262 12.945 1.00 0.00 H new ATOM 0 HE3 MET A 121 31.523 -3.022 12.690 1.00 0.00 H new