USER MOD reduce.3.24.130724 H: found=0, std=0, add=981, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 982 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 110 LYS NZ :NH3+ -179:sc= 1.96 (180deg=1.14) USER MOD Set 1.2: A 116 GLN : amide:sc= 1.4 K(o=4,f=-2.4) USER MOD Set 1.3: A 120 THR OG1 : rot 180:sc= 0.683 USER MOD Set 2.1: A 37 HIS : no HE2:sc= 0.524 K(o=-0.12,f=-8.5!) USER MOD Set 2.2: A 65 ASN : amide:sc= -0.64 K(o=-0.12,f=-4.5!) USER MOD Set 3.1: A 21 HIS : no HE2:sc= 1.07 K(o=3.5,f=-5.4!) USER MOD Set 3.2: A 25 LYS NZ :NH3+ -169:sc= 2.46 (180deg=1.1) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot -140:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0.06 USER MOD Single : A 33 THR OG1 : rot -69:sc= 1.21 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot -160:sc= 0.999 USER MOD Single : A 55 SER OG : rot 71:sc= 0.442 USER MOD Single : A 56 THR OG1 : rot 58:sc= 1.22 USER MOD Single : A 57 HIS : no HD1:sc= -0.0215 X(o=-0.022,f=-0.0044) USER MOD Single : A 67 SER OG : rot 180:sc= -0.311 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 2.1 K(o=2.1,f=0) USER MOD Single : A 76 GLN : amide:sc= 0.743 K(o=0.74,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot -7:sc= 0.673 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 ASN : amide:sc= 1.08 K(o=1.1,f=-0.04) USER MOD Single : A 112 SER OG : rot 87:sc= 1.23 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 76:sc= 0.988 USER MOD Single : A 122 LYS NZ :NH3+ 172:sc= 1.2 (180deg=1.14) USER MOD Single : A 124 ASN : amide:sc= 1.05 K(o=1.1,f=-2.4) USER MOD Single : A 141 SER OG : rot 71:sc= 1.14 USER MOD Single : A 144 ASN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 147 LYS NZ :NH3+ -163:sc= 1.23 (180deg=0.798) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 5.732 0.247 0.848 1.00 0.00 N ATOM 21 CA ALA A 2 7.170 0.465 0.726 1.00 0.00 C ATOM 22 C ALA A 2 7.641 -0.091 -0.620 1.00 0.00 C ATOM 23 O ALA A 2 6.981 -0.952 -1.208 1.00 0.00 O ATOM 24 CB ALA A 2 7.905 -0.214 1.887 1.00 0.00 C ATOM 0 HA ALA A 2 7.391 1.532 0.769 1.00 0.00 H new ATOM 0 HB1 ALA A 2 8.977 -0.046 1.787 1.00 0.00 H new ATOM 0 HB2 ALA A 2 7.558 0.205 2.832 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.703 -1.285 1.869 1.00 0.00 H new ATOM 30 N ASP A 3 8.799 0.379 -1.078 1.00 0.00 N ATOM 31 CA ASP A 3 9.405 0.017 -2.361 1.00 0.00 C ATOM 32 C ASP A 3 10.909 -0.227 -2.214 1.00 0.00 C ATOM 33 O ASP A 3 11.470 -1.029 -2.960 1.00 0.00 O ATOM 34 CB ASP A 3 9.147 1.124 -3.389 1.00 0.00 C ATOM 35 CG ASP A 3 9.728 0.755 -4.763 1.00 0.00 C ATOM 36 OD1 ASP A 3 9.193 -0.170 -5.417 1.00 0.00 O ATOM 37 OD2 ASP A 3 10.680 1.424 -5.217 1.00 0.00 O ATOM 0 H ASP A 3 9.362 1.045 -0.549 1.00 0.00 H new ATOM 0 HA ASP A 3 8.947 -0.910 -2.706 1.00 0.00 H new ATOM 0 HB2 ASP A 3 8.075 1.297 -3.480 1.00 0.00 H new ATOM 0 HB3 ASP A 3 9.592 2.057 -3.042 1.00 0.00 H new ATOM 42 N ILE A 4 11.540 0.378 -1.201 1.00 0.00 N ATOM 43 CA ILE A 4 12.906 0.111 -0.775 1.00 0.00 C ATOM 44 C ILE A 4 12.819 -0.136 0.729 1.00 0.00 C ATOM 45 O ILE A 4 12.985 0.771 1.544 1.00 0.00 O ATOM 46 CB ILE A 4 13.884 1.245 -1.150 1.00 0.00 C ATOM 47 CG1 ILE A 4 13.793 1.618 -2.649 1.00 0.00 C ATOM 48 CG2 ILE A 4 15.315 0.788 -0.798 1.00 0.00 C ATOM 49 CD1 ILE A 4 14.717 2.771 -3.055 1.00 0.00 C ATOM 0 H ILE A 4 11.088 1.097 -0.636 1.00 0.00 H new ATOM 0 HA ILE A 4 13.321 -0.755 -1.290 1.00 0.00 H new ATOM 0 HB ILE A 4 13.618 2.139 -0.586 1.00 0.00 H new ATOM 0 HG12 ILE A 4 14.037 0.741 -3.248 1.00 0.00 H new ATOM 0 HG13 ILE A 4 12.764 1.889 -2.885 1.00 0.00 H new ATOM 0 HG21 ILE A 4 16.022 1.576 -1.056 1.00 0.00 H new ATOM 0 HG22 ILE A 4 15.378 0.579 0.270 1.00 0.00 H new ATOM 0 HG23 ILE A 4 15.557 -0.114 -1.359 1.00 0.00 H new ATOM 0 HD11 ILE A 4 14.598 2.975 -4.119 1.00 0.00 H new ATOM 0 HD12 ILE A 4 14.459 3.662 -2.483 1.00 0.00 H new ATOM 0 HD13 ILE A 4 15.752 2.497 -2.852 1.00 0.00 H new ATOM 61 N THR A 5 12.461 -1.357 1.103 1.00 0.00 N ATOM 62 CA THR A 5 12.398 -1.732 2.506 1.00 0.00 C ATOM 63 C THR A 5 13.838 -1.952 2.986 1.00 0.00 C ATOM 64 O THR A 5 14.551 -2.818 2.469 1.00 0.00 O ATOM 65 CB THR A 5 11.514 -2.973 2.647 1.00 0.00 C ATOM 66 OG1 THR A 5 10.181 -2.628 2.323 1.00 0.00 O ATOM 67 CG2 THR A 5 11.544 -3.583 4.048 1.00 0.00 C ATOM 0 H THR A 5 12.210 -2.103 0.454 1.00 0.00 H new ATOM 0 HA THR A 5 11.949 -0.958 3.128 1.00 0.00 H new ATOM 0 HB THR A 5 11.910 -3.725 1.964 1.00 0.00 H new ATOM 0 HG1 THR A 5 9.608 -3.419 2.409 1.00 0.00 H new ATOM 0 HG21 THR A 5 10.896 -4.459 4.077 1.00 0.00 H new ATOM 0 HG22 THR A 5 12.564 -3.878 4.295 1.00 0.00 H new ATOM 0 HG23 THR A 5 11.194 -2.848 4.773 1.00 0.00 H new ATOM 75 N LEU A 6 14.281 -1.154 3.956 1.00 0.00 N ATOM 76 CA LEU A 6 15.559 -1.355 4.628 1.00 0.00 C ATOM 77 C LEU A 6 15.423 -2.540 5.590 1.00 0.00 C ATOM 78 O LEU A 6 14.355 -2.779 6.162 1.00 0.00 O ATOM 79 CB LEU A 6 16.009 -0.093 5.396 1.00 0.00 C ATOM 80 CG LEU A 6 16.627 1.027 4.535 1.00 0.00 C ATOM 81 CD1 LEU A 6 15.675 1.605 3.481 1.00 0.00 C ATOM 82 CD2 LEU A 6 17.106 2.173 5.430 1.00 0.00 C ATOM 0 H LEU A 6 13.759 -0.347 4.298 1.00 0.00 H new ATOM 0 HA LEU A 6 16.321 -1.561 3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 6 15.148 0.314 5.926 1.00 0.00 H new ATOM 0 HB3 LEU A 6 16.737 -0.390 6.151 1.00 0.00 H new ATOM 0 HG LEU A 6 17.456 0.560 4.002 1.00 0.00 H new ATOM 0 HD11 LEU A 6 16.186 2.386 2.919 1.00 0.00 H new ATOM 0 HD12 LEU A 6 15.362 0.813 2.800 1.00 0.00 H new ATOM 0 HD13 LEU A 6 14.799 2.027 3.974 1.00 0.00 H new ATOM 0 HD21 LEU A 6 17.541 2.959 4.813 1.00 0.00 H new ATOM 0 HD22 LEU A 6 16.261 2.576 5.989 1.00 0.00 H new ATOM 0 HD23 LEU A 6 17.857 1.801 6.127 1.00 0.00 H new ATOM 94 N ILE A 7 16.530 -3.247 5.800 1.00 0.00 N ATOM 95 CA ILE A 7 16.659 -4.405 6.674 1.00 0.00 C ATOM 96 C ILE A 7 17.663 -3.974 7.746 1.00 0.00 C ATOM 97 O ILE A 7 18.877 -3.986 7.534 1.00 0.00 O ATOM 98 CB ILE A 7 17.055 -5.655 5.845 1.00 0.00 C ATOM 99 CG1 ILE A 7 15.885 -6.055 4.913 1.00 0.00 C ATOM 100 CG2 ILE A 7 17.478 -6.833 6.740 1.00 0.00 C ATOM 101 CD1 ILE A 7 16.183 -7.256 4.009 1.00 0.00 C ATOM 0 H ILE A 7 17.409 -3.013 5.338 1.00 0.00 H new ATOM 0 HA ILE A 7 15.733 -4.710 7.162 1.00 0.00 H new ATOM 0 HB ILE A 7 17.923 -5.398 5.238 1.00 0.00 H new ATOM 0 HG12 ILE A 7 15.011 -6.282 5.523 1.00 0.00 H new ATOM 0 HG13 ILE A 7 15.625 -5.200 4.288 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.746 -7.686 6.116 1.00 0.00 H new ATOM 0 HG22 ILE A 7 18.337 -6.541 7.344 1.00 0.00 H new ATOM 0 HG23 ILE A 7 16.651 -7.108 7.394 1.00 0.00 H new ATOM 0 HD11 ILE A 7 15.312 -7.470 3.389 1.00 0.00 H new ATOM 0 HD12 ILE A 7 17.036 -7.028 3.370 1.00 0.00 H new ATOM 0 HD13 ILE A 7 16.413 -8.126 4.624 1.00 0.00 H new ATOM 113 N SER A 8 17.125 -3.501 8.865 1.00 0.00 N ATOM 114 CA SER A 8 17.832 -2.840 9.944 1.00 0.00 C ATOM 115 C SER A 8 18.405 -3.867 10.932 1.00 0.00 C ATOM 116 O SER A 8 17.758 -4.255 11.914 1.00 0.00 O ATOM 117 CB SER A 8 16.859 -1.853 10.611 1.00 0.00 C ATOM 118 OG SER A 8 16.211 -1.036 9.640 1.00 0.00 O ATOM 0 H SER A 8 16.125 -3.576 9.049 1.00 0.00 H new ATOM 0 HA SER A 8 18.690 -2.286 9.562 1.00 0.00 H new ATOM 0 HB2 SER A 8 16.113 -2.404 11.183 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.401 -1.224 11.317 1.00 0.00 H new ATOM 0 HG SER A 8 16.142 -0.119 9.978 1.00 0.00 H new ATOM 124 N GLY A 9 19.633 -4.326 10.685 1.00 0.00 N ATOM 125 CA GLY A 9 20.426 -5.127 11.613 1.00 0.00 C ATOM 126 C GLY A 9 21.066 -4.182 12.626 1.00 0.00 C ATOM 127 O GLY A 9 22.290 -4.114 12.756 1.00 0.00 O ATOM 0 H GLY A 9 20.116 -4.144 9.805 1.00 0.00 H new ATOM 0 HA2 GLY A 9 19.796 -5.858 12.119 1.00 0.00 H new ATOM 0 HA3 GLY A 9 21.193 -5.685 11.075 1.00 0.00 H new ATOM 131 N SER A 10 20.234 -3.412 13.320 1.00 0.00 N ATOM 132 CA SER A 10 20.656 -2.286 14.128 1.00 0.00 C ATOM 133 C SER A 10 20.625 -2.546 15.634 1.00 0.00 C ATOM 134 O SER A 10 19.961 -1.833 16.387 1.00 0.00 O ATOM 135 CB SER A 10 19.825 -1.087 13.707 1.00 0.00 C ATOM 136 OG SER A 10 19.839 -0.947 12.291 1.00 0.00 O ATOM 0 H SER A 10 19.225 -3.562 13.333 1.00 0.00 H new ATOM 0 HA SER A 10 21.713 -2.092 13.943 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.800 -1.206 14.057 1.00 0.00 H new ATOM 0 HB3 SER A 10 20.218 -0.183 14.172 1.00 0.00 H new ATOM 0 HG SER A 10 19.298 -0.171 12.034 1.00 0.00 H new ATOM 182 N GLY A 14 22.595 3.069 16.726 1.00 0.00 N ATOM 183 CA GLY A 14 23.200 4.076 15.860 1.00 0.00 C ATOM 184 C GLY A 14 23.081 3.690 14.389 1.00 0.00 C ATOM 185 O GLY A 14 22.792 4.542 13.548 1.00 0.00 O ATOM 0 HA2 GLY A 14 22.716 5.038 16.025 1.00 0.00 H new ATOM 0 HA3 GLY A 14 24.251 4.199 16.122 1.00 0.00 H new ATOM 189 N ALA A 15 23.194 2.390 14.085 1.00 0.00 N ATOM 190 CA ALA A 15 22.944 1.867 12.748 1.00 0.00 C ATOM 191 C ALA A 15 21.501 2.168 12.326 1.00 0.00 C ATOM 192 O ALA A 15 21.235 2.373 11.143 1.00 0.00 O ATOM 193 CB ALA A 15 23.246 0.356 12.706 1.00 0.00 C ATOM 0 H ALA A 15 23.462 1.677 14.763 1.00 0.00 H new ATOM 0 HA ALA A 15 23.608 2.359 12.037 1.00 0.00 H new ATOM 0 HB1 ALA A 15 23.056 -0.025 11.703 1.00 0.00 H new ATOM 0 HB2 ALA A 15 24.291 0.186 12.967 1.00 0.00 H new ATOM 0 HB3 ALA A 15 22.605 -0.163 13.419 1.00 0.00 H new ATOM 199 N GLU A 16 20.571 2.249 13.286 1.00 0.00 N ATOM 200 CA GLU A 16 19.170 2.552 12.997 1.00 0.00 C ATOM 201 C GLU A 16 18.946 4.052 12.809 1.00 0.00 C ATOM 202 O GLU A 16 18.083 4.436 12.023 1.00 0.00 O ATOM 203 CB GLU A 16 18.232 2.002 14.087 1.00 0.00 C ATOM 204 CG GLU A 16 16.956 1.445 13.441 1.00 0.00 C ATOM 205 CD GLU A 16 16.047 0.752 14.469 1.00 0.00 C ATOM 206 OE1 GLU A 16 15.241 1.440 15.137 1.00 0.00 O ATOM 207 OE2 GLU A 16 16.125 -0.490 14.598 1.00 0.00 O ATOM 0 H GLU A 16 20.770 2.107 14.276 1.00 0.00 H new ATOM 0 HA GLU A 16 18.928 2.052 12.059 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.736 1.218 14.652 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.978 2.792 14.794 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.408 2.256 12.961 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.225 0.736 12.658 1.00 0.00 H new ATOM 214 N TYR A 17 19.724 4.913 13.471 1.00 0.00 N ATOM 215 CA TYR A 17 19.635 6.354 13.255 1.00 0.00 C ATOM 216 C TYR A 17 20.107 6.673 11.836 1.00 0.00 C ATOM 217 O TYR A 17 19.480 7.469 11.135 1.00 0.00 O ATOM 218 CB TYR A 17 20.462 7.122 14.301 1.00 0.00 C ATOM 219 CG TYR A 17 20.167 6.840 15.771 1.00 0.00 C ATOM 220 CD1 TYR A 17 18.906 6.376 16.205 1.00 0.00 C ATOM 221 CD2 TYR A 17 21.182 7.065 16.723 1.00 0.00 C ATOM 222 CE1 TYR A 17 18.675 6.105 17.566 1.00 0.00 C ATOM 223 CE2 TYR A 17 20.959 6.796 18.085 1.00 0.00 C ATOM 224 CZ TYR A 17 19.704 6.307 18.513 1.00 0.00 C ATOM 225 OH TYR A 17 19.501 6.043 19.835 1.00 0.00 O ATOM 0 H TYR A 17 20.422 4.634 14.161 1.00 0.00 H new ATOM 0 HA TYR A 17 18.599 6.673 13.370 1.00 0.00 H new ATOM 0 HB2 TYR A 17 21.516 6.908 14.121 1.00 0.00 H new ATOM 0 HB3 TYR A 17 20.319 8.189 14.127 1.00 0.00 H new ATOM 0 HD1 TYR A 17 18.113 6.228 15.487 1.00 0.00 H new ATOM 0 HD2 TYR A 17 22.140 7.448 16.403 1.00 0.00 H new ATOM 0 HE1 TYR A 17 17.710 5.742 17.887 1.00 0.00 H new ATOM 0 HE2 TYR A 17 21.747 6.963 18.804 1.00 0.00 H new ATOM 0 HH TYR A 17 20.319 6.240 20.337 1.00 0.00 H new ATOM 235 N VAL A 18 21.173 6.006 11.381 1.00 0.00 N ATOM 236 CA VAL A 18 21.623 6.123 10.000 1.00 0.00 C ATOM 237 C VAL A 18 20.569 5.527 9.056 1.00 0.00 C ATOM 238 O VAL A 18 20.261 6.154 8.045 1.00 0.00 O ATOM 239 CB VAL A 18 23.019 5.512 9.821 1.00 0.00 C ATOM 240 CG1 VAL A 18 23.502 5.613 8.366 1.00 0.00 C ATOM 241 CG2 VAL A 18 24.064 6.202 10.716 1.00 0.00 C ATOM 0 H VAL A 18 21.738 5.380 11.955 1.00 0.00 H new ATOM 0 HA VAL A 18 21.727 7.176 9.737 1.00 0.00 H new ATOM 0 HB VAL A 18 22.923 4.465 10.107 1.00 0.00 H new ATOM 0 HG11 VAL A 18 24.494 5.170 8.280 1.00 0.00 H new ATOM 0 HG12 VAL A 18 22.809 5.080 7.715 1.00 0.00 H new ATOM 0 HG13 VAL A 18 23.546 6.661 8.069 1.00 0.00 H new ATOM 0 HG21 VAL A 18 25.039 5.740 10.560 1.00 0.00 H new ATOM 0 HG22 VAL A 18 24.119 7.260 10.462 1.00 0.00 H new ATOM 0 HG23 VAL A 18 23.775 6.095 11.762 1.00 0.00 H new ATOM 251 N ALA A 19 19.967 4.373 9.381 1.00 0.00 N ATOM 252 CA ALA A 19 18.909 3.791 8.558 1.00 0.00 C ATOM 253 C ALA A 19 17.732 4.761 8.403 1.00 0.00 C ATOM 254 O ALA A 19 17.208 4.911 7.303 1.00 0.00 O ATOM 255 CB ALA A 19 18.440 2.455 9.145 1.00 0.00 C ATOM 0 H ALA A 19 20.199 3.827 10.211 1.00 0.00 H new ATOM 0 HA ALA A 19 19.320 3.604 7.566 1.00 0.00 H new ATOM 0 HB1 ALA A 19 17.652 2.038 8.517 1.00 0.00 H new ATOM 0 HB2 ALA A 19 19.279 1.760 9.184 1.00 0.00 H new ATOM 0 HB3 ALA A 19 18.055 2.615 10.152 1.00 0.00 H new ATOM 261 N GLU A 20 17.333 5.447 9.476 1.00 0.00 N ATOM 262 CA GLU A 20 16.252 6.423 9.442 1.00 0.00 C ATOM 263 C GLU A 20 16.629 7.617 8.557 1.00 0.00 C ATOM 264 O GLU A 20 15.812 8.054 7.748 1.00 0.00 O ATOM 265 CB GLU A 20 15.910 6.852 10.879 1.00 0.00 C ATOM 266 CG GLU A 20 14.689 7.779 10.933 1.00 0.00 C ATOM 267 CD GLU A 20 14.306 8.123 12.384 1.00 0.00 C ATOM 268 OE1 GLU A 20 14.823 9.120 12.936 1.00 0.00 O ATOM 269 OE2 GLU A 20 13.463 7.415 12.980 1.00 0.00 O ATOM 0 H GLU A 20 17.757 5.337 10.397 1.00 0.00 H new ATOM 0 HA GLU A 20 15.363 5.973 9.000 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.718 5.966 11.485 1.00 0.00 H new ATOM 0 HB3 GLU A 20 16.769 7.359 11.319 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.903 8.696 10.385 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.845 7.300 10.436 1.00 0.00 H new ATOM 276 N HIS A 21 17.864 8.122 8.661 1.00 0.00 N ATOM 277 CA HIS A 21 18.349 9.210 7.817 1.00 0.00 C ATOM 278 C HIS A 21 18.333 8.803 6.337 1.00 0.00 C ATOM 279 O HIS A 21 17.828 9.547 5.494 1.00 0.00 O ATOM 280 CB HIS A 21 19.758 9.620 8.271 1.00 0.00 C ATOM 281 CG HIS A 21 20.432 10.590 7.333 1.00 0.00 C ATOM 282 ND1 HIS A 21 21.429 10.287 6.431 1.00 0.00 N ATOM 283 CD2 HIS A 21 20.143 11.920 7.186 1.00 0.00 C ATOM 284 CE1 HIS A 21 21.735 11.410 5.760 1.00 0.00 C ATOM 285 NE2 HIS A 21 20.972 12.438 6.182 1.00 0.00 N ATOM 0 H HIS A 21 18.552 7.785 9.334 1.00 0.00 H new ATOM 0 HA HIS A 21 17.685 10.068 7.921 1.00 0.00 H new ATOM 0 HB2 HIS A 21 19.696 10.069 9.262 1.00 0.00 H new ATOM 0 HB3 HIS A 21 20.376 8.727 8.364 1.00 0.00 H new ATOM 0 HD1 HIS A 21 21.859 9.372 6.297 1.00 0.00 H new ATOM 0 HD2 HIS A 21 19.404 12.474 7.746 1.00 0.00 H new ATOM 0 HE1 HIS A 21 22.488 11.479 4.989 1.00 0.00 H new ATOM 293 N LEU A 22 18.850 7.611 6.023 1.00 0.00 N ATOM 294 CA LEU A 22 18.871 7.073 4.666 1.00 0.00 C ATOM 295 C LEU A 22 17.437 6.963 4.141 1.00 0.00 C ATOM 296 O LEU A 22 17.152 7.408 3.030 1.00 0.00 O ATOM 297 CB LEU A 22 19.532 5.685 4.658 1.00 0.00 C ATOM 298 CG LEU A 22 21.059 5.701 4.857 1.00 0.00 C ATOM 299 CD1 LEU A 22 21.526 4.285 5.199 1.00 0.00 C ATOM 300 CD2 LEU A 22 21.798 6.183 3.603 1.00 0.00 C ATOM 0 H LEU A 22 19.269 6.989 6.714 1.00 0.00 H new ATOM 0 HA LEU A 22 19.446 7.741 4.025 1.00 0.00 H new ATOM 0 HB2 LEU A 22 19.083 5.079 5.444 1.00 0.00 H new ATOM 0 HB3 LEU A 22 19.307 5.196 3.710 1.00 0.00 H new ATOM 0 HG LEU A 22 21.287 6.396 5.665 1.00 0.00 H new ATOM 0 HD11 LEU A 22 22.607 4.283 5.342 1.00 0.00 H new ATOM 0 HD12 LEU A 22 21.038 3.952 6.115 1.00 0.00 H new ATOM 0 HD13 LEU A 22 21.267 3.610 4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 22 22.872 6.178 3.789 1.00 0.00 H new ATOM 0 HD22 LEU A 22 21.571 5.519 2.769 1.00 0.00 H new ATOM 0 HD23 LEU A 22 21.477 7.195 3.358 1.00 0.00 H new ATOM 312 N ALA A 23 16.531 6.396 4.945 1.00 0.00 N ATOM 313 CA ALA A 23 15.135 6.215 4.582 1.00 0.00 C ATOM 314 C ALA A 23 14.467 7.562 4.304 1.00 0.00 C ATOM 315 O ALA A 23 13.798 7.708 3.286 1.00 0.00 O ATOM 316 CB ALA A 23 14.399 5.457 5.691 1.00 0.00 C ATOM 0 H ALA A 23 16.757 6.048 5.877 1.00 0.00 H new ATOM 0 HA ALA A 23 15.085 5.625 3.667 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.354 5.326 5.410 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.862 4.480 5.833 1.00 0.00 H new ATOM 0 HB3 ALA A 23 14.457 6.024 6.620 1.00 0.00 H new ATOM 322 N GLU A 24 14.681 8.565 5.158 1.00 0.00 N ATOM 323 CA GLU A 24 14.119 9.898 4.970 1.00 0.00 C ATOM 324 C GLU A 24 14.585 10.492 3.636 1.00 0.00 C ATOM 325 O GLU A 24 13.786 11.081 2.906 1.00 0.00 O ATOM 326 CB GLU A 24 14.516 10.785 6.163 1.00 0.00 C ATOM 327 CG GLU A 24 13.906 12.196 6.125 1.00 0.00 C ATOM 328 CD GLU A 24 12.363 12.224 6.150 1.00 0.00 C ATOM 329 OE1 GLU A 24 11.730 11.381 6.825 1.00 0.00 O ATOM 330 OE2 GLU A 24 11.766 13.132 5.530 1.00 0.00 O ATOM 0 H GLU A 24 15.250 8.473 5.999 1.00 0.00 H new ATOM 0 HA GLU A 24 13.031 9.840 4.931 1.00 0.00 H new ATOM 0 HB2 GLU A 24 14.210 10.293 7.086 1.00 0.00 H new ATOM 0 HB3 GLU A 24 15.602 10.871 6.193 1.00 0.00 H new ATOM 0 HG2 GLU A 24 14.281 12.764 6.976 1.00 0.00 H new ATOM 0 HG3 GLU A 24 14.252 12.704 5.225 1.00 0.00 H new ATOM 337 N LYS A 25 15.861 10.316 3.276 1.00 0.00 N ATOM 338 CA LYS A 25 16.365 10.841 2.008 1.00 0.00 C ATOM 339 C LYS A 25 15.811 10.048 0.829 1.00 0.00 C ATOM 340 O LYS A 25 15.586 10.648 -0.220 1.00 0.00 O ATOM 341 CB LYS A 25 17.903 10.929 2.020 1.00 0.00 C ATOM 342 CG LYS A 25 18.404 12.305 2.506 1.00 0.00 C ATOM 343 CD LYS A 25 17.879 12.713 3.895 1.00 0.00 C ATOM 344 CE LYS A 25 18.207 14.161 4.286 1.00 0.00 C ATOM 345 NZ LYS A 25 19.654 14.415 4.461 1.00 0.00 N ATOM 0 H LYS A 25 16.553 9.821 3.838 1.00 0.00 H new ATOM 0 HA LYS A 25 16.004 11.862 1.881 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.305 10.149 2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.284 10.739 1.017 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.494 12.295 2.530 1.00 0.00 H new ATOM 0 HG3 LYS A 25 18.109 13.064 1.781 1.00 0.00 H new ATOM 0 HD2 LYS A 25 16.798 12.577 3.918 1.00 0.00 H new ATOM 0 HD3 LYS A 25 18.300 12.041 4.643 1.00 0.00 H new ATOM 0 HE2 LYS A 25 17.819 14.832 3.520 1.00 0.00 H new ATOM 0 HE3 LYS A 25 17.689 14.404 5.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.792 15.347 4.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 20.064 13.680 5.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 20.124 14.397 3.534 1.00 0.00 H new ATOM 359 N LEU A 26 15.525 8.751 0.974 1.00 0.00 N ATOM 360 CA LEU A 26 14.814 8.014 -0.064 1.00 0.00 C ATOM 361 C LEU A 26 13.386 8.523 -0.237 1.00 0.00 C ATOM 362 O LEU A 26 12.936 8.647 -1.376 1.00 0.00 O ATOM 363 CB LEU A 26 14.780 6.511 0.235 1.00 0.00 C ATOM 364 CG LEU A 26 16.119 5.796 0.031 1.00 0.00 C ATOM 365 CD1 LEU A 26 16.005 4.340 0.491 1.00 0.00 C ATOM 366 CD2 LEU A 26 16.572 5.851 -1.435 1.00 0.00 C ATOM 0 H LEU A 26 15.774 8.197 1.794 1.00 0.00 H new ATOM 0 HA LEU A 26 15.363 8.179 -0.991 1.00 0.00 H new ATOM 0 HB2 LEU A 26 14.457 6.365 1.266 1.00 0.00 H new ATOM 0 HB3 LEU A 26 14.031 6.043 -0.403 1.00 0.00 H new ATOM 0 HG LEU A 26 16.870 6.311 0.630 1.00 0.00 H new ATOM 0 HD11 LEU A 26 16.960 3.836 0.344 1.00 0.00 H new ATOM 0 HD12 LEU A 26 15.739 4.312 1.548 1.00 0.00 H new ATOM 0 HD13 LEU A 26 15.234 3.834 -0.091 1.00 0.00 H new ATOM 0 HD21 LEU A 26 17.525 5.334 -1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 26 15.825 5.368 -2.065 1.00 0.00 H new ATOM 0 HD23 LEU A 26 16.688 6.891 -1.741 1.00 0.00 H new ATOM 378 N GLU A 27 12.681 8.850 0.851 1.00 0.00 N ATOM 379 CA GLU A 27 11.331 9.402 0.766 1.00 0.00 C ATOM 380 C GLU A 27 11.369 10.716 -0.023 1.00 0.00 C ATOM 381 O GLU A 27 10.548 10.919 -0.918 1.00 0.00 O ATOM 382 CB GLU A 27 10.721 9.631 2.161 1.00 0.00 C ATOM 383 CG GLU A 27 10.403 8.351 2.951 1.00 0.00 C ATOM 384 CD GLU A 27 9.291 7.469 2.355 1.00 0.00 C ATOM 385 OE1 GLU A 27 8.397 7.974 1.638 1.00 0.00 O ATOM 386 OE2 GLU A 27 9.283 6.255 2.669 1.00 0.00 O ATOM 0 H GLU A 27 13.028 8.740 1.804 1.00 0.00 H new ATOM 0 HA GLU A 27 10.697 8.681 0.250 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.410 10.239 2.747 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.803 10.208 2.049 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.313 7.756 3.029 1.00 0.00 H new ATOM 0 HG3 GLU A 27 10.118 8.631 3.965 1.00 0.00 H new ATOM 393 N GLU A 28 12.354 11.579 0.254 1.00 0.00 N ATOM 394 CA GLU A 28 12.545 12.834 -0.469 1.00 0.00 C ATOM 395 C GLU A 28 12.918 12.581 -1.938 1.00 0.00 C ATOM 396 O GLU A 28 12.444 13.300 -2.821 1.00 0.00 O ATOM 397 CB GLU A 28 13.625 13.684 0.224 1.00 0.00 C ATOM 398 CG GLU A 28 13.170 14.285 1.563 1.00 0.00 C ATOM 399 CD GLU A 28 12.119 15.396 1.379 1.00 0.00 C ATOM 400 OE1 GLU A 28 12.501 16.568 1.155 1.00 0.00 O ATOM 401 OE2 GLU A 28 10.901 15.122 1.472 1.00 0.00 O ATOM 0 H GLU A 28 13.042 11.422 0.990 1.00 0.00 H new ATOM 0 HA GLU A 28 11.602 13.380 -0.456 1.00 0.00 H new ATOM 0 HB2 GLU A 28 14.508 13.067 0.393 1.00 0.00 H new ATOM 0 HB3 GLU A 28 13.924 14.492 -0.444 1.00 0.00 H new ATOM 0 HG2 GLU A 28 12.755 13.496 2.190 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.034 14.690 2.089 1.00 0.00 H new ATOM 408 N ALA A 29 13.734 11.557 -2.217 1.00 0.00 N ATOM 409 CA ALA A 29 14.116 11.170 -3.573 1.00 0.00 C ATOM 410 C ALA A 29 12.937 10.581 -4.365 1.00 0.00 C ATOM 411 O ALA A 29 12.973 10.596 -5.596 1.00 0.00 O ATOM 412 CB ALA A 29 15.284 10.177 -3.523 1.00 0.00 C ATOM 0 H ALA A 29 14.151 10.969 -1.495 1.00 0.00 H new ATOM 0 HA ALA A 29 14.430 12.072 -4.098 1.00 0.00 H new ATOM 0 HB1 ALA A 29 15.564 9.893 -4.537 1.00 0.00 H new ATOM 0 HB2 ALA A 29 16.137 10.643 -3.029 1.00 0.00 H new ATOM 0 HB3 ALA A 29 14.983 9.289 -2.967 1.00 0.00 H new ATOM 418 N GLY A 30 11.898 10.086 -3.683 1.00 0.00 N ATOM 419 CA GLY A 30 10.647 9.653 -4.294 1.00 0.00 C ATOM 420 C GLY A 30 10.430 8.140 -4.226 1.00 0.00 C ATOM 421 O GLY A 30 9.765 7.594 -5.108 1.00 0.00 O ATOM 0 H GLY A 30 11.909 9.975 -2.669 1.00 0.00 H new ATOM 0 HA2 GLY A 30 9.816 10.155 -3.798 1.00 0.00 H new ATOM 0 HA3 GLY A 30 10.632 9.968 -5.337 1.00 0.00 H new ATOM 425 N PHE A 31 10.978 7.455 -3.216 1.00 0.00 N ATOM 426 CA PHE A 31 10.850 6.010 -3.037 1.00 0.00 C ATOM 427 C PHE A 31 10.323 5.755 -1.626 1.00 0.00 C ATOM 428 O PHE A 31 10.864 6.300 -0.662 1.00 0.00 O ATOM 429 CB PHE A 31 12.211 5.326 -3.229 1.00 0.00 C ATOM 430 CG PHE A 31 12.894 5.587 -4.561 1.00 0.00 C ATOM 431 CD1 PHE A 31 13.760 6.687 -4.704 1.00 0.00 C ATOM 432 CD2 PHE A 31 12.684 4.721 -5.652 1.00 0.00 C ATOM 433 CE1 PHE A 31 14.407 6.927 -5.929 1.00 0.00 C ATOM 434 CE2 PHE A 31 13.340 4.953 -6.875 1.00 0.00 C ATOM 435 CZ PHE A 31 14.201 6.056 -7.015 1.00 0.00 C ATOM 0 H PHE A 31 11.534 7.902 -2.487 1.00 0.00 H new ATOM 0 HA PHE A 31 10.162 5.599 -3.776 1.00 0.00 H new ATOM 0 HB2 PHE A 31 12.877 5.651 -2.430 1.00 0.00 H new ATOM 0 HB3 PHE A 31 12.077 4.250 -3.114 1.00 0.00 H new ATOM 0 HD1 PHE A 31 13.928 7.350 -3.868 1.00 0.00 H new ATOM 0 HD2 PHE A 31 12.018 3.877 -5.550 1.00 0.00 H new ATOM 0 HE1 PHE A 31 15.062 7.779 -6.036 1.00 0.00 H new ATOM 0 HE2 PHE A 31 13.182 4.283 -7.707 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.703 6.234 -7.954 1.00 0.00 H new ATOM 445 N THR A 32 9.268 4.951 -1.492 1.00 0.00 N ATOM 446 CA THR A 32 8.718 4.608 -0.190 1.00 0.00 C ATOM 447 C THR A 32 9.624 3.588 0.504 1.00 0.00 C ATOM 448 O THR A 32 10.225 2.726 -0.145 1.00 0.00 O ATOM 449 CB THR A 32 7.284 4.083 -0.347 1.00 0.00 C ATOM 450 OG1 THR A 32 7.191 3.202 -1.454 1.00 0.00 O ATOM 451 CG2 THR A 32 6.302 5.236 -0.575 1.00 0.00 C ATOM 0 H THR A 32 8.778 4.525 -2.278 1.00 0.00 H new ATOM 0 HA THR A 32 8.677 5.499 0.437 1.00 0.00 H new ATOM 0 HB THR A 32 7.031 3.556 0.573 1.00 0.00 H new ATOM 0 HG1 THR A 32 6.270 2.877 -1.537 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.293 4.838 -0.683 1.00 0.00 H new ATOM 0 HG22 THR A 32 6.335 5.916 0.277 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.578 5.776 -1.481 1.00 0.00 H new ATOM 459 N THR A 33 9.688 3.642 1.831 1.00 0.00 N ATOM 460 CA THR A 33 10.631 2.872 2.622 1.00 0.00 C ATOM 461 C THR A 33 9.945 2.208 3.818 1.00 0.00 C ATOM 462 O THR A 33 8.790 2.497 4.148 1.00 0.00 O ATOM 463 CB THR A 33 11.767 3.796 3.095 1.00 0.00 C ATOM 464 OG1 THR A 33 11.283 4.927 3.795 1.00 0.00 O ATOM 465 CG2 THR A 33 12.650 4.264 1.943 1.00 0.00 C ATOM 0 H THR A 33 9.074 4.233 2.392 1.00 0.00 H new ATOM 0 HA THR A 33 11.042 2.076 2.001 1.00 0.00 H new ATOM 0 HB THR A 33 12.367 3.191 3.775 1.00 0.00 H new ATOM 0 HG1 THR A 33 10.810 5.519 3.173 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.436 4.913 2.328 1.00 0.00 H new ATOM 0 HG22 THR A 33 13.100 3.399 1.455 1.00 0.00 H new ATOM 0 HG23 THR A 33 12.046 4.814 1.222 1.00 0.00 H new ATOM 473 N GLU A 34 10.683 1.321 4.481 1.00 0.00 N ATOM 474 CA GLU A 34 10.359 0.710 5.761 1.00 0.00 C ATOM 475 C GLU A 34 11.727 0.378 6.374 1.00 0.00 C ATOM 476 O GLU A 34 12.717 0.347 5.645 1.00 0.00 O ATOM 477 CB GLU A 34 9.461 -0.520 5.520 1.00 0.00 C ATOM 478 CG GLU A 34 9.138 -1.367 6.761 1.00 0.00 C ATOM 479 CD GLU A 34 8.434 -0.555 7.860 1.00 0.00 C ATOM 480 OE1 GLU A 34 9.134 0.087 8.674 1.00 0.00 O ATOM 481 OE2 GLU A 34 7.183 -0.562 7.926 1.00 0.00 O ATOM 0 H GLU A 34 11.576 0.992 4.114 1.00 0.00 H new ATOM 0 HA GLU A 34 9.791 1.345 6.441 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.523 -0.181 5.081 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.945 -1.160 4.782 1.00 0.00 H new ATOM 0 HG2 GLU A 34 8.504 -2.205 6.470 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.061 -1.788 7.160 1.00 0.00 H new ATOM 488 N THR A 35 11.817 0.143 7.677 1.00 0.00 N ATOM 489 CA THR A 35 13.047 -0.139 8.395 1.00 0.00 C ATOM 490 C THR A 35 12.762 -1.358 9.270 1.00 0.00 C ATOM 491 O THR A 35 12.416 -1.229 10.448 1.00 0.00 O ATOM 492 CB THR A 35 13.492 1.115 9.177 1.00 0.00 C ATOM 493 OG1 THR A 35 12.405 1.910 9.633 1.00 0.00 O ATOM 494 CG2 THR A 35 14.392 2.018 8.326 1.00 0.00 C ATOM 0 H THR A 35 10.998 0.145 8.285 1.00 0.00 H new ATOM 0 HA THR A 35 13.884 -0.373 7.738 1.00 0.00 H new ATOM 0 HB THR A 35 14.033 0.725 10.039 1.00 0.00 H new ATOM 0 HG1 THR A 35 12.750 2.687 10.121 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.686 2.891 8.908 1.00 0.00 H new ATOM 0 HG22 THR A 35 15.282 1.465 8.026 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.848 2.341 7.438 1.00 0.00 H new ATOM 502 N LEU A 36 12.774 -2.547 8.655 1.00 0.00 N ATOM 503 CA LEU A 36 12.436 -3.785 9.344 1.00 0.00 C ATOM 504 C LEU A 36 13.555 -4.078 10.328 1.00 0.00 C ATOM 505 O LEU A 36 14.680 -4.353 9.918 1.00 0.00 O ATOM 506 CB LEU A 36 12.273 -4.962 8.370 1.00 0.00 C ATOM 507 CG LEU A 36 11.023 -4.882 7.481 1.00 0.00 C ATOM 508 CD1 LEU A 36 11.040 -6.047 6.482 1.00 0.00 C ATOM 509 CD2 LEU A 36 9.711 -4.922 8.276 1.00 0.00 C ATOM 0 H LEU A 36 13.017 -2.671 7.672 1.00 0.00 H new ATOM 0 HA LEU A 36 11.480 -3.664 9.853 1.00 0.00 H new ATOM 0 HB2 LEU A 36 13.155 -5.014 7.732 1.00 0.00 H new ATOM 0 HB3 LEU A 36 12.238 -5.889 8.942 1.00 0.00 H new ATOM 0 HG LEU A 36 11.058 -3.920 6.969 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.155 -5.996 5.848 1.00 0.00 H new ATOM 0 HD12 LEU A 36 11.934 -5.982 5.862 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.043 -6.992 7.025 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.867 -4.862 7.589 1.00 0.00 H new ATOM 0 HD22 LEU A 36 9.655 -5.854 8.839 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.678 -4.079 8.966 1.00 0.00 H new ATOM 521 N HIS A 37 13.246 -4.019 11.619 1.00 0.00 N ATOM 522 CA HIS A 37 14.194 -4.368 12.663 1.00 0.00 C ATOM 523 C HIS A 37 14.355 -5.891 12.672 1.00 0.00 C ATOM 524 O HIS A 37 13.461 -6.606 13.128 1.00 0.00 O ATOM 525 CB HIS A 37 13.729 -3.810 14.017 1.00 0.00 C ATOM 526 CG HIS A 37 14.757 -4.003 15.102 1.00 0.00 C ATOM 527 ND1 HIS A 37 15.749 -3.115 15.452 1.00 0.00 N ATOM 528 CD2 HIS A 37 14.905 -5.108 15.898 1.00 0.00 C ATOM 529 CE1 HIS A 37 16.474 -3.664 16.438 1.00 0.00 C ATOM 530 NE2 HIS A 37 16.013 -4.896 16.729 1.00 0.00 N ATOM 0 H HIS A 37 12.333 -3.728 11.967 1.00 0.00 H new ATOM 0 HA HIS A 37 15.169 -3.920 12.470 1.00 0.00 H new ATOM 0 HB2 HIS A 37 13.510 -2.747 13.913 1.00 0.00 H new ATOM 0 HB3 HIS A 37 12.800 -4.300 14.309 1.00 0.00 H new ATOM 0 HD1 HIS A 37 15.906 -2.198 15.034 1.00 0.00 H new ATOM 0 HD2 HIS A 37 14.278 -5.987 15.887 1.00 0.00 H new ATOM 0 HE1 HIS A 37 17.309 -3.186 16.929 1.00 0.00 H new ATOM 538 N GLY A 38 15.494 -6.381 12.176 1.00 0.00 N ATOM 539 CA GLY A 38 15.881 -7.787 12.248 1.00 0.00 C ATOM 540 C GLY A 38 14.837 -8.792 11.724 1.00 0.00 C ATOM 541 O GLY A 38 14.436 -9.678 12.485 1.00 0.00 O ATOM 0 H GLY A 38 16.185 -5.797 11.704 1.00 0.00 H new ATOM 0 HA2 GLY A 38 16.804 -7.921 11.683 1.00 0.00 H new ATOM 0 HA3 GLY A 38 16.105 -8.031 13.286 1.00 0.00 H new ATOM 545 N PRO A 39 14.357 -8.675 10.470 1.00 0.00 N ATOM 546 CA PRO A 39 13.450 -9.648 9.868 1.00 0.00 C ATOM 547 C PRO A 39 14.154 -10.990 9.594 1.00 0.00 C ATOM 548 O PRO A 39 15.371 -11.126 9.747 1.00 0.00 O ATOM 549 CB PRO A 39 12.965 -8.989 8.570 1.00 0.00 C ATOM 550 CG PRO A 39 14.173 -8.155 8.155 1.00 0.00 C ATOM 551 CD PRO A 39 14.703 -7.654 9.497 1.00 0.00 C ATOM 0 HA PRO A 39 12.621 -9.892 10.533 1.00 0.00 H new ATOM 0 HB2 PRO A 39 12.702 -9.728 7.813 1.00 0.00 H new ATOM 0 HB3 PRO A 39 12.082 -8.372 8.733 1.00 0.00 H new ATOM 0 HG2 PRO A 39 14.914 -8.751 7.622 1.00 0.00 H new ATOM 0 HG3 PRO A 39 13.892 -7.333 7.497 1.00 0.00 H new ATOM 0 HD2 PRO A 39 15.782 -7.501 9.458 1.00 0.00 H new ATOM 0 HD3 PRO A 39 14.255 -6.696 9.760 1.00 0.00 H new ATOM 559 N LEU A 40 13.375 -11.971 9.133 1.00 0.00 N ATOM 560 CA LEU A 40 13.815 -13.306 8.745 1.00 0.00 C ATOM 561 C LEU A 40 13.236 -13.675 7.382 1.00 0.00 C ATOM 562 O LEU A 40 12.355 -12.992 6.864 1.00 0.00 O ATOM 563 CB LEU A 40 13.350 -14.318 9.813 1.00 0.00 C ATOM 564 CG LEU A 40 14.388 -14.513 10.924 1.00 0.00 C ATOM 565 CD1 LEU A 40 13.775 -15.305 12.083 1.00 0.00 C ATOM 566 CD2 LEU A 40 15.612 -15.270 10.384 1.00 0.00 C ATOM 0 H LEU A 40 12.370 -11.846 9.016 1.00 0.00 H new ATOM 0 HA LEU A 40 14.902 -13.326 8.673 1.00 0.00 H new ATOM 0 HB2 LEU A 40 12.413 -13.975 10.251 1.00 0.00 H new ATOM 0 HB3 LEU A 40 13.147 -15.277 9.337 1.00 0.00 H new ATOM 0 HG LEU A 40 14.701 -13.531 11.279 1.00 0.00 H new ATOM 0 HD11 LEU A 40 14.520 -15.438 12.867 1.00 0.00 H new ATOM 0 HD12 LEU A 40 12.920 -14.760 12.484 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.448 -16.281 11.724 1.00 0.00 H new ATOM 0 HD21 LEU A 40 16.341 -15.401 11.184 1.00 0.00 H new ATOM 0 HD22 LEU A 40 15.301 -16.246 10.013 1.00 0.00 H new ATOM 0 HD23 LEU A 40 16.063 -14.700 9.572 1.00 0.00 H new ATOM 578 N LEU A 41 13.708 -14.798 6.831 1.00 0.00 N ATOM 579 CA LEU A 41 13.273 -15.383 5.567 1.00 0.00 C ATOM 580 C LEU A 41 11.749 -15.549 5.509 1.00 0.00 C ATOM 581 O LEU A 41 11.138 -15.274 4.480 1.00 0.00 O ATOM 582 CB LEU A 41 14.039 -16.714 5.440 1.00 0.00 C ATOM 583 CG LEU A 41 13.854 -17.558 4.170 1.00 0.00 C ATOM 584 CD1 LEU A 41 12.575 -18.401 4.179 1.00 0.00 C ATOM 585 CD2 LEU A 41 13.960 -16.742 2.881 1.00 0.00 C ATOM 0 H LEU A 41 14.440 -15.348 7.280 1.00 0.00 H new ATOM 0 HA LEU A 41 13.498 -14.735 4.720 1.00 0.00 H new ATOM 0 HB2 LEU A 41 15.102 -16.493 5.537 1.00 0.00 H new ATOM 0 HB3 LEU A 41 13.763 -17.336 6.292 1.00 0.00 H new ATOM 0 HG LEU A 41 14.694 -18.252 4.183 1.00 0.00 H new ATOM 0 HD11 LEU A 41 12.509 -18.971 3.252 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.597 -19.086 5.026 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.708 -17.746 4.265 1.00 0.00 H new ATOM 0 HD21 LEU A 41 13.820 -17.398 2.022 1.00 0.00 H new ATOM 0 HD22 LEU A 41 13.192 -15.969 2.876 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.944 -16.276 2.825 1.00 0.00 H new ATOM 597 N GLU A 42 11.121 -15.926 6.628 1.00 0.00 N ATOM 598 CA GLU A 42 9.669 -16.089 6.735 1.00 0.00 C ATOM 599 C GLU A 42 8.889 -14.772 6.548 1.00 0.00 C ATOM 600 O GLU A 42 7.661 -14.795 6.445 1.00 0.00 O ATOM 601 CB GLU A 42 9.318 -16.771 8.071 1.00 0.00 C ATOM 602 CG GLU A 42 9.666 -15.932 9.312 1.00 0.00 C ATOM 603 CD GLU A 42 9.248 -16.652 10.608 1.00 0.00 C ATOM 604 OE1 GLU A 42 10.024 -17.485 11.128 1.00 0.00 O ATOM 605 OE2 GLU A 42 8.141 -16.384 11.130 1.00 0.00 O ATOM 0 H GLU A 42 11.615 -16.129 7.497 1.00 0.00 H new ATOM 0 HA GLU A 42 9.354 -16.729 5.911 1.00 0.00 H new ATOM 0 HB2 GLU A 42 8.251 -16.995 8.084 1.00 0.00 H new ATOM 0 HB3 GLU A 42 9.844 -17.724 8.130 1.00 0.00 H new ATOM 0 HG2 GLU A 42 10.738 -15.735 9.332 1.00 0.00 H new ATOM 0 HG3 GLU A 42 9.166 -14.965 9.252 1.00 0.00 H new ATOM 612 N ASP A 43 9.581 -13.630 6.490 1.00 0.00 N ATOM 613 CA ASP A 43 9.018 -12.285 6.366 1.00 0.00 C ATOM 614 C ASP A 43 9.771 -11.471 5.295 1.00 0.00 C ATOM 615 O ASP A 43 9.685 -10.244 5.255 1.00 0.00 O ATOM 616 CB ASP A 43 9.043 -11.605 7.745 1.00 0.00 C ATOM 617 CG ASP A 43 8.262 -10.278 7.774 1.00 0.00 C ATOM 618 OD1 ASP A 43 7.097 -10.239 7.315 1.00 0.00 O ATOM 619 OD2 ASP A 43 8.777 -9.285 8.335 1.00 0.00 O ATOM 0 H ASP A 43 10.600 -13.620 6.530 1.00 0.00 H new ATOM 0 HA ASP A 43 7.982 -12.344 6.032 1.00 0.00 H new ATOM 0 HB2 ASP A 43 8.623 -12.284 8.487 1.00 0.00 H new ATOM 0 HB3 ASP A 43 10.077 -11.418 8.034 1.00 0.00 H new ATOM 624 N LEU A 44 10.509 -12.151 4.407 1.00 0.00 N ATOM 625 CA LEU A 44 11.279 -11.554 3.318 1.00 0.00 C ATOM 626 C LEU A 44 11.002 -12.369 2.050 1.00 0.00 C ATOM 627 O LEU A 44 11.590 -13.443 1.888 1.00 0.00 O ATOM 628 CB LEU A 44 12.787 -11.543 3.643 1.00 0.00 C ATOM 629 CG LEU A 44 13.227 -10.487 4.672 1.00 0.00 C ATOM 630 CD1 LEU A 44 14.712 -10.701 4.987 1.00 0.00 C ATOM 631 CD2 LEU A 44 13.021 -9.052 4.167 1.00 0.00 C ATOM 0 H LEU A 44 10.586 -13.168 4.432 1.00 0.00 H new ATOM 0 HA LEU A 44 10.979 -10.516 3.175 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.070 -12.528 4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.341 -11.379 2.718 1.00 0.00 H new ATOM 0 HG LEU A 44 12.610 -10.609 5.563 1.00 0.00 H new ATOM 0 HD11 LEU A 44 15.040 -9.960 5.716 1.00 0.00 H new ATOM 0 HD12 LEU A 44 14.857 -11.701 5.396 1.00 0.00 H new ATOM 0 HD13 LEU A 44 15.297 -10.595 4.073 1.00 0.00 H new ATOM 0 HD21 LEU A 44 13.347 -8.347 4.931 1.00 0.00 H new ATOM 0 HD22 LEU A 44 13.604 -8.899 3.259 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.965 -8.890 3.951 1.00 0.00 H new ATOM 643 N PRO A 45 10.091 -11.922 1.166 1.00 0.00 N ATOM 644 CA PRO A 45 9.774 -12.649 -0.054 1.00 0.00 C ATOM 645 C PRO A 45 10.963 -12.632 -1.025 1.00 0.00 C ATOM 646 O PRO A 45 11.882 -11.815 -0.914 1.00 0.00 O ATOM 647 CB PRO A 45 8.525 -11.971 -0.629 1.00 0.00 C ATOM 648 CG PRO A 45 8.655 -10.535 -0.133 1.00 0.00 C ATOM 649 CD PRO A 45 9.319 -10.688 1.235 1.00 0.00 C ATOM 0 HA PRO A 45 9.577 -13.705 0.133 1.00 0.00 H new ATOM 0 HB2 PRO A 45 8.503 -12.022 -1.718 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.609 -12.441 -0.270 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.261 -9.931 -0.808 1.00 0.00 H new ATOM 0 HG3 PRO A 45 7.683 -10.048 -0.055 1.00 0.00 H new ATOM 0 HD2 PRO A 45 9.962 -9.836 1.455 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.573 -10.737 2.028 1.00 0.00 H new ATOM 657 N ALA A 46 10.918 -13.536 -2.006 1.00 0.00 N ATOM 658 CA ALA A 46 12.020 -13.824 -2.919 1.00 0.00 C ATOM 659 C ALA A 46 12.302 -12.726 -3.953 1.00 0.00 C ATOM 660 O ALA A 46 13.180 -12.912 -4.795 1.00 0.00 O ATOM 661 CB ALA A 46 11.723 -15.152 -3.629 1.00 0.00 C ATOM 0 H ALA A 46 10.090 -14.102 -2.190 1.00 0.00 H new ATOM 0 HA ALA A 46 12.925 -13.880 -2.314 1.00 0.00 H new ATOM 0 HB1 ALA A 46 12.535 -15.386 -4.317 1.00 0.00 H new ATOM 0 HB2 ALA A 46 11.633 -15.948 -2.890 1.00 0.00 H new ATOM 0 HB3 ALA A 46 10.790 -15.066 -4.185 1.00 0.00 H new ATOM 667 N SER A 47 11.586 -11.604 -3.901 1.00 0.00 N ATOM 668 CA SER A 47 11.611 -10.559 -4.913 1.00 0.00 C ATOM 669 C SER A 47 11.382 -9.223 -4.213 1.00 0.00 C ATOM 670 O SER A 47 10.513 -9.126 -3.342 1.00 0.00 O ATOM 671 CB SER A 47 10.500 -10.799 -5.949 1.00 0.00 C ATOM 672 OG SER A 47 10.549 -12.106 -6.504 1.00 0.00 O ATOM 0 H SER A 47 10.954 -11.394 -3.128 1.00 0.00 H new ATOM 0 HA SER A 47 12.570 -10.561 -5.431 1.00 0.00 H new ATOM 0 HB2 SER A 47 9.529 -10.643 -5.479 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.588 -10.064 -6.749 1.00 0.00 H new ATOM 0 HG SER A 47 9.824 -12.212 -7.155 1.00 0.00 H new ATOM 678 N GLY A 48 12.148 -8.203 -4.594 1.00 0.00 N ATOM 679 CA GLY A 48 12.043 -6.852 -4.062 1.00 0.00 C ATOM 680 C GLY A 48 13.391 -6.149 -4.147 1.00 0.00 C ATOM 681 O GLY A 48 14.385 -6.757 -4.558 1.00 0.00 O ATOM 0 H GLY A 48 12.878 -8.299 -5.300 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.295 -6.290 -4.621 1.00 0.00 H new ATOM 0 HA3 GLY A 48 11.707 -6.886 -3.026 1.00 0.00 H new ATOM 685 N ILE A 49 13.420 -4.877 -3.742 1.00 0.00 N ATOM 686 CA ILE A 49 14.626 -4.070 -3.649 1.00 0.00 C ATOM 687 C ILE A 49 14.811 -3.799 -2.159 1.00 0.00 C ATOM 688 O ILE A 49 14.095 -2.982 -1.577 1.00 0.00 O ATOM 689 CB ILE A 49 14.518 -2.771 -4.481 1.00 0.00 C ATOM 690 CG1 ILE A 49 14.120 -3.039 -5.951 1.00 0.00 C ATOM 691 CG2 ILE A 49 15.866 -2.027 -4.420 1.00 0.00 C ATOM 692 CD1 ILE A 49 13.695 -1.761 -6.678 1.00 0.00 C ATOM 0 H ILE A 49 12.579 -4.372 -3.463 1.00 0.00 H new ATOM 0 HA ILE A 49 15.492 -4.585 -4.066 1.00 0.00 H new ATOM 0 HB ILE A 49 13.725 -2.159 -4.051 1.00 0.00 H new ATOM 0 HG12 ILE A 49 14.961 -3.491 -6.477 1.00 0.00 H new ATOM 0 HG13 ILE A 49 13.302 -3.759 -5.979 1.00 0.00 H new ATOM 0 HG21 ILE A 49 15.801 -1.109 -5.004 1.00 0.00 H new ATOM 0 HG22 ILE A 49 16.100 -1.783 -3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 49 16.651 -2.663 -4.829 1.00 0.00 H new ATOM 0 HD11 ILE A 49 13.425 -2.000 -7.707 1.00 0.00 H new ATOM 0 HD12 ILE A 49 12.836 -1.322 -6.170 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.521 -1.049 -6.676 1.00 0.00 H new ATOM 704 N TRP A 50 15.730 -4.518 -1.524 1.00 0.00 N ATOM 705 CA TRP A 50 15.997 -4.396 -0.096 1.00 0.00 C ATOM 706 C TRP A 50 17.259 -3.548 0.117 1.00 0.00 C ATOM 707 O TRP A 50 17.989 -3.263 -0.833 1.00 0.00 O ATOM 708 CB TRP A 50 16.068 -5.798 0.541 1.00 0.00 C ATOM 709 CG TRP A 50 14.914 -6.743 0.275 1.00 0.00 C ATOM 710 CD1 TRP A 50 15.016 -8.092 0.194 1.00 0.00 C ATOM 711 CD2 TRP A 50 13.488 -6.464 0.061 1.00 0.00 C ATOM 712 NE1 TRP A 50 13.792 -8.655 -0.115 1.00 0.00 N ATOM 713 CE2 TRP A 50 12.814 -7.696 -0.196 1.00 0.00 C ATOM 714 CE3 TRP A 50 12.678 -5.306 0.051 1.00 0.00 C ATOM 715 CZ2 TRP A 50 11.444 -7.769 -0.462 1.00 0.00 C ATOM 716 CZ3 TRP A 50 11.297 -5.364 -0.220 1.00 0.00 C ATOM 717 CH2 TRP A 50 10.675 -6.597 -0.475 1.00 0.00 C ATOM 0 H TRP A 50 16.317 -5.209 -1.991 1.00 0.00 H new ATOM 0 HA TRP A 50 15.185 -3.874 0.411 1.00 0.00 H new ATOM 0 HB2 TRP A 50 16.984 -6.279 0.196 1.00 0.00 H new ATOM 0 HB3 TRP A 50 16.160 -5.674 1.620 1.00 0.00 H new ATOM 0 HD1 TRP A 50 15.928 -8.650 0.349 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.636 -9.652 -0.263 1.00 0.00 H new ATOM 0 HE3 TRP A 50 13.131 -4.348 0.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 10.980 -8.724 -0.657 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 10.713 -4.455 -0.232 1.00 0.00 H new ATOM 0 HH2 TRP A 50 9.615 -6.642 -0.679 1.00 0.00 H new ATOM 728 N LEU A 51 17.547 -3.126 1.348 1.00 0.00 N ATOM 729 CA LEU A 51 18.764 -2.381 1.662 1.00 0.00 C ATOM 730 C LEU A 51 19.206 -2.821 3.047 1.00 0.00 C ATOM 731 O LEU A 51 18.595 -2.440 4.040 1.00 0.00 O ATOM 732 CB LEU A 51 18.514 -0.866 1.545 1.00 0.00 C ATOM 733 CG LEU A 51 19.710 0.018 1.965 1.00 0.00 C ATOM 734 CD1 LEU A 51 21.003 -0.367 1.237 1.00 0.00 C ATOM 735 CD2 LEU A 51 19.393 1.489 1.669 1.00 0.00 C ATOM 0 H LEU A 51 16.944 -3.291 2.154 1.00 0.00 H new ATOM 0 HA LEU A 51 19.566 -2.591 0.955 1.00 0.00 H new ATOM 0 HB2 LEU A 51 18.252 -0.633 0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 51 17.653 -0.605 2.160 1.00 0.00 H new ATOM 0 HG LEU A 51 19.866 -0.137 3.033 1.00 0.00 H new ATOM 0 HD11 LEU A 51 21.813 0.283 1.567 1.00 0.00 H new ATOM 0 HD12 LEU A 51 21.254 -1.403 1.464 1.00 0.00 H new ATOM 0 HD13 LEU A 51 20.862 -0.255 0.162 1.00 0.00 H new ATOM 0 HD21 LEU A 51 20.238 2.110 1.966 1.00 0.00 H new ATOM 0 HD22 LEU A 51 19.208 1.614 0.602 1.00 0.00 H new ATOM 0 HD23 LEU A 51 18.507 1.790 2.228 1.00 0.00 H new ATOM 747 N VAL A 52 20.191 -3.711 3.098 1.00 0.00 N ATOM 748 CA VAL A 52 20.660 -4.323 4.334 1.00 0.00 C ATOM 749 C VAL A 52 21.585 -3.341 5.057 1.00 0.00 C ATOM 750 O VAL A 52 22.419 -2.689 4.423 1.00 0.00 O ATOM 751 CB VAL A 52 21.347 -5.666 4.030 1.00 0.00 C ATOM 752 CG1 VAL A 52 21.666 -6.448 5.315 1.00 0.00 C ATOM 753 CG2 VAL A 52 20.502 -6.577 3.116 1.00 0.00 C ATOM 0 H VAL A 52 20.693 -4.032 2.270 1.00 0.00 H new ATOM 0 HA VAL A 52 19.821 -4.541 4.995 1.00 0.00 H new ATOM 0 HB VAL A 52 22.269 -5.401 3.513 1.00 0.00 H new ATOM 0 HG11 VAL A 52 22.150 -7.390 5.057 1.00 0.00 H new ATOM 0 HG12 VAL A 52 22.332 -5.858 5.944 1.00 0.00 H new ATOM 0 HG13 VAL A 52 20.742 -6.651 5.856 1.00 0.00 H new ATOM 0 HG21 VAL A 52 21.037 -7.509 2.936 1.00 0.00 H new ATOM 0 HG22 VAL A 52 19.549 -6.793 3.598 1.00 0.00 H new ATOM 0 HG23 VAL A 52 20.322 -6.073 2.166 1.00 0.00 H new ATOM 763 N ILE A 53 21.484 -3.277 6.385 1.00 0.00 N ATOM 764 CA ILE A 53 22.391 -2.542 7.251 1.00 0.00 C ATOM 765 C ILE A 53 22.757 -3.506 8.378 1.00 0.00 C ATOM 766 O ILE A 53 21.860 -4.143 8.934 1.00 0.00 O ATOM 767 CB ILE A 53 21.734 -1.248 7.804 1.00 0.00 C ATOM 768 CG1 ILE A 53 21.154 -0.324 6.707 1.00 0.00 C ATOM 769 CG2 ILE A 53 22.761 -0.443 8.619 1.00 0.00 C ATOM 770 CD1 ILE A 53 19.656 -0.543 6.486 1.00 0.00 C ATOM 0 H ILE A 53 20.743 -3.753 6.899 1.00 0.00 H new ATOM 0 HA ILE A 53 23.275 -2.210 6.706 1.00 0.00 H new ATOM 0 HB ILE A 53 20.903 -1.582 8.426 1.00 0.00 H new ATOM 0 HG12 ILE A 53 21.329 0.716 6.983 1.00 0.00 H new ATOM 0 HG13 ILE A 53 21.685 -0.499 5.771 1.00 0.00 H new ATOM 0 HG21 ILE A 53 22.291 0.463 9.003 1.00 0.00 H new ATOM 0 HG22 ILE A 53 23.119 -1.048 9.452 1.00 0.00 H new ATOM 0 HG23 ILE A 53 23.602 -0.173 7.980 1.00 0.00 H new ATOM 0 HD11 ILE A 53 19.301 0.131 5.706 1.00 0.00 H new ATOM 0 HD12 ILE A 53 19.480 -1.575 6.182 1.00 0.00 H new ATOM 0 HD13 ILE A 53 19.118 -0.341 7.412 1.00 0.00 H new ATOM 782 N SER A 54 24.035 -3.575 8.749 1.00 0.00 N ATOM 783 CA SER A 54 24.493 -4.342 9.899 1.00 0.00 C ATOM 784 C SER A 54 25.307 -3.478 10.854 1.00 0.00 C ATOM 785 O SER A 54 26.156 -2.692 10.423 1.00 0.00 O ATOM 786 CB SER A 54 25.380 -5.498 9.446 1.00 0.00 C ATOM 787 OG SER A 54 24.629 -6.518 8.834 1.00 0.00 O ATOM 0 H SER A 54 24.786 -3.094 8.253 1.00 0.00 H new ATOM 0 HA SER A 54 23.605 -4.715 10.409 1.00 0.00 H new ATOM 0 HB2 SER A 54 26.131 -5.129 8.747 1.00 0.00 H new ATOM 0 HB3 SER A 54 25.915 -5.904 10.304 1.00 0.00 H new ATOM 0 HG SER A 54 25.142 -7.353 8.844 1.00 0.00 H new ATOM 793 N SER A 55 25.055 -3.662 12.149 1.00 0.00 N ATOM 794 CA SER A 55 25.886 -3.111 13.208 1.00 0.00 C ATOM 795 C SER A 55 27.232 -3.853 13.207 1.00 0.00 C ATOM 796 O SER A 55 27.320 -4.980 12.714 1.00 0.00 O ATOM 797 CB SER A 55 25.190 -3.293 14.557 1.00 0.00 C ATOM 798 OG SER A 55 23.908 -2.694 14.545 1.00 0.00 O ATOM 0 H SER A 55 24.261 -4.203 12.491 1.00 0.00 H new ATOM 0 HA SER A 55 26.050 -2.046 13.041 1.00 0.00 H new ATOM 0 HB2 SER A 55 25.098 -4.355 14.784 1.00 0.00 H new ATOM 0 HB3 SER A 55 25.796 -2.850 15.347 1.00 0.00 H new ATOM 0 HG SER A 55 23.309 -3.215 13.971 1.00 0.00 H new ATOM 804 N THR A 56 28.268 -3.262 13.804 1.00 0.00 N ATOM 805 CA THR A 56 29.611 -3.831 13.841 1.00 0.00 C ATOM 806 C THR A 56 30.204 -3.534 15.224 1.00 0.00 C ATOM 807 O THR A 56 30.802 -2.480 15.445 1.00 0.00 O ATOM 808 CB THR A 56 30.472 -3.297 12.670 1.00 0.00 C ATOM 809 OG1 THR A 56 29.707 -2.928 11.529 1.00 0.00 O ATOM 810 CG2 THR A 56 31.463 -4.361 12.209 1.00 0.00 C ATOM 0 H THR A 56 28.194 -2.363 14.281 1.00 0.00 H new ATOM 0 HA THR A 56 29.585 -4.912 13.701 1.00 0.00 H new ATOM 0 HB THR A 56 30.974 -2.413 13.063 1.00 0.00 H new ATOM 0 HG1 THR A 56 29.049 -2.248 11.783 1.00 0.00 H new ATOM 0 HG21 THR A 56 32.060 -3.970 11.386 1.00 0.00 H new ATOM 0 HG22 THR A 56 32.119 -4.630 13.037 1.00 0.00 H new ATOM 0 HG23 THR A 56 30.919 -5.244 11.875 1.00 0.00 H new ATOM 818 N HIS A 57 29.980 -4.430 16.188 1.00 0.00 N ATOM 819 CA HIS A 57 30.302 -4.232 17.605 1.00 0.00 C ATOM 820 C HIS A 57 31.807 -4.445 17.894 1.00 0.00 C ATOM 821 O HIS A 57 32.175 -5.127 18.850 1.00 0.00 O ATOM 822 CB HIS A 57 29.376 -5.139 18.440 1.00 0.00 C ATOM 823 CG HIS A 57 29.300 -4.773 19.906 1.00 0.00 C ATOM 824 ND1 HIS A 57 28.534 -3.769 20.458 1.00 0.00 N ATOM 825 CD2 HIS A 57 29.950 -5.394 20.939 1.00 0.00 C ATOM 826 CE1 HIS A 57 28.725 -3.780 21.788 1.00 0.00 C ATOM 827 NE2 HIS A 57 29.585 -4.757 22.134 1.00 0.00 N ATOM 0 H HIS A 57 29.558 -5.339 16.000 1.00 0.00 H new ATOM 0 HA HIS A 57 30.118 -3.196 17.891 1.00 0.00 H new ATOM 0 HB2 HIS A 57 28.372 -5.102 18.016 1.00 0.00 H new ATOM 0 HB3 HIS A 57 29.721 -6.169 18.352 1.00 0.00 H new ATOM 0 HD2 HIS A 57 30.627 -6.230 20.849 1.00 0.00 H new ATOM 0 HE1 HIS A 57 28.254 -3.100 22.483 1.00 0.00 H new ATOM 0 HE2 HIS A 57 29.906 -4.987 23.075 1.00 0.00 H new ATOM 835 N GLY A 58 32.696 -3.940 17.033 1.00 0.00 N ATOM 836 CA GLY A 58 34.153 -3.994 17.196 1.00 0.00 C ATOM 837 C GLY A 58 34.756 -5.353 16.832 1.00 0.00 C ATOM 838 O GLY A 58 35.793 -5.404 16.170 1.00 0.00 O ATOM 0 H GLY A 58 32.412 -3.467 16.175 1.00 0.00 H new ATOM 0 HA2 GLY A 58 34.609 -3.224 16.574 1.00 0.00 H new ATOM 0 HA3 GLY A 58 34.404 -3.759 18.230 1.00 0.00 H new ATOM 842 N ALA A 59 34.088 -6.452 17.188 1.00 0.00 N ATOM 843 CA ALA A 59 34.523 -7.811 16.879 1.00 0.00 C ATOM 844 C ALA A 59 34.308 -8.189 15.405 1.00 0.00 C ATOM 845 O ALA A 59 34.951 -9.119 14.918 1.00 0.00 O ATOM 846 CB ALA A 59 33.759 -8.788 17.780 1.00 0.00 C ATOM 0 H ALA A 59 33.212 -6.419 17.710 1.00 0.00 H new ATOM 0 HA ALA A 59 35.596 -7.865 17.062 1.00 0.00 H new ATOM 0 HB1 ALA A 59 34.074 -9.808 17.560 1.00 0.00 H new ATOM 0 HB2 ALA A 59 33.970 -8.560 18.825 1.00 0.00 H new ATOM 0 HB3 ALA A 59 32.689 -8.691 17.597 1.00 0.00 H new ATOM 852 N GLY A 60 33.407 -7.497 14.696 1.00 0.00 N ATOM 853 CA GLY A 60 33.058 -7.821 13.311 1.00 0.00 C ATOM 854 C GLY A 60 31.975 -8.894 13.189 1.00 0.00 C ATOM 855 O GLY A 60 31.737 -9.372 12.080 1.00 0.00 O ATOM 0 H GLY A 60 32.899 -6.695 15.070 1.00 0.00 H new ATOM 0 HA2 GLY A 60 32.719 -6.915 12.809 1.00 0.00 H new ATOM 0 HA3 GLY A 60 33.953 -8.159 12.789 1.00 0.00 H new ATOM 859 N ASP A 61 31.331 -9.289 14.293 1.00 0.00 N ATOM 860 CA ASP A 61 30.233 -10.258 14.279 1.00 0.00 C ATOM 861 C ASP A 61 28.940 -9.608 13.765 1.00 0.00 C ATOM 862 O ASP A 61 28.745 -8.397 13.903 1.00 0.00 O ATOM 863 CB ASP A 61 30.026 -10.834 15.687 1.00 0.00 C ATOM 864 CG ASP A 61 28.956 -11.943 15.727 1.00 0.00 C ATOM 865 OD1 ASP A 61 28.812 -12.694 14.735 1.00 0.00 O ATOM 866 OD2 ASP A 61 28.289 -12.094 16.775 1.00 0.00 O ATOM 0 H ASP A 61 31.559 -8.943 15.225 1.00 0.00 H new ATOM 0 HA ASP A 61 30.493 -11.071 13.601 1.00 0.00 H new ATOM 0 HB2 ASP A 61 30.971 -11.234 16.054 1.00 0.00 H new ATOM 0 HB3 ASP A 61 29.736 -10.031 16.364 1.00 0.00 H new ATOM 871 N ILE A 62 28.057 -10.413 13.174 1.00 0.00 N ATOM 872 CA ILE A 62 26.770 -9.995 12.621 1.00 0.00 C ATOM 873 C ILE A 62 25.866 -9.521 13.782 1.00 0.00 C ATOM 874 O ILE A 62 25.904 -10.130 14.855 1.00 0.00 O ATOM 875 CB ILE A 62 26.146 -11.167 11.810 1.00 0.00 C ATOM 876 CG1 ILE A 62 27.147 -11.875 10.862 1.00 0.00 C ATOM 877 CG2 ILE A 62 24.922 -10.712 10.989 1.00 0.00 C ATOM 878 CD1 ILE A 62 26.543 -13.053 10.086 1.00 0.00 C ATOM 0 H ILE A 62 28.226 -11.413 13.063 1.00 0.00 H new ATOM 0 HA ILE A 62 26.890 -9.161 11.929 1.00 0.00 H new ATOM 0 HB ILE A 62 25.838 -11.887 12.568 1.00 0.00 H new ATOM 0 HG12 ILE A 62 27.536 -11.146 10.151 1.00 0.00 H new ATOM 0 HG13 ILE A 62 27.994 -12.234 11.447 1.00 0.00 H new ATOM 0 HG21 ILE A 62 24.517 -11.561 10.438 1.00 0.00 H new ATOM 0 HG22 ILE A 62 24.159 -10.318 11.661 1.00 0.00 H new ATOM 0 HG23 ILE A 62 25.223 -9.934 10.287 1.00 0.00 H new ATOM 0 HD11 ILE A 62 27.305 -13.496 9.445 1.00 0.00 H new ATOM 0 HD12 ILE A 62 26.179 -13.803 10.788 1.00 0.00 H new ATOM 0 HD13 ILE A 62 25.715 -12.698 9.473 1.00 0.00 H new ATOM 890 N PRO A 63 25.038 -8.472 13.597 1.00 0.00 N ATOM 891 CA PRO A 63 24.088 -7.994 14.602 1.00 0.00 C ATOM 892 C PRO A 63 23.109 -9.091 15.022 1.00 0.00 C ATOM 893 O PRO A 63 22.409 -9.651 14.180 1.00 0.00 O ATOM 894 CB PRO A 63 23.339 -6.834 13.942 1.00 0.00 C ATOM 895 CG PRO A 63 23.519 -7.100 12.454 1.00 0.00 C ATOM 896 CD PRO A 63 24.937 -7.637 12.412 1.00 0.00 C ATOM 0 HA PRO A 63 24.605 -7.686 15.510 1.00 0.00 H new ATOM 0 HB2 PRO A 63 22.286 -6.823 14.224 1.00 0.00 H new ATOM 0 HB3 PRO A 63 23.756 -5.870 14.231 1.00 0.00 H new ATOM 0 HG2 PRO A 63 22.796 -7.822 12.076 1.00 0.00 H new ATOM 0 HG3 PRO A 63 23.406 -6.194 11.859 1.00 0.00 H new ATOM 0 HD2 PRO A 63 25.118 -8.211 11.504 1.00 0.00 H new ATOM 0 HD3 PRO A 63 25.669 -6.830 12.430 1.00 0.00 H new ATOM 904 N ASP A 64 23.013 -9.352 16.326 1.00 0.00 N ATOM 905 CA ASP A 64 22.231 -10.451 16.901 1.00 0.00 C ATOM 906 C ASP A 64 20.746 -10.434 16.514 1.00 0.00 C ATOM 907 O ASP A 64 20.105 -11.485 16.469 1.00 0.00 O ATOM 908 CB ASP A 64 22.368 -10.420 18.428 1.00 0.00 C ATOM 909 CG ASP A 64 21.572 -11.553 19.100 1.00 0.00 C ATOM 910 OD1 ASP A 64 22.015 -12.723 19.046 1.00 0.00 O ATOM 911 OD2 ASP A 64 20.530 -11.271 19.732 1.00 0.00 O ATOM 0 H ASP A 64 23.489 -8.791 17.032 1.00 0.00 H new ATOM 0 HA ASP A 64 22.638 -11.373 16.486 1.00 0.00 H new ATOM 0 HB2 ASP A 64 23.420 -10.505 18.700 1.00 0.00 H new ATOM 0 HB3 ASP A 64 22.019 -9.459 18.804 1.00 0.00 H new ATOM 916 N ASN A 65 20.189 -9.255 16.216 1.00 0.00 N ATOM 917 CA ASN A 65 18.782 -9.114 15.842 1.00 0.00 C ATOM 918 C ASN A 65 18.497 -9.636 14.427 1.00 0.00 C ATOM 919 O ASN A 65 17.341 -9.919 14.117 1.00 0.00 O ATOM 920 CB ASN A 65 18.296 -7.656 15.993 1.00 0.00 C ATOM 921 CG ASN A 65 18.678 -6.747 14.827 1.00 0.00 C ATOM 922 OD1 ASN A 65 19.742 -6.888 14.239 1.00 0.00 O ATOM 923 ND2 ASN A 65 17.827 -5.803 14.466 1.00 0.00 N ATOM 0 H ASN A 65 20.702 -8.374 16.228 1.00 0.00 H new ATOM 0 HA ASN A 65 18.217 -9.735 16.537 1.00 0.00 H new ATOM 0 HB2 ASN A 65 17.211 -7.655 16.100 1.00 0.00 H new ATOM 0 HB3 ASN A 65 18.707 -7.241 16.913 1.00 0.00 H new ATOM 0 HD21 ASN A 65 18.054 -5.182 13.689 1.00 0.00 H new ATOM 0 HD22 ASN A 65 16.943 -5.695 14.964 1.00 0.00 H new ATOM 930 N LEU A 66 19.516 -9.777 13.573 1.00 0.00 N ATOM 931 CA LEU A 66 19.384 -10.089 12.145 1.00 0.00 C ATOM 932 C LEU A 66 20.238 -11.294 11.763 1.00 0.00 C ATOM 933 O LEU A 66 19.929 -11.972 10.786 1.00 0.00 O ATOM 934 CB LEU A 66 19.794 -8.844 11.333 1.00 0.00 C ATOM 935 CG LEU A 66 19.858 -9.023 9.799 1.00 0.00 C ATOM 936 CD1 LEU A 66 18.489 -9.355 9.197 1.00 0.00 C ATOM 937 CD2 LEU A 66 20.400 -7.743 9.154 1.00 0.00 C ATOM 0 H LEU A 66 20.488 -9.674 13.866 1.00 0.00 H new ATOM 0 HA LEU A 66 18.349 -10.349 11.923 1.00 0.00 H new ATOM 0 HB2 LEU A 66 19.090 -8.042 11.556 1.00 0.00 H new ATOM 0 HB3 LEU A 66 20.773 -8.515 11.681 1.00 0.00 H new ATOM 0 HG LEU A 66 20.523 -9.863 9.595 1.00 0.00 H new ATOM 0 HD11 LEU A 66 18.585 -9.471 8.117 1.00 0.00 H new ATOM 0 HD12 LEU A 66 18.116 -10.283 9.630 1.00 0.00 H new ATOM 0 HD13 LEU A 66 17.790 -8.547 9.414 1.00 0.00 H new ATOM 0 HD21 LEU A 66 20.444 -7.871 8.072 1.00 0.00 H new ATOM 0 HD22 LEU A 66 19.742 -6.908 9.394 1.00 0.00 H new ATOM 0 HD23 LEU A 66 21.400 -7.538 9.536 1.00 0.00 H new ATOM 949 N SER A 67 21.281 -11.601 12.529 1.00 0.00 N ATOM 950 CA SER A 67 22.207 -12.676 12.241 1.00 0.00 C ATOM 951 C SER A 67 21.552 -14.053 12.023 1.00 0.00 C ATOM 952 O SER A 67 22.058 -14.781 11.164 1.00 0.00 O ATOM 953 CB SER A 67 23.334 -12.642 13.277 1.00 0.00 C ATOM 954 OG SER A 67 22.897 -12.949 14.584 1.00 0.00 O ATOM 0 H SER A 67 21.505 -11.094 13.385 1.00 0.00 H new ATOM 0 HA SER A 67 22.647 -12.503 11.259 1.00 0.00 H new ATOM 0 HB2 SER A 67 24.109 -13.350 12.984 1.00 0.00 H new ATOM 0 HB3 SER A 67 23.790 -11.652 13.276 1.00 0.00 H new ATOM 0 HG SER A 67 23.658 -12.913 15.200 1.00 0.00 H new ATOM 960 N PRO A 68 20.415 -14.426 12.655 1.00 0.00 N ATOM 961 CA PRO A 68 19.675 -15.633 12.292 1.00 0.00 C ATOM 962 C PRO A 68 19.322 -15.753 10.799 1.00 0.00 C ATOM 963 O PRO A 68 19.139 -16.872 10.321 1.00 0.00 O ATOM 964 CB PRO A 68 18.421 -15.620 13.171 1.00 0.00 C ATOM 965 CG PRO A 68 18.894 -14.902 14.428 1.00 0.00 C ATOM 966 CD PRO A 68 19.802 -13.828 13.839 1.00 0.00 C ATOM 0 HA PRO A 68 20.302 -16.508 12.463 1.00 0.00 H new ATOM 0 HB2 PRO A 68 17.597 -15.093 12.691 1.00 0.00 H new ATOM 0 HB3 PRO A 68 18.070 -16.629 13.390 1.00 0.00 H new ATOM 0 HG2 PRO A 68 18.066 -14.475 14.993 1.00 0.00 H new ATOM 0 HG3 PRO A 68 19.431 -15.568 15.104 1.00 0.00 H new ATOM 0 HD2 PRO A 68 19.233 -12.937 13.576 1.00 0.00 H new ATOM 0 HD3 PRO A 68 20.561 -13.521 14.559 1.00 0.00 H new ATOM 974 N PHE A 69 19.249 -14.652 10.038 1.00 0.00 N ATOM 975 CA PHE A 69 19.004 -14.700 8.596 1.00 0.00 C ATOM 976 C PHE A 69 20.113 -15.460 7.858 1.00 0.00 C ATOM 977 O PHE A 69 19.818 -16.198 6.918 1.00 0.00 O ATOM 978 CB PHE A 69 18.849 -13.272 8.045 1.00 0.00 C ATOM 979 CG PHE A 69 18.378 -13.171 6.601 1.00 0.00 C ATOM 980 CD1 PHE A 69 17.189 -13.821 6.213 1.00 0.00 C ATOM 981 CD2 PHE A 69 19.079 -12.389 5.656 1.00 0.00 C ATOM 982 CE1 PHE A 69 16.702 -13.693 4.902 1.00 0.00 C ATOM 983 CE2 PHE A 69 18.566 -12.233 4.357 1.00 0.00 C ATOM 984 CZ PHE A 69 17.380 -12.884 3.978 1.00 0.00 C ATOM 0 H PHE A 69 19.358 -13.707 10.407 1.00 0.00 H new ATOM 0 HA PHE A 69 18.077 -15.247 8.425 1.00 0.00 H new ATOM 0 HB2 PHE A 69 18.143 -12.733 8.677 1.00 0.00 H new ATOM 0 HB3 PHE A 69 19.809 -12.762 8.132 1.00 0.00 H new ATOM 0 HD1 PHE A 69 16.648 -14.422 6.929 1.00 0.00 H new ATOM 0 HD2 PHE A 69 20.008 -11.912 5.932 1.00 0.00 H new ATOM 0 HE1 PHE A 69 15.806 -14.217 4.605 1.00 0.00 H new ATOM 0 HE2 PHE A 69 19.087 -11.609 3.646 1.00 0.00 H new ATOM 0 HZ PHE A 69 16.991 -12.762 2.978 1.00 0.00 H new ATOM 994 N TYR A 70 21.372 -15.339 8.303 1.00 0.00 N ATOM 995 CA TYR A 70 22.493 -16.083 7.730 1.00 0.00 C ATOM 996 C TYR A 70 22.236 -17.585 7.857 1.00 0.00 C ATOM 997 O TYR A 70 22.459 -18.338 6.907 1.00 0.00 O ATOM 998 CB TYR A 70 23.794 -15.679 8.449 1.00 0.00 C ATOM 999 CG TYR A 70 25.052 -16.417 8.027 1.00 0.00 C ATOM 1000 CD1 TYR A 70 25.489 -16.378 6.690 1.00 0.00 C ATOM 1001 CD2 TYR A 70 25.817 -17.107 8.991 1.00 0.00 C ATOM 1002 CE1 TYR A 70 26.687 -17.017 6.319 1.00 0.00 C ATOM 1003 CE2 TYR A 70 27.011 -17.753 8.625 1.00 0.00 C ATOM 1004 CZ TYR A 70 27.457 -17.705 7.284 1.00 0.00 C ATOM 1005 OH TYR A 70 28.614 -18.319 6.911 1.00 0.00 O ATOM 0 H TYR A 70 21.637 -14.722 9.070 1.00 0.00 H new ATOM 0 HA TYR A 70 22.594 -15.845 6.671 1.00 0.00 H new ATOM 0 HB2 TYR A 70 23.954 -14.612 8.293 1.00 0.00 H new ATOM 0 HB3 TYR A 70 23.653 -15.827 9.520 1.00 0.00 H new ATOM 0 HD1 TYR A 70 24.904 -15.857 5.947 1.00 0.00 H new ATOM 0 HD2 TYR A 70 25.483 -17.139 10.018 1.00 0.00 H new ATOM 0 HE1 TYR A 70 27.019 -16.981 5.292 1.00 0.00 H new ATOM 0 HE2 TYR A 70 27.587 -18.285 9.367 1.00 0.00 H new ATOM 0 HH TYR A 70 29.024 -18.746 7.692 1.00 0.00 H new ATOM 1015 N GLU A 71 21.742 -18.022 9.019 1.00 0.00 N ATOM 1016 CA GLU A 71 21.442 -19.422 9.274 1.00 0.00 C ATOM 1017 C GLU A 71 20.231 -19.852 8.444 1.00 0.00 C ATOM 1018 O GLU A 71 20.299 -20.864 7.752 1.00 0.00 O ATOM 1019 CB GLU A 71 21.205 -19.668 10.774 1.00 0.00 C ATOM 1020 CG GLU A 71 22.452 -19.361 11.616 1.00 0.00 C ATOM 1021 CD GLU A 71 22.250 -19.755 13.089 1.00 0.00 C ATOM 1022 OE1 GLU A 71 21.765 -18.924 13.889 1.00 0.00 O ATOM 1023 OE2 GLU A 71 22.593 -20.899 13.471 1.00 0.00 O ATOM 0 H GLU A 71 21.540 -17.408 9.808 1.00 0.00 H new ATOM 0 HA GLU A 71 22.299 -20.026 8.976 1.00 0.00 H new ATOM 0 HB2 GLU A 71 20.376 -19.048 11.116 1.00 0.00 H new ATOM 0 HB3 GLU A 71 20.911 -20.706 10.928 1.00 0.00 H new ATOM 0 HG2 GLU A 71 23.308 -19.899 11.209 1.00 0.00 H new ATOM 0 HG3 GLU A 71 22.683 -18.298 11.551 1.00 0.00 H new ATOM 1030 N ALA A 72 19.137 -19.085 8.453 1.00 0.00 N ATOM 1031 CA ALA A 72 17.912 -19.491 7.771 1.00 0.00 C ATOM 1032 C ALA A 72 18.083 -19.566 6.257 1.00 0.00 C ATOM 1033 O ALA A 72 17.427 -20.400 5.629 1.00 0.00 O ATOM 1034 CB ALA A 72 16.763 -18.539 8.130 1.00 0.00 C ATOM 0 H ALA A 72 19.078 -18.183 8.925 1.00 0.00 H new ATOM 0 HA ALA A 72 17.672 -20.497 8.116 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.855 -18.853 7.615 1.00 0.00 H new ATOM 0 HB2 ALA A 72 16.595 -18.561 9.207 1.00 0.00 H new ATOM 0 HB3 ALA A 72 17.021 -17.525 7.824 1.00 0.00 H new ATOM 1040 N LEU A 73 18.939 -18.732 5.661 1.00 0.00 N ATOM 1041 CA LEU A 73 19.257 -18.868 4.249 1.00 0.00 C ATOM 1042 C LEU A 73 20.057 -20.147 4.031 1.00 0.00 C ATOM 1043 O LEU A 73 19.633 -20.977 3.231 1.00 0.00 O ATOM 1044 CB LEU A 73 20.028 -17.653 3.719 1.00 0.00 C ATOM 1045 CG LEU A 73 19.193 -16.369 3.565 1.00 0.00 C ATOM 1046 CD1 LEU A 73 20.111 -15.250 3.067 1.00 0.00 C ATOM 1047 CD2 LEU A 73 18.025 -16.524 2.583 1.00 0.00 C ATOM 0 H LEU A 73 19.417 -17.965 6.134 1.00 0.00 H new ATOM 0 HA LEU A 73 18.322 -18.922 3.691 1.00 0.00 H new ATOM 0 HB2 LEU A 73 20.861 -17.448 4.392 1.00 0.00 H new ATOM 0 HB3 LEU A 73 20.457 -17.908 2.750 1.00 0.00 H new ATOM 0 HG LEU A 73 18.764 -16.139 4.540 1.00 0.00 H new ATOM 0 HD11 LEU A 73 19.536 -14.331 2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 73 20.912 -15.088 3.788 1.00 0.00 H new ATOM 0 HD13 LEU A 73 20.540 -15.532 2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 73 17.476 -15.584 2.519 1.00 0.00 H new ATOM 0 HD22 LEU A 73 18.410 -16.787 1.598 1.00 0.00 H new ATOM 0 HD23 LEU A 73 17.357 -17.311 2.933 1.00 0.00 H new ATOM 1059 N GLN A 74 21.178 -20.347 4.734 1.00 0.00 N ATOM 1060 CA GLN A 74 22.059 -21.471 4.417 1.00 0.00 C ATOM 1061 C GLN A 74 21.423 -22.825 4.765 1.00 0.00 C ATOM 1062 O GLN A 74 21.722 -23.819 4.101 1.00 0.00 O ATOM 1063 CB GLN A 74 23.447 -21.290 5.052 1.00 0.00 C ATOM 1064 CG GLN A 74 23.512 -21.589 6.555 1.00 0.00 C ATOM 1065 CD GLN A 74 24.803 -21.065 7.176 1.00 0.00 C ATOM 1066 OE1 GLN A 74 25.744 -21.808 7.447 1.00 0.00 O ATOM 1067 NE2 GLN A 74 24.870 -19.767 7.410 1.00 0.00 N ATOM 0 H GLN A 74 21.489 -19.760 5.508 1.00 0.00 H new ATOM 0 HA GLN A 74 22.202 -21.477 3.336 1.00 0.00 H new ATOM 0 HB2 GLN A 74 24.154 -21.939 4.536 1.00 0.00 H new ATOM 0 HB3 GLN A 74 23.776 -20.264 4.886 1.00 0.00 H new ATOM 0 HG2 GLN A 74 22.657 -21.134 7.054 1.00 0.00 H new ATOM 0 HG3 GLN A 74 23.440 -22.665 6.716 1.00 0.00 H new ATOM 0 HE21 GLN A 74 24.079 -19.166 7.179 1.00 0.00 H new ATOM 0 HE22 GLN A 74 25.712 -19.366 7.822 1.00 0.00 H new ATOM 1076 N GLU A 75 20.546 -22.885 5.776 1.00 0.00 N ATOM 1077 CA GLU A 75 19.905 -24.131 6.189 1.00 0.00 C ATOM 1078 C GLU A 75 18.841 -24.572 5.178 1.00 0.00 C ATOM 1079 O GLU A 75 18.544 -25.765 5.099 1.00 0.00 O ATOM 1080 CB GLU A 75 19.280 -23.968 7.587 1.00 0.00 C ATOM 1081 CG GLU A 75 20.323 -23.955 8.718 1.00 0.00 C ATOM 1082 CD GLU A 75 20.943 -25.343 8.960 1.00 0.00 C ATOM 1083 OE1 GLU A 75 20.347 -26.162 9.698 1.00 0.00 O ATOM 1084 OE2 GLU A 75 22.043 -25.629 8.433 1.00 0.00 O ATOM 0 H GLU A 75 20.265 -22.073 6.325 1.00 0.00 H new ATOM 0 HA GLU A 75 20.670 -24.907 6.229 1.00 0.00 H new ATOM 0 HB2 GLU A 75 18.709 -23.040 7.617 1.00 0.00 H new ATOM 0 HB3 GLU A 75 18.575 -24.781 7.760 1.00 0.00 H new ATOM 0 HG2 GLU A 75 21.113 -23.245 8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 75 19.854 -23.604 9.637 1.00 0.00 H new ATOM 1091 N GLN A 76 18.280 -23.638 4.395 1.00 0.00 N ATOM 1092 CA GLN A 76 17.163 -23.922 3.494 1.00 0.00 C ATOM 1093 C GLN A 76 17.547 -23.805 2.013 1.00 0.00 C ATOM 1094 O GLN A 76 16.892 -24.440 1.185 1.00 0.00 O ATOM 1095 CB GLN A 76 15.990 -22.983 3.817 1.00 0.00 C ATOM 1096 CG GLN A 76 15.438 -23.192 5.236 1.00 0.00 C ATOM 1097 CD GLN A 76 14.302 -22.217 5.540 1.00 0.00 C ATOM 1098 OE1 GLN A 76 13.130 -22.585 5.583 1.00 0.00 O ATOM 1099 NE2 GLN A 76 14.625 -20.952 5.752 1.00 0.00 N ATOM 0 H GLN A 76 18.591 -22.667 4.372 1.00 0.00 H new ATOM 0 HA GLN A 76 16.868 -24.959 3.658 1.00 0.00 H new ATOM 0 HB2 GLN A 76 16.317 -21.949 3.707 1.00 0.00 H new ATOM 0 HB3 GLN A 76 15.191 -23.144 3.093 1.00 0.00 H new ATOM 0 HG2 GLN A 76 15.079 -24.216 5.342 1.00 0.00 H new ATOM 0 HG3 GLN A 76 16.239 -23.058 5.963 1.00 0.00 H new ATOM 0 HE21 GLN A 76 15.602 -20.662 5.713 1.00 0.00 H new ATOM 0 HE22 GLN A 76 13.897 -20.267 5.955 1.00 0.00 H new ATOM 1108 N LYS A 77 18.596 -23.037 1.679 1.00 0.00 N ATOM 1109 CA LYS A 77 18.973 -22.638 0.317 1.00 0.00 C ATOM 1110 C LYS A 77 17.707 -22.318 -0.503 1.00 0.00 C ATOM 1111 O LYS A 77 17.385 -23.037 -1.449 1.00 0.00 O ATOM 1112 CB LYS A 77 19.918 -23.685 -0.305 1.00 0.00 C ATOM 1113 CG LYS A 77 20.632 -23.137 -1.556 1.00 0.00 C ATOM 1114 CD LYS A 77 21.650 -24.123 -2.148 1.00 0.00 C ATOM 1115 CE LYS A 77 20.976 -25.390 -2.699 1.00 0.00 C ATOM 1116 NZ LYS A 77 21.951 -26.319 -3.322 1.00 0.00 N ATOM 0 H LYS A 77 19.231 -22.662 2.383 1.00 0.00 H new ATOM 0 HA LYS A 77 19.551 -21.714 0.327 1.00 0.00 H new ATOM 0 HB2 LYS A 77 20.660 -23.990 0.433 1.00 0.00 H new ATOM 0 HB3 LYS A 77 19.349 -24.576 -0.572 1.00 0.00 H new ATOM 0 HG2 LYS A 77 19.888 -22.893 -2.314 1.00 0.00 H new ATOM 0 HG3 LYS A 77 21.142 -22.208 -1.299 1.00 0.00 H new ATOM 0 HD2 LYS A 77 22.207 -23.633 -2.947 1.00 0.00 H new ATOM 0 HD3 LYS A 77 22.372 -24.402 -1.381 1.00 0.00 H new ATOM 0 HE2 LYS A 77 20.454 -25.902 -1.891 1.00 0.00 H new ATOM 0 HE3 LYS A 77 20.224 -25.108 -3.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 21.451 -27.158 -3.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 22.431 -25.840 -4.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 22.655 -26.610 -2.614 1.00 0.00 H new ATOM 1130 N PRO A 78 16.952 -21.268 -0.119 1.00 0.00 N ATOM 1131 CA PRO A 78 15.621 -20.998 -0.657 1.00 0.00 C ATOM 1132 C PRO A 78 15.578 -20.560 -2.129 1.00 0.00 C ATOM 1133 O PRO A 78 14.480 -20.443 -2.673 1.00 0.00 O ATOM 1134 CB PRO A 78 15.010 -19.959 0.289 1.00 0.00 C ATOM 1135 CG PRO A 78 16.226 -19.195 0.806 1.00 0.00 C ATOM 1136 CD PRO A 78 17.292 -20.281 0.900 1.00 0.00 C ATOM 0 HA PRO A 78 15.045 -21.923 -0.690 1.00 0.00 H new ATOM 0 HB2 PRO A 78 14.314 -19.302 -0.232 1.00 0.00 H new ATOM 0 HB3 PRO A 78 14.457 -20.431 1.101 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.521 -18.396 0.126 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.032 -18.734 1.774 1.00 0.00 H new ATOM 0 HD2 PRO A 78 18.286 -19.868 0.727 1.00 0.00 H new ATOM 0 HD3 PRO A 78 17.303 -20.732 1.892 1.00 0.00 H new ATOM 1144 N ASP A 79 16.733 -20.364 -2.781 1.00 0.00 N ATOM 1145 CA ASP A 79 16.860 -20.126 -4.228 1.00 0.00 C ATOM 1146 C ASP A 79 15.919 -19.006 -4.702 1.00 0.00 C ATOM 1147 O ASP A 79 15.076 -19.183 -5.584 1.00 0.00 O ATOM 1148 CB ASP A 79 16.700 -21.456 -4.986 1.00 0.00 C ATOM 1149 CG ASP A 79 17.069 -21.330 -6.474 1.00 0.00 C ATOM 1150 OD1 ASP A 79 18.248 -21.044 -6.777 1.00 0.00 O ATOM 1151 OD2 ASP A 79 16.218 -21.616 -7.348 1.00 0.00 O ATOM 0 H ASP A 79 17.633 -20.367 -2.302 1.00 0.00 H new ATOM 0 HA ASP A 79 17.860 -19.755 -4.455 1.00 0.00 H new ATOM 0 HB2 ASP A 79 17.330 -22.214 -4.521 1.00 0.00 H new ATOM 0 HB3 ASP A 79 15.669 -21.800 -4.898 1.00 0.00 H new ATOM 1156 N LEU A 80 16.012 -17.866 -4.008 1.00 0.00 N ATOM 1157 CA LEU A 80 15.171 -16.687 -4.199 1.00 0.00 C ATOM 1158 C LEU A 80 15.295 -16.167 -5.633 1.00 0.00 C ATOM 1159 O LEU A 80 14.283 -15.899 -6.280 1.00 0.00 O ATOM 1160 CB LEU A 80 15.557 -15.577 -3.195 1.00 0.00 C ATOM 1161 CG LEU A 80 15.573 -15.988 -1.709 1.00 0.00 C ATOM 1162 CD1 LEU A 80 15.951 -14.791 -0.831 1.00 0.00 C ATOM 1163 CD2 LEU A 80 14.241 -16.566 -1.223 1.00 0.00 C ATOM 0 H LEU A 80 16.704 -17.738 -3.269 1.00 0.00 H new ATOM 0 HA LEU A 80 14.135 -16.974 -4.020 1.00 0.00 H new ATOM 0 HB2 LEU A 80 16.546 -15.203 -3.459 1.00 0.00 H new ATOM 0 HB3 LEU A 80 14.860 -14.747 -3.315 1.00 0.00 H new ATOM 0 HG LEU A 80 16.319 -16.778 -1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 80 15.958 -15.095 0.216 1.00 0.00 H new ATOM 0 HD12 LEU A 80 16.941 -14.432 -1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 80 15.223 -13.992 -0.971 1.00 0.00 H new ATOM 0 HD21 LEU A 80 14.323 -16.834 -0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 80 13.454 -15.822 -1.348 1.00 0.00 H new ATOM 0 HD23 LEU A 80 13.996 -17.454 -1.805 1.00 0.00 H new ATOM 1175 N SER A 81 16.530 -16.058 -6.129 1.00 0.00 N ATOM 1176 CA SER A 81 16.874 -15.726 -7.511 1.00 0.00 C ATOM 1177 C SER A 81 16.272 -14.423 -8.070 1.00 0.00 C ATOM 1178 O SER A 81 16.301 -14.228 -9.287 1.00 0.00 O ATOM 1179 CB SER A 81 16.602 -16.949 -8.401 1.00 0.00 C ATOM 1180 OG SER A 81 17.293 -18.078 -7.892 1.00 0.00 O ATOM 0 H SER A 81 17.356 -16.206 -5.549 1.00 0.00 H new ATOM 0 HA SER A 81 17.938 -15.491 -7.515 1.00 0.00 H new ATOM 0 HB2 SER A 81 15.532 -17.153 -8.438 1.00 0.00 H new ATOM 0 HB3 SER A 81 16.923 -16.745 -9.423 1.00 0.00 H new ATOM 0 HG SER A 81 17.115 -18.855 -8.462 1.00 0.00 H new ATOM 1186 N ALA A 82 15.748 -13.517 -7.228 1.00 0.00 N ATOM 1187 CA ALA A 82 15.116 -12.280 -7.700 1.00 0.00 C ATOM 1188 C ALA A 82 15.155 -11.134 -6.679 1.00 0.00 C ATOM 1189 O ALA A 82 14.632 -10.052 -6.965 1.00 0.00 O ATOM 1190 CB ALA A 82 13.674 -12.574 -8.149 1.00 0.00 C ATOM 0 H ALA A 82 15.751 -13.622 -6.213 1.00 0.00 H new ATOM 0 HA ALA A 82 15.703 -11.929 -8.548 1.00 0.00 H new ATOM 0 HB1 ALA A 82 13.207 -11.653 -8.499 1.00 0.00 H new ATOM 0 HB2 ALA A 82 13.687 -13.305 -8.958 1.00 0.00 H new ATOM 0 HB3 ALA A 82 13.105 -12.972 -7.309 1.00 0.00 H new ATOM 1196 N VAL A 83 15.769 -11.321 -5.507 1.00 0.00 N ATOM 1197 CA VAL A 83 16.026 -10.210 -4.600 1.00 0.00 C ATOM 1198 C VAL A 83 17.150 -9.372 -5.209 1.00 0.00 C ATOM 1199 O VAL A 83 18.150 -9.911 -5.695 1.00 0.00 O ATOM 1200 CB VAL A 83 16.402 -10.723 -3.190 1.00 0.00 C ATOM 1201 CG1 VAL A 83 16.858 -9.593 -2.256 1.00 0.00 C ATOM 1202 CG2 VAL A 83 15.222 -11.445 -2.529 1.00 0.00 C ATOM 0 H VAL A 83 16.094 -12.227 -5.170 1.00 0.00 H new ATOM 0 HA VAL A 83 15.131 -9.601 -4.478 1.00 0.00 H new ATOM 0 HB VAL A 83 17.231 -11.415 -3.338 1.00 0.00 H new ATOM 0 HG11 VAL A 83 17.110 -10.007 -1.280 1.00 0.00 H new ATOM 0 HG12 VAL A 83 17.735 -9.102 -2.679 1.00 0.00 H new ATOM 0 HG13 VAL A 83 16.054 -8.866 -2.145 1.00 0.00 H new ATOM 0 HG21 VAL A 83 15.517 -11.794 -1.539 1.00 0.00 H new ATOM 0 HG22 VAL A 83 14.381 -10.758 -2.436 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.928 -12.297 -3.141 1.00 0.00 H new ATOM 1212 N ARG A 84 17.007 -8.051 -5.142 1.00 0.00 N ATOM 1213 CA ARG A 84 18.068 -7.106 -5.444 1.00 0.00 C ATOM 1214 C ARG A 84 18.253 -6.328 -4.156 1.00 0.00 C ATOM 1215 O ARG A 84 17.271 -6.055 -3.462 1.00 0.00 O ATOM 1216 CB ARG A 84 17.710 -6.190 -6.623 1.00 0.00 C ATOM 1217 CG ARG A 84 17.628 -6.914 -7.979 1.00 0.00 C ATOM 1218 CD ARG A 84 18.885 -7.714 -8.366 1.00 0.00 C ATOM 1219 NE ARG A 84 20.118 -6.906 -8.323 1.00 0.00 N ATOM 1220 CZ ARG A 84 20.599 -6.136 -9.308 1.00 0.00 C ATOM 1221 NH1 ARG A 84 19.921 -5.980 -10.444 1.00 0.00 N ATOM 1222 NH2 ARG A 84 21.770 -5.528 -9.159 1.00 0.00 N ATOM 0 H ARG A 84 16.132 -7.603 -4.871 1.00 0.00 H new ATOM 0 HA ARG A 84 18.984 -7.606 -5.759 1.00 0.00 H new ATOM 0 HB2 ARG A 84 16.752 -5.712 -6.420 1.00 0.00 H new ATOM 0 HB3 ARG A 84 18.454 -5.396 -6.691 1.00 0.00 H new ATOM 0 HG2 ARG A 84 16.775 -7.593 -7.961 1.00 0.00 H new ATOM 0 HG3 ARG A 84 17.432 -6.176 -8.757 1.00 0.00 H new ATOM 0 HD2 ARG A 84 18.990 -8.564 -7.691 1.00 0.00 H new ATOM 0 HD3 ARG A 84 18.757 -8.118 -9.370 1.00 0.00 H new ATOM 0 HE ARG A 84 20.658 -6.936 -7.458 1.00 0.00 H new ATOM 0 HH11 ARG A 84 19.025 -6.450 -10.571 1.00 0.00 H new ATOM 0 HH12 ARG A 84 20.298 -5.391 -11.186 1.00 0.00 H new ATOM 0 HH21 ARG A 84 22.301 -5.648 -8.296 1.00 0.00 H new ATOM 0 HH22 ARG A 84 22.139 -4.941 -9.907 1.00 0.00 H new ATOM 1236 N PHE A 85 19.489 -6.017 -3.783 1.00 0.00 N ATOM 1237 CA PHE A 85 19.733 -5.392 -2.494 1.00 0.00 C ATOM 1238 C PHE A 85 20.952 -4.486 -2.540 1.00 0.00 C ATOM 1239 O PHE A 85 21.715 -4.512 -3.505 1.00 0.00 O ATOM 1240 CB PHE A 85 19.846 -6.468 -1.398 1.00 0.00 C ATOM 1241 CG PHE A 85 21.070 -7.359 -1.499 1.00 0.00 C ATOM 1242 CD1 PHE A 85 21.061 -8.503 -2.320 1.00 0.00 C ATOM 1243 CD2 PHE A 85 22.227 -7.039 -0.764 1.00 0.00 C ATOM 1244 CE1 PHE A 85 22.201 -9.323 -2.398 1.00 0.00 C ATOM 1245 CE2 PHE A 85 23.370 -7.844 -0.858 1.00 0.00 C ATOM 1246 CZ PHE A 85 23.355 -8.991 -1.667 1.00 0.00 C ATOM 0 H PHE A 85 20.323 -6.185 -4.346 1.00 0.00 H new ATOM 0 HA PHE A 85 18.885 -4.754 -2.247 1.00 0.00 H new ATOM 0 HB2 PHE A 85 19.853 -5.976 -0.426 1.00 0.00 H new ATOM 0 HB3 PHE A 85 18.955 -7.095 -1.432 1.00 0.00 H new ATOM 0 HD1 PHE A 85 20.178 -8.751 -2.890 1.00 0.00 H new ATOM 0 HD2 PHE A 85 22.234 -6.169 -0.124 1.00 0.00 H new ATOM 0 HE1 PHE A 85 22.190 -10.207 -3.019 1.00 0.00 H new ATOM 0 HE2 PHE A 85 24.262 -7.582 -0.308 1.00 0.00 H new ATOM 0 HZ PHE A 85 24.231 -9.619 -1.728 1.00 0.00 H new ATOM 1256 N GLY A 86 21.142 -3.708 -1.479 1.00 0.00 N ATOM 1257 CA GLY A 86 22.339 -2.932 -1.209 1.00 0.00 C ATOM 1258 C GLY A 86 22.752 -3.294 0.212 1.00 0.00 C ATOM 1259 O GLY A 86 21.969 -3.926 0.931 1.00 0.00 O ATOM 0 H GLY A 86 20.432 -3.599 -0.754 1.00 0.00 H new ATOM 0 HA2 GLY A 86 23.130 -3.172 -1.920 1.00 0.00 H new ATOM 0 HA3 GLY A 86 22.142 -1.864 -1.300 1.00 0.00 H new ATOM 1263 N ALA A 87 23.964 -2.938 0.628 1.00 0.00 N ATOM 1264 CA ALA A 87 24.527 -3.423 1.877 1.00 0.00 C ATOM 1265 C ALA A 87 25.392 -2.339 2.506 1.00 0.00 C ATOM 1266 O ALA A 87 26.193 -1.694 1.820 1.00 0.00 O ATOM 1267 CB ALA A 87 25.336 -4.690 1.588 1.00 0.00 C ATOM 0 H ALA A 87 24.578 -2.309 0.110 1.00 0.00 H new ATOM 0 HA ALA A 87 23.736 -3.666 2.586 1.00 0.00 H new ATOM 0 HB1 ALA A 87 25.766 -5.067 2.516 1.00 0.00 H new ATOM 0 HB2 ALA A 87 24.683 -5.448 1.156 1.00 0.00 H new ATOM 0 HB3 ALA A 87 26.137 -4.458 0.885 1.00 0.00 H new ATOM 1273 N ILE A 88 25.232 -2.163 3.815 1.00 0.00 N ATOM 1274 CA ILE A 88 25.873 -1.126 4.604 1.00 0.00 C ATOM 1275 C ILE A 88 26.370 -1.797 5.884 1.00 0.00 C ATOM 1276 O ILE A 88 25.640 -2.576 6.500 1.00 0.00 O ATOM 1277 CB ILE A 88 24.879 0.026 4.913 1.00 0.00 C ATOM 1278 CG1 ILE A 88 24.146 0.521 3.644 1.00 0.00 C ATOM 1279 CG2 ILE A 88 25.624 1.183 5.610 1.00 0.00 C ATOM 1280 CD1 ILE A 88 23.204 1.705 3.859 1.00 0.00 C ATOM 0 H ILE A 88 24.627 -2.765 4.373 1.00 0.00 H new ATOM 0 HA ILE A 88 26.704 -0.674 4.062 1.00 0.00 H new ATOM 0 HB ILE A 88 24.112 -0.362 5.583 1.00 0.00 H new ATOM 0 HG12 ILE A 88 24.891 0.800 2.899 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.573 -0.308 3.228 1.00 0.00 H new ATOM 0 HG21 ILE A 88 24.923 1.990 5.825 1.00 0.00 H new ATOM 0 HG22 ILE A 88 26.062 0.825 6.542 1.00 0.00 H new ATOM 0 HG23 ILE A 88 26.414 1.553 4.956 1.00 0.00 H new ATOM 0 HD11 ILE A 88 22.739 1.977 2.911 1.00 0.00 H new ATOM 0 HD12 ILE A 88 22.431 1.429 4.577 1.00 0.00 H new ATOM 0 HD13 ILE A 88 23.769 2.555 4.243 1.00 0.00 H new ATOM 1292 N GLY A 89 27.583 -1.464 6.314 1.00 0.00 N ATOM 1293 CA GLY A 89 28.113 -1.856 7.609 1.00 0.00 C ATOM 1294 C GLY A 89 28.420 -0.598 8.407 1.00 0.00 C ATOM 1295 O GLY A 89 28.994 0.345 7.859 1.00 0.00 O ATOM 0 H GLY A 89 28.233 -0.905 5.761 1.00 0.00 H new ATOM 0 HA2 GLY A 89 27.391 -2.475 8.142 1.00 0.00 H new ATOM 0 HA3 GLY A 89 29.015 -2.454 7.483 1.00 0.00 H new ATOM 1299 N ILE A 90 28.040 -0.566 9.683 1.00 0.00 N ATOM 1300 CA ILE A 90 28.136 0.613 10.540 1.00 0.00 C ATOM 1301 C ILE A 90 28.601 0.110 11.900 1.00 0.00 C ATOM 1302 O ILE A 90 28.024 -0.853 12.402 1.00 0.00 O ATOM 1303 CB ILE A 90 26.760 1.323 10.660 1.00 0.00 C ATOM 1304 CG1 ILE A 90 26.105 1.559 9.278 1.00 0.00 C ATOM 1305 CG2 ILE A 90 26.914 2.643 11.447 1.00 0.00 C ATOM 1306 CD1 ILE A 90 24.777 2.321 9.311 1.00 0.00 C ATOM 0 H ILE A 90 27.648 -1.378 10.160 1.00 0.00 H new ATOM 0 HA ILE A 90 28.831 1.344 10.127 1.00 0.00 H new ATOM 0 HB ILE A 90 26.088 0.665 11.211 1.00 0.00 H new ATOM 0 HG12 ILE A 90 26.806 2.109 8.650 1.00 0.00 H new ATOM 0 HG13 ILE A 90 25.940 0.593 8.801 1.00 0.00 H new ATOM 0 HG21 ILE A 90 25.944 3.134 11.526 1.00 0.00 H new ATOM 0 HG22 ILE A 90 27.295 2.429 12.445 1.00 0.00 H new ATOM 0 HG23 ILE A 90 27.611 3.298 10.925 1.00 0.00 H new ATOM 0 HD11 ILE A 90 24.398 2.436 8.295 1.00 0.00 H new ATOM 0 HD12 ILE A 90 24.053 1.765 9.908 1.00 0.00 H new ATOM 0 HD13 ILE A 90 24.933 3.305 9.754 1.00 0.00 H new ATOM 1318 N GLY A 91 29.615 0.702 12.527 1.00 0.00 N ATOM 1319 CA GLY A 91 29.963 0.369 13.884 1.00 0.00 C ATOM 1320 C GLY A 91 31.340 0.897 14.219 1.00 0.00 C ATOM 1321 O GLY A 91 31.876 1.797 13.570 1.00 0.00 O ATOM 0 H GLY A 91 30.206 1.417 12.104 1.00 0.00 H new ATOM 0 HA2 GLY A 91 29.228 0.791 14.569 1.00 0.00 H new ATOM 0 HA3 GLY A 91 29.939 -0.713 14.018 1.00 0.00 H new ATOM 1325 N SER A 92 31.900 0.300 15.250 1.00 0.00 N ATOM 1326 CA SER A 92 33.194 0.597 15.861 1.00 0.00 C ATOM 1327 C SER A 92 34.348 0.049 15.007 1.00 0.00 C ATOM 1328 O SER A 92 35.230 -0.653 15.501 1.00 0.00 O ATOM 1329 CB SER A 92 33.203 0.020 17.285 1.00 0.00 C ATOM 1330 OG SER A 92 32.066 0.470 18.010 1.00 0.00 O ATOM 0 H SER A 92 31.430 -0.469 15.727 1.00 0.00 H new ATOM 0 HA SER A 92 33.342 1.676 15.915 1.00 0.00 H new ATOM 0 HB2 SER A 92 33.207 -1.069 17.243 1.00 0.00 H new ATOM 0 HB3 SER A 92 34.114 0.323 17.801 1.00 0.00 H new ATOM 0 HG SER A 92 32.084 0.093 18.914 1.00 0.00 H new ATOM 1336 N ARG A 93 34.317 0.298 13.696 1.00 0.00 N ATOM 1337 CA ARG A 93 35.224 -0.321 12.725 1.00 0.00 C ATOM 1338 C ARG A 93 36.677 0.113 12.909 1.00 0.00 C ATOM 1339 O ARG A 93 37.579 -0.566 12.423 1.00 0.00 O ATOM 1340 CB ARG A 93 34.693 -0.095 11.298 1.00 0.00 C ATOM 1341 CG ARG A 93 33.412 -0.924 11.098 1.00 0.00 C ATOM 1342 CD ARG A 93 32.766 -0.781 9.719 1.00 0.00 C ATOM 1343 NE ARG A 93 31.672 -1.766 9.599 1.00 0.00 N ATOM 1344 CZ ARG A 93 31.593 -2.794 8.746 1.00 0.00 C ATOM 1345 NH1 ARG A 93 32.445 -2.916 7.733 1.00 0.00 N ATOM 1346 NH2 ARG A 93 30.642 -3.704 8.936 1.00 0.00 N ATOM 0 H ARG A 93 33.652 0.945 13.272 1.00 0.00 H new ATOM 0 HA ARG A 93 35.240 -1.396 12.907 1.00 0.00 H new ATOM 0 HB2 ARG A 93 34.485 0.963 11.138 1.00 0.00 H new ATOM 0 HB3 ARG A 93 35.447 -0.386 10.566 1.00 0.00 H new ATOM 0 HG2 ARG A 93 33.646 -1.975 11.267 1.00 0.00 H new ATOM 0 HG3 ARG A 93 32.685 -0.633 11.856 1.00 0.00 H new ATOM 0 HD2 ARG A 93 32.380 0.230 9.587 1.00 0.00 H new ATOM 0 HD3 ARG A 93 33.507 -0.944 8.937 1.00 0.00 H new ATOM 0 HE ARG A 93 30.887 -1.649 10.240 1.00 0.00 H new ATOM 0 HH11 ARG A 93 33.176 -2.218 7.595 1.00 0.00 H new ATOM 0 HH12 ARG A 93 32.368 -3.707 7.094 1.00 0.00 H new ATOM 0 HH21 ARG A 93 29.994 -3.609 9.718 1.00 0.00 H new ATOM 0 HH22 ARG A 93 30.561 -4.497 8.300 1.00 0.00 H new ATOM 1360 N GLU A 94 36.927 1.192 13.653 1.00 0.00 N ATOM 1361 CA GLU A 94 38.270 1.578 14.076 1.00 0.00 C ATOM 1362 C GLU A 94 38.918 0.516 14.982 1.00 0.00 C ATOM 1363 O GLU A 94 40.147 0.429 15.021 1.00 0.00 O ATOM 1364 CB GLU A 94 38.201 2.921 14.821 1.00 0.00 C ATOM 1365 CG GLU A 94 39.151 3.966 14.226 1.00 0.00 C ATOM 1366 CD GLU A 94 38.942 5.338 14.887 1.00 0.00 C ATOM 1367 OE1 GLU A 94 37.836 5.905 14.742 1.00 0.00 O ATOM 1368 OE2 GLU A 94 39.882 5.855 15.534 1.00 0.00 O ATOM 0 H GLU A 94 36.197 1.825 13.980 1.00 0.00 H new ATOM 0 HA GLU A 94 38.889 1.670 13.184 1.00 0.00 H new ATOM 0 HB2 GLU A 94 37.180 3.301 14.787 1.00 0.00 H new ATOM 0 HB3 GLU A 94 38.448 2.765 15.871 1.00 0.00 H new ATOM 0 HG2 GLU A 94 40.183 3.645 14.364 1.00 0.00 H new ATOM 0 HG3 GLU A 94 38.983 4.046 13.152 1.00 0.00 H new ATOM 1375 N TYR A 95 38.119 -0.259 15.734 1.00 0.00 N ATOM 1376 CA TYR A 95 38.620 -1.170 16.759 1.00 0.00 C ATOM 1377 C TYR A 95 39.429 -2.302 16.120 1.00 0.00 C ATOM 1378 O TYR A 95 40.609 -2.472 16.431 1.00 0.00 O ATOM 1379 CB TYR A 95 37.448 -1.712 17.592 1.00 0.00 C ATOM 1380 CG TYR A 95 37.869 -2.605 18.744 1.00 0.00 C ATOM 1381 CD1 TYR A 95 38.206 -2.039 19.988 1.00 0.00 C ATOM 1382 CD2 TYR A 95 37.929 -4.003 18.573 1.00 0.00 C ATOM 1383 CE1 TYR A 95 38.600 -2.862 21.059 1.00 0.00 C ATOM 1384 CE2 TYR A 95 38.321 -4.832 19.639 1.00 0.00 C ATOM 1385 CZ TYR A 95 38.658 -4.265 20.889 1.00 0.00 C ATOM 1386 OH TYR A 95 39.039 -5.078 21.916 1.00 0.00 O ATOM 0 H TYR A 95 37.103 -0.266 15.642 1.00 0.00 H new ATOM 0 HA TYR A 95 39.289 -0.628 17.428 1.00 0.00 H new ATOM 0 HB2 TYR A 95 36.878 -0.871 17.987 1.00 0.00 H new ATOM 0 HB3 TYR A 95 36.779 -2.272 16.938 1.00 0.00 H new ATOM 0 HD1 TYR A 95 38.162 -0.968 20.121 1.00 0.00 H new ATOM 0 HD2 TYR A 95 37.673 -4.439 17.619 1.00 0.00 H new ATOM 0 HE1 TYR A 95 38.858 -2.422 22.011 1.00 0.00 H new ATOM 0 HE2 TYR A 95 38.365 -5.902 19.503 1.00 0.00 H new ATOM 0 HH TYR A 95 39.020 -6.012 21.619 1.00 0.00 H new ATOM 1396 N ASP A 96 38.795 -3.041 15.206 1.00 0.00 N ATOM 1397 CA ASP A 96 39.418 -4.067 14.369 1.00 0.00 C ATOM 1398 C ASP A 96 38.426 -4.478 13.280 1.00 0.00 C ATOM 1399 O ASP A 96 38.605 -4.128 12.114 1.00 0.00 O ATOM 1400 CB ASP A 96 39.824 -5.301 15.198 1.00 0.00 C ATOM 1401 CG ASP A 96 40.352 -6.439 14.306 1.00 0.00 C ATOM 1402 OD1 ASP A 96 41.247 -6.193 13.466 1.00 0.00 O ATOM 1403 OD2 ASP A 96 39.918 -7.598 14.484 1.00 0.00 O ATOM 0 H ASP A 96 37.797 -2.937 15.023 1.00 0.00 H new ATOM 0 HA ASP A 96 40.324 -3.655 13.924 1.00 0.00 H new ATOM 0 HB2 ASP A 96 40.591 -5.018 15.919 1.00 0.00 H new ATOM 0 HB3 ASP A 96 38.965 -5.655 15.768 1.00 0.00 H new ATOM 1408 N THR A 97 37.316 -5.107 13.684 1.00 0.00 N ATOM 1409 CA THR A 97 36.275 -5.696 12.846 1.00 0.00 C ATOM 1410 C THR A 97 36.808 -6.623 11.723 1.00 0.00 C ATOM 1411 O THR A 97 38.003 -6.920 11.656 1.00 0.00 O ATOM 1412 CB THR A 97 35.291 -4.593 12.412 1.00 0.00 C ATOM 1413 OG1 THR A 97 35.905 -3.601 11.621 1.00 0.00 O ATOM 1414 CG2 THR A 97 34.626 -3.906 13.614 1.00 0.00 C ATOM 0 H THR A 97 37.111 -5.224 14.676 1.00 0.00 H new ATOM 0 HA THR A 97 35.703 -6.410 13.438 1.00 0.00 H new ATOM 0 HB THR A 97 34.534 -5.106 11.818 1.00 0.00 H new ATOM 0 HG1 THR A 97 36.873 -3.751 11.602 1.00 0.00 H new ATOM 0 HG21 THR A 97 33.941 -3.136 13.260 1.00 0.00 H new ATOM 0 HG22 THR A 97 34.073 -4.644 14.195 1.00 0.00 H new ATOM 0 HG23 THR A 97 35.391 -3.450 14.242 1.00 0.00 H new ATOM 1460 N ALA A 101 30.186 -9.102 9.524 1.00 0.00 N ATOM 1461 CA ALA A 101 28.934 -8.555 10.025 1.00 0.00 C ATOM 1462 C ALA A 101 27.887 -8.269 8.948 1.00 0.00 C ATOM 1463 O ALA A 101 26.696 -8.267 9.257 1.00 0.00 O ATOM 1464 CB ALA A 101 29.209 -7.270 10.808 1.00 0.00 C ATOM 0 HA ALA A 101 28.511 -9.330 10.664 1.00 0.00 H new ATOM 0 HB1 ALA A 101 28.269 -6.863 11.182 1.00 0.00 H new ATOM 0 HB2 ALA A 101 29.869 -7.490 11.648 1.00 0.00 H new ATOM 0 HB3 ALA A 101 29.686 -6.540 10.154 1.00 0.00 H new ATOM 1470 N ILE A 102 28.306 -8.024 7.707 1.00 0.00 N ATOM 1471 CA ILE A 102 27.397 -7.856 6.576 1.00 0.00 C ATOM 1472 C ILE A 102 27.761 -8.882 5.492 1.00 0.00 C ATOM 1473 O ILE A 102 26.870 -9.425 4.841 1.00 0.00 O ATOM 1474 CB ILE A 102 27.405 -6.365 6.133 1.00 0.00 C ATOM 1475 CG1 ILE A 102 26.054 -5.847 5.586 1.00 0.00 C ATOM 1476 CG2 ILE A 102 28.557 -6.010 5.178 1.00 0.00 C ATOM 1477 CD1 ILE A 102 25.342 -6.722 4.554 1.00 0.00 C ATOM 0 H ILE A 102 29.291 -7.936 7.458 1.00 0.00 H new ATOM 0 HA ILE A 102 26.360 -8.067 6.835 1.00 0.00 H new ATOM 0 HB ILE A 102 27.580 -5.833 7.068 1.00 0.00 H new ATOM 0 HG12 ILE A 102 25.380 -5.702 6.430 1.00 0.00 H new ATOM 0 HG13 ILE A 102 26.222 -4.867 5.141 1.00 0.00 H new ATOM 0 HG21 ILE A 102 28.497 -4.954 4.913 1.00 0.00 H new ATOM 0 HG22 ILE A 102 29.510 -6.208 5.668 1.00 0.00 H new ATOM 0 HG23 ILE A 102 28.481 -6.616 4.275 1.00 0.00 H new ATOM 0 HD11 ILE A 102 24.409 -6.245 4.254 1.00 0.00 H new ATOM 0 HD12 ILE A 102 25.982 -6.849 3.681 1.00 0.00 H new ATOM 0 HD13 ILE A 102 25.126 -7.697 4.991 1.00 0.00 H new ATOM 1489 N ASP A 103 29.048 -9.226 5.350 1.00 0.00 N ATOM 1490 CA ASP A 103 29.554 -10.064 4.265 1.00 0.00 C ATOM 1491 C ASP A 103 28.923 -11.457 4.276 1.00 0.00 C ATOM 1492 O ASP A 103 28.600 -11.999 3.220 1.00 0.00 O ATOM 1493 CB ASP A 103 31.077 -10.180 4.348 1.00 0.00 C ATOM 1494 CG ASP A 103 31.626 -11.125 3.266 1.00 0.00 C ATOM 1495 OD1 ASP A 103 31.731 -10.709 2.091 1.00 0.00 O ATOM 1496 OD2 ASP A 103 32.006 -12.270 3.599 1.00 0.00 O ATOM 0 H ASP A 103 29.775 -8.923 5.998 1.00 0.00 H new ATOM 0 HA ASP A 103 29.278 -9.582 3.327 1.00 0.00 H new ATOM 0 HB2 ASP A 103 31.526 -9.193 4.233 1.00 0.00 H new ATOM 0 HB3 ASP A 103 31.363 -10.548 5.334 1.00 0.00 H new ATOM 1501 N LYS A 104 28.691 -12.031 5.460 1.00 0.00 N ATOM 1502 CA LYS A 104 28.059 -13.342 5.571 1.00 0.00 C ATOM 1503 C LYS A 104 26.594 -13.285 5.136 1.00 0.00 C ATOM 1504 O LYS A 104 26.143 -14.168 4.406 1.00 0.00 O ATOM 1505 CB LYS A 104 28.209 -13.847 7.012 1.00 0.00 C ATOM 1506 CG LYS A 104 29.582 -14.500 7.233 1.00 0.00 C ATOM 1507 CD LYS A 104 29.745 -14.990 8.680 1.00 0.00 C ATOM 1508 CE LYS A 104 30.951 -15.926 8.859 1.00 0.00 C ATOM 1509 NZ LYS A 104 32.260 -15.252 8.655 1.00 0.00 N ATOM 0 H LYS A 104 28.933 -11.605 6.355 1.00 0.00 H new ATOM 0 HA LYS A 104 28.554 -14.044 4.900 1.00 0.00 H new ATOM 0 HB2 LYS A 104 28.083 -13.016 7.706 1.00 0.00 H new ATOM 0 HB3 LYS A 104 27.421 -14.568 7.231 1.00 0.00 H new ATOM 0 HG2 LYS A 104 29.702 -15.339 6.548 1.00 0.00 H new ATOM 0 HG3 LYS A 104 30.369 -13.783 6.999 1.00 0.00 H new ATOM 0 HD2 LYS A 104 29.857 -14.130 9.340 1.00 0.00 H new ATOM 0 HD3 LYS A 104 28.838 -15.511 8.987 1.00 0.00 H new ATOM 0 HE2 LYS A 104 30.924 -16.353 9.861 1.00 0.00 H new ATOM 0 HE3 LYS A 104 30.865 -16.755 8.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 33.029 -15.939 8.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 32.306 -14.867 7.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 32.363 -14.478 9.342 1.00 0.00 H new ATOM 1523 N LEU A 105 25.858 -12.245 5.546 1.00 0.00 N ATOM 1524 CA LEU A 105 24.449 -12.091 5.190 1.00 0.00 C ATOM 1525 C LEU A 105 24.323 -11.974 3.676 1.00 0.00 C ATOM 1526 O LEU A 105 23.525 -12.686 3.064 1.00 0.00 O ATOM 1527 CB LEU A 105 23.835 -10.836 5.838 1.00 0.00 C ATOM 1528 CG LEU A 105 23.708 -10.874 7.369 1.00 0.00 C ATOM 1529 CD1 LEU A 105 23.342 -9.474 7.864 1.00 0.00 C ATOM 1530 CD2 LEU A 105 22.625 -11.855 7.831 1.00 0.00 C ATOM 0 H LEU A 105 26.223 -11.493 6.130 1.00 0.00 H new ATOM 0 HA LEU A 105 23.912 -12.966 5.556 1.00 0.00 H new ATOM 0 HB2 LEU A 105 24.442 -9.973 5.563 1.00 0.00 H new ATOM 0 HB3 LEU A 105 22.844 -10.677 5.413 1.00 0.00 H new ATOM 0 HG LEU A 105 24.662 -11.206 7.779 1.00 0.00 H new ATOM 0 HD11 LEU A 105 23.248 -9.485 8.950 1.00 0.00 H new ATOM 0 HD12 LEU A 105 24.122 -8.770 7.574 1.00 0.00 H new ATOM 0 HD13 LEU A 105 22.394 -9.168 7.421 1.00 0.00 H new ATOM 0 HD21 LEU A 105 22.570 -11.850 8.920 1.00 0.00 H new ATOM 0 HD22 LEU A 105 21.662 -11.555 7.417 1.00 0.00 H new ATOM 0 HD23 LEU A 105 22.872 -12.859 7.485 1.00 0.00 H new ATOM 1542 N GLU A 106 25.114 -11.086 3.067 1.00 0.00 N ATOM 1543 CA GLU A 106 25.000 -10.837 1.639 1.00 0.00 C ATOM 1544 C GLU A 106 25.463 -12.052 0.831 1.00 0.00 C ATOM 1545 O GLU A 106 24.919 -12.307 -0.244 1.00 0.00 O ATOM 1546 CB GLU A 106 25.773 -9.568 1.223 1.00 0.00 C ATOM 1547 CG GLU A 106 27.289 -9.687 1.388 1.00 0.00 C ATOM 1548 CD GLU A 106 28.069 -8.483 0.848 1.00 0.00 C ATOM 1549 OE1 GLU A 106 27.933 -7.363 1.385 1.00 0.00 O ATOM 1550 OE2 GLU A 106 28.850 -8.689 -0.110 1.00 0.00 O ATOM 0 H GLU A 106 25.831 -10.536 3.540 1.00 0.00 H new ATOM 0 HA GLU A 106 23.946 -10.667 1.418 1.00 0.00 H new ATOM 0 HB2 GLU A 106 25.547 -9.341 0.181 1.00 0.00 H new ATOM 0 HB3 GLU A 106 25.417 -8.726 1.817 1.00 0.00 H new ATOM 0 HG2 GLU A 106 27.521 -9.813 2.446 1.00 0.00 H new ATOM 0 HG3 GLU A 106 27.631 -10.587 0.877 1.00 0.00 H new ATOM 1557 N ALA A 107 26.451 -12.806 1.331 1.00 0.00 N ATOM 1558 CA ALA A 107 26.965 -13.975 0.640 1.00 0.00 C ATOM 1559 C ALA A 107 25.862 -15.014 0.509 1.00 0.00 C ATOM 1560 O ALA A 107 25.715 -15.604 -0.558 1.00 0.00 O ATOM 1561 CB ALA A 107 28.171 -14.563 1.378 1.00 0.00 C ATOM 0 H ALA A 107 26.909 -12.616 2.223 1.00 0.00 H new ATOM 0 HA ALA A 107 27.298 -13.676 -0.354 1.00 0.00 H new ATOM 0 HB1 ALA A 107 28.536 -15.437 0.839 1.00 0.00 H new ATOM 0 HB2 ALA A 107 28.962 -13.815 1.436 1.00 0.00 H new ATOM 0 HB3 ALA A 107 27.874 -14.855 2.385 1.00 0.00 H new ATOM 1567 N GLU A 108 25.059 -15.224 1.555 1.00 0.00 N ATOM 1568 CA GLU A 108 23.979 -16.194 1.477 1.00 0.00 C ATOM 1569 C GLU A 108 22.805 -15.687 0.641 1.00 0.00 C ATOM 1570 O GLU A 108 22.158 -16.506 -0.014 1.00 0.00 O ATOM 1571 CB GLU A 108 23.545 -16.673 2.865 1.00 0.00 C ATOM 1572 CG GLU A 108 24.577 -17.622 3.495 1.00 0.00 C ATOM 1573 CD GLU A 108 24.902 -18.872 2.646 1.00 0.00 C ATOM 1574 OE1 GLU A 108 24.035 -19.363 1.887 1.00 0.00 O ATOM 1575 OE2 GLU A 108 26.051 -19.363 2.726 1.00 0.00 O ATOM 0 H GLU A 108 25.138 -14.741 2.450 1.00 0.00 H new ATOM 0 HA GLU A 108 24.371 -17.065 0.953 1.00 0.00 H new ATOM 0 HB2 GLU A 108 23.399 -15.812 3.517 1.00 0.00 H new ATOM 0 HB3 GLU A 108 22.584 -17.181 2.789 1.00 0.00 H new ATOM 0 HG2 GLU A 108 25.499 -17.069 3.672 1.00 0.00 H new ATOM 0 HG3 GLU A 108 24.208 -17.946 4.468 1.00 0.00 H new ATOM 1582 N LEU A 109 22.547 -14.374 0.568 1.00 0.00 N ATOM 1583 CA LEU A 109 21.567 -13.857 -0.396 1.00 0.00 C ATOM 1584 C LEU A 109 22.048 -14.158 -1.812 1.00 0.00 C ATOM 1585 O LEU A 109 21.282 -14.674 -2.628 1.00 0.00 O ATOM 1586 CB LEU A 109 21.336 -12.339 -0.255 1.00 0.00 C ATOM 1587 CG LEU A 109 20.418 -11.912 0.900 1.00 0.00 C ATOM 1588 CD1 LEU A 109 20.474 -10.386 1.054 1.00 0.00 C ATOM 1589 CD2 LEU A 109 18.965 -12.331 0.624 1.00 0.00 C ATOM 0 H LEU A 109 22.992 -13.665 1.151 1.00 0.00 H new ATOM 0 HA LEU A 109 20.618 -14.353 -0.190 1.00 0.00 H new ATOM 0 HB2 LEU A 109 22.303 -11.853 -0.126 1.00 0.00 H new ATOM 0 HB3 LEU A 109 20.914 -11.966 -1.188 1.00 0.00 H new ATOM 0 HG LEU A 109 20.760 -12.399 1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 109 19.824 -10.079 1.873 1.00 0.00 H new ATOM 0 HD12 LEU A 109 21.498 -10.079 1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 109 20.141 -9.915 0.130 1.00 0.00 H new ATOM 0 HD21 LEU A 109 18.332 -12.019 1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 109 18.618 -11.858 -0.294 1.00 0.00 H new ATOM 0 HD23 LEU A 109 18.913 -13.414 0.516 1.00 0.00 H new ATOM 1601 N LYS A 110 23.316 -13.862 -2.112 1.00 0.00 N ATOM 1602 CA LYS A 110 23.873 -14.067 -3.446 1.00 0.00 C ATOM 1603 C LYS A 110 23.931 -15.552 -3.787 1.00 0.00 C ATOM 1604 O LYS A 110 23.639 -15.931 -4.919 1.00 0.00 O ATOM 1605 CB LYS A 110 25.241 -13.375 -3.565 1.00 0.00 C ATOM 1606 CG LYS A 110 25.061 -11.856 -3.726 1.00 0.00 C ATOM 1607 CD LYS A 110 26.368 -11.049 -3.812 1.00 0.00 C ATOM 1608 CE LYS A 110 27.038 -10.831 -2.444 1.00 0.00 C ATOM 1609 NZ LYS A 110 28.131 -9.825 -2.509 1.00 0.00 N ATOM 0 H LYS A 110 23.979 -13.476 -1.440 1.00 0.00 H new ATOM 0 HA LYS A 110 23.216 -13.606 -4.183 1.00 0.00 H new ATOM 0 HB2 LYS A 110 25.840 -13.585 -2.679 1.00 0.00 H new ATOM 0 HB3 LYS A 110 25.785 -13.776 -4.420 1.00 0.00 H new ATOM 0 HG2 LYS A 110 24.477 -11.669 -4.627 1.00 0.00 H new ATOM 0 HG3 LYS A 110 24.477 -11.484 -2.884 1.00 0.00 H new ATOM 0 HD2 LYS A 110 27.064 -11.567 -4.472 1.00 0.00 H new ATOM 0 HD3 LYS A 110 26.160 -10.080 -4.266 1.00 0.00 H new ATOM 0 HE2 LYS A 110 26.289 -10.505 -1.722 1.00 0.00 H new ATOM 0 HE3 LYS A 110 27.439 -11.778 -2.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 28.565 -9.723 -1.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 28.851 -10.138 -3.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 27.742 -8.909 -2.812 1.00 0.00 H new ATOM 1623 N ASN A 111 24.228 -16.403 -2.806 1.00 0.00 N ATOM 1624 CA ASN A 111 24.173 -17.855 -2.964 1.00 0.00 C ATOM 1625 C ASN A 111 22.741 -18.314 -3.257 1.00 0.00 C ATOM 1626 O ASN A 111 22.527 -19.172 -4.111 1.00 0.00 O ATOM 1627 CB ASN A 111 24.695 -18.537 -1.687 1.00 0.00 C ATOM 1628 CG ASN A 111 24.578 -20.059 -1.718 1.00 0.00 C ATOM 1629 OD1 ASN A 111 24.832 -20.702 -2.732 1.00 0.00 O ATOM 1630 ND2 ASN A 111 24.207 -20.670 -0.604 1.00 0.00 N ATOM 0 H ASN A 111 24.515 -16.103 -1.874 1.00 0.00 H new ATOM 0 HA ASN A 111 24.803 -18.138 -3.807 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.740 -18.264 -1.540 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.142 -18.155 -0.829 1.00 0.00 H new ATOM 0 HD21 ASN A 111 24.129 -21.687 -0.582 1.00 0.00 H new ATOM 0 HD22 ASN A 111 23.999 -20.124 0.232 1.00 0.00 H new ATOM 1637 N SER A 112 21.752 -17.689 -2.612 1.00 0.00 N ATOM 1638 CA SER A 112 20.331 -17.877 -2.889 1.00 0.00 C ATOM 1639 C SER A 112 19.888 -17.186 -4.193 1.00 0.00 C ATOM 1640 O SER A 112 18.689 -17.059 -4.432 1.00 0.00 O ATOM 1641 CB SER A 112 19.504 -17.393 -1.688 1.00 0.00 C ATOM 1642 OG SER A 112 19.951 -17.998 -0.488 1.00 0.00 O ATOM 0 H SER A 112 21.926 -17.020 -1.862 1.00 0.00 H new ATOM 0 HA SER A 112 20.155 -18.942 -3.038 1.00 0.00 H new ATOM 0 HB2 SER A 112 19.579 -16.309 -1.603 1.00 0.00 H new ATOM 0 HB3 SER A 112 18.452 -17.628 -1.848 1.00 0.00 H new ATOM 0 HG SER A 112 20.681 -17.468 -0.107 1.00 0.00 H new ATOM 1648 N GLY A 113 20.808 -16.716 -5.041 1.00 0.00 N ATOM 1649 CA GLY A 113 20.516 -16.239 -6.386 1.00 0.00 C ATOM 1650 C GLY A 113 20.155 -14.754 -6.451 1.00 0.00 C ATOM 1651 O GLY A 113 19.982 -14.230 -7.553 1.00 0.00 O ATOM 0 H GLY A 113 21.798 -16.657 -4.801 1.00 0.00 H new ATOM 0 HA2 GLY A 113 21.383 -16.421 -7.022 1.00 0.00 H new ATOM 0 HA3 GLY A 113 19.692 -16.822 -6.797 1.00 0.00 H new ATOM 1655 N ALA A 114 20.027 -14.067 -5.310 1.00 0.00 N ATOM 1656 CA ALA A 114 19.899 -12.613 -5.279 1.00 0.00 C ATOM 1657 C ALA A 114 21.155 -11.961 -5.869 1.00 0.00 C ATOM 1658 O ALA A 114 22.185 -12.625 -6.013 1.00 0.00 O ATOM 1659 CB ALA A 114 19.752 -12.160 -3.825 1.00 0.00 C ATOM 0 H ALA A 114 20.010 -14.504 -4.389 1.00 0.00 H new ATOM 0 HA ALA A 114 19.028 -12.318 -5.864 1.00 0.00 H new ATOM 0 HB1 ALA A 114 19.656 -11.075 -3.790 1.00 0.00 H new ATOM 0 HB2 ALA A 114 18.864 -12.617 -3.389 1.00 0.00 H new ATOM 0 HB3 ALA A 114 20.632 -12.465 -3.258 1.00 0.00 H new ATOM 1665 N LYS A 115 21.127 -10.648 -6.120 1.00 0.00 N ATOM 1666 CA LYS A 115 22.344 -9.911 -6.465 1.00 0.00 C ATOM 1667 C LYS A 115 22.344 -8.533 -5.827 1.00 0.00 C ATOM 1668 O LYS A 115 21.323 -7.842 -5.796 1.00 0.00 O ATOM 1669 CB LYS A 115 22.561 -9.825 -7.986 1.00 0.00 C ATOM 1670 CG LYS A 115 23.131 -11.139 -8.560 1.00 0.00 C ATOM 1671 CD LYS A 115 23.755 -10.953 -9.951 1.00 0.00 C ATOM 1672 CE LYS A 115 25.065 -10.146 -9.878 1.00 0.00 C ATOM 1673 NZ LYS A 115 25.711 -10.008 -11.207 1.00 0.00 N ATOM 0 H LYS A 115 20.281 -10.079 -6.091 1.00 0.00 H new ATOM 0 HA LYS A 115 23.186 -10.472 -6.059 1.00 0.00 H new ATOM 0 HB2 LYS A 115 21.615 -9.595 -8.476 1.00 0.00 H new ATOM 0 HB3 LYS A 115 23.243 -9.005 -8.210 1.00 0.00 H new ATOM 0 HG2 LYS A 115 23.884 -11.533 -7.878 1.00 0.00 H new ATOM 0 HG3 LYS A 115 22.335 -11.881 -8.619 1.00 0.00 H new ATOM 0 HD2 LYS A 115 23.951 -11.928 -10.396 1.00 0.00 H new ATOM 0 HD3 LYS A 115 23.047 -10.442 -10.603 1.00 0.00 H new ATOM 0 HE2 LYS A 115 24.858 -9.156 -9.472 1.00 0.00 H new ATOM 0 HE3 LYS A 115 25.754 -10.636 -9.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 26.589 -9.458 -11.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 25.933 -10.951 -11.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 25.065 -9.518 -11.858 1.00 0.00 H new ATOM 1687 N GLN A 116 23.521 -8.147 -5.345 1.00 0.00 N ATOM 1688 CA GLN A 116 23.803 -6.838 -4.781 1.00 0.00 C ATOM 1689 C GLN A 116 23.665 -5.768 -5.876 1.00 0.00 C ATOM 1690 O GLN A 116 23.562 -6.075 -7.067 1.00 0.00 O ATOM 1691 CB GLN A 116 25.222 -6.905 -4.183 1.00 0.00 C ATOM 1692 CG GLN A 116 25.581 -5.787 -3.186 1.00 0.00 C ATOM 1693 CD GLN A 116 26.970 -5.967 -2.567 1.00 0.00 C ATOM 1694 OE1 GLN A 116 27.594 -7.023 -2.673 1.00 0.00 O ATOM 1695 NE2 GLN A 116 27.474 -4.927 -1.922 1.00 0.00 N ATOM 0 H GLN A 116 24.334 -8.763 -5.338 1.00 0.00 H new ATOM 0 HA GLN A 116 23.100 -6.564 -3.994 1.00 0.00 H new ATOM 0 HB2 GLN A 116 25.340 -7.865 -3.681 1.00 0.00 H new ATOM 0 HB3 GLN A 116 25.942 -6.882 -5.001 1.00 0.00 H new ATOM 0 HG2 GLN A 116 25.537 -4.824 -3.695 1.00 0.00 H new ATOM 0 HG3 GLN A 116 24.835 -5.761 -2.392 1.00 0.00 H new ATOM 0 HE21 GLN A 116 26.937 -4.063 -1.848 1.00 0.00 H new ATOM 0 HE22 GLN A 116 28.400 -4.989 -1.499 1.00 0.00 H new ATOM 1704 N THR A 117 23.703 -4.503 -5.475 1.00 0.00 N ATOM 1705 CA THR A 117 23.585 -3.326 -6.320 1.00 0.00 C ATOM 1706 C THR A 117 24.597 -2.314 -5.770 1.00 0.00 C ATOM 1707 O THR A 117 24.887 -2.329 -4.569 1.00 0.00 O ATOM 1708 CB THR A 117 22.140 -2.779 -6.230 1.00 0.00 C ATOM 1709 OG1 THR A 117 21.191 -3.829 -6.156 1.00 0.00 O ATOM 1710 CG2 THR A 117 21.765 -1.881 -7.415 1.00 0.00 C ATOM 0 H THR A 117 23.824 -4.259 -4.492 1.00 0.00 H new ATOM 0 HA THR A 117 23.787 -3.540 -7.369 1.00 0.00 H new ATOM 0 HB THR A 117 22.117 -2.183 -5.318 1.00 0.00 H new ATOM 0 HG1 THR A 117 21.202 -4.217 -5.256 1.00 0.00 H new ATOM 0 HG21 THR A 117 20.741 -1.529 -7.295 1.00 0.00 H new ATOM 0 HG22 THR A 117 22.441 -1.026 -7.452 1.00 0.00 H new ATOM 0 HG23 THR A 117 21.847 -2.449 -8.342 1.00 0.00 H new ATOM 1718 N GLY A 118 25.103 -1.416 -6.615 1.00 0.00 N ATOM 1719 CA GLY A 118 26.064 -0.397 -6.209 1.00 0.00 C ATOM 1720 C GLY A 118 27.353 -1.075 -5.737 1.00 0.00 C ATOM 1721 O GLY A 118 27.851 -1.995 -6.394 1.00 0.00 O ATOM 0 H GLY A 118 24.855 -1.377 -7.604 1.00 0.00 H new ATOM 0 HA2 GLY A 118 26.276 0.272 -7.043 1.00 0.00 H new ATOM 0 HA3 GLY A 118 25.647 0.214 -5.408 1.00 0.00 H new ATOM 1725 N GLU A 119 27.877 -0.647 -4.590 1.00 0.00 N ATOM 1726 CA GLU A 119 28.995 -1.252 -3.890 1.00 0.00 C ATOM 1727 C GLU A 119 28.702 -1.109 -2.391 1.00 0.00 C ATOM 1728 O GLU A 119 27.943 -0.222 -1.993 1.00 0.00 O ATOM 1729 CB GLU A 119 30.284 -0.534 -4.317 1.00 0.00 C ATOM 1730 CG GLU A 119 31.523 -1.091 -3.617 1.00 0.00 C ATOM 1731 CD GLU A 119 32.826 -0.565 -4.248 1.00 0.00 C ATOM 1732 OE1 GLU A 119 33.338 0.491 -3.815 1.00 0.00 O ATOM 1733 OE2 GLU A 119 33.365 -1.216 -5.173 1.00 0.00 O ATOM 0 H GLU A 119 27.511 0.172 -4.104 1.00 0.00 H new ATOM 0 HA GLU A 119 29.127 -2.308 -4.124 1.00 0.00 H new ATOM 0 HB2 GLU A 119 30.408 -0.627 -5.396 1.00 0.00 H new ATOM 0 HB3 GLU A 119 30.194 0.530 -4.097 1.00 0.00 H new ATOM 0 HG2 GLU A 119 31.496 -0.820 -2.562 1.00 0.00 H new ATOM 0 HG3 GLU A 119 31.509 -2.180 -3.667 1.00 0.00 H new ATOM 1740 N THR A 120 29.265 -1.986 -1.563 1.00 0.00 N ATOM 1741 CA THR A 120 29.036 -2.015 -0.123 1.00 0.00 C ATOM 1742 C THR A 120 29.535 -0.711 0.513 1.00 0.00 C ATOM 1743 O THR A 120 30.687 -0.319 0.304 1.00 0.00 O ATOM 1744 CB THR A 120 29.767 -3.228 0.486 1.00 0.00 C ATOM 1745 OG1 THR A 120 29.894 -4.286 -0.458 1.00 0.00 O ATOM 1746 CG2 THR A 120 29.031 -3.763 1.714 1.00 0.00 C ATOM 0 H THR A 120 29.907 -2.711 -1.883 1.00 0.00 H new ATOM 0 HA THR A 120 27.968 -2.108 0.076 1.00 0.00 H new ATOM 0 HB THR A 120 30.757 -2.878 0.777 1.00 0.00 H new ATOM 0 HG1 THR A 120 30.363 -5.040 -0.043 1.00 0.00 H new ATOM 0 HG21 THR A 120 29.573 -4.618 2.119 1.00 0.00 H new ATOM 0 HG22 THR A 120 28.969 -2.981 2.471 1.00 0.00 H new ATOM 0 HG23 THR A 120 28.025 -4.073 1.429 1.00 0.00 H new ATOM 1754 N LEU A 121 28.698 -0.066 1.326 1.00 0.00 N ATOM 1755 CA LEU A 121 29.065 1.123 2.095 1.00 0.00 C ATOM 1756 C LEU A 121 29.575 0.667 3.464 1.00 0.00 C ATOM 1757 O LEU A 121 29.036 -0.277 4.041 1.00 0.00 O ATOM 1758 CB LEU A 121 27.836 2.040 2.219 1.00 0.00 C ATOM 1759 CG LEU A 121 28.009 3.304 3.086 1.00 0.00 C ATOM 1760 CD1 LEU A 121 29.138 4.228 2.621 1.00 0.00 C ATOM 1761 CD2 LEU A 121 26.702 4.106 3.068 1.00 0.00 C ATOM 0 H LEU A 121 27.732 -0.359 1.471 1.00 0.00 H new ATOM 0 HA LEU A 121 29.854 1.690 1.600 1.00 0.00 H new ATOM 0 HB2 LEU A 121 27.539 2.351 1.217 1.00 0.00 H new ATOM 0 HB3 LEU A 121 27.013 1.455 2.629 1.00 0.00 H new ATOM 0 HG LEU A 121 28.268 2.954 4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 121 29.195 5.093 3.281 1.00 0.00 H new ATOM 0 HD12 LEU A 121 30.084 3.688 2.648 1.00 0.00 H new ATOM 0 HD13 LEU A 121 28.939 4.562 1.603 1.00 0.00 H new ATOM 0 HD21 LEU A 121 26.816 5.001 3.679 1.00 0.00 H new ATOM 0 HD22 LEU A 121 26.466 4.393 2.043 1.00 0.00 H new ATOM 0 HD23 LEU A 121 25.894 3.494 3.469 1.00 0.00 H new ATOM 1773 N LYS A 122 30.597 1.333 4.005 1.00 0.00 N ATOM 1774 CA LYS A 122 31.129 1.065 5.341 1.00 0.00 C ATOM 1775 C LYS A 122 31.204 2.407 6.060 1.00 0.00 C ATOM 1776 O LYS A 122 31.585 3.400 5.437 1.00 0.00 O ATOM 1777 CB LYS A 122 32.527 0.417 5.284 1.00 0.00 C ATOM 1778 CG LYS A 122 32.600 -1.025 4.738 1.00 0.00 C ATOM 1779 CD LYS A 122 32.507 -1.223 3.214 1.00 0.00 C ATOM 1780 CE LYS A 122 33.503 -0.353 2.430 1.00 0.00 C ATOM 1781 NZ LYS A 122 33.426 -0.585 0.966 1.00 0.00 N ATOM 0 H LYS A 122 31.085 2.085 3.519 1.00 0.00 H new ATOM 0 HA LYS A 122 30.481 0.362 5.864 1.00 0.00 H new ATOM 0 HB2 LYS A 122 33.169 1.047 4.669 1.00 0.00 H new ATOM 0 HB3 LYS A 122 32.946 0.422 6.290 1.00 0.00 H new ATOM 0 HG2 LYS A 122 33.539 -1.463 5.076 1.00 0.00 H new ATOM 0 HG3 LYS A 122 31.796 -1.599 5.200 1.00 0.00 H new ATOM 0 HD2 LYS A 122 32.687 -2.272 2.978 1.00 0.00 H new ATOM 0 HD3 LYS A 122 31.494 -0.991 2.885 1.00 0.00 H new ATOM 0 HE2 LYS A 122 33.306 0.698 2.639 1.00 0.00 H new ATOM 0 HE3 LYS A 122 34.515 -0.563 2.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 34.015 0.116 0.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 33.770 -1.542 0.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 32.439 -0.491 0.651 1.00 0.00 H new ATOM 1795 N ILE A 123 30.850 2.448 7.343 1.00 0.00 N ATOM 1796 CA ILE A 123 30.768 3.677 8.122 1.00 0.00 C ATOM 1797 C ILE A 123 31.350 3.377 9.506 1.00 0.00 C ATOM 1798 O ILE A 123 30.700 2.753 10.347 1.00 0.00 O ATOM 1799 CB ILE A 123 29.307 4.200 8.195 1.00 0.00 C ATOM 1800 CG1 ILE A 123 28.545 4.136 6.847 1.00 0.00 C ATOM 1801 CG2 ILE A 123 29.305 5.643 8.736 1.00 0.00 C ATOM 1802 CD1 ILE A 123 27.119 4.697 6.904 1.00 0.00 C ATOM 0 H ILE A 123 30.609 1.613 7.877 1.00 0.00 H new ATOM 0 HA ILE A 123 31.340 4.475 7.649 1.00 0.00 H new ATOM 0 HB ILE A 123 28.772 3.533 8.871 1.00 0.00 H new ATOM 0 HG12 ILE A 123 29.111 4.688 6.096 1.00 0.00 H new ATOM 0 HG13 ILE A 123 28.502 3.099 6.515 1.00 0.00 H new ATOM 0 HG21 ILE A 123 28.280 6.011 8.788 1.00 0.00 H new ATOM 0 HG22 ILE A 123 29.747 5.659 9.732 1.00 0.00 H new ATOM 0 HG23 ILE A 123 29.887 6.282 8.071 1.00 0.00 H new ATOM 0 HD11 ILE A 123 26.656 4.615 5.921 1.00 0.00 H new ATOM 0 HD12 ILE A 123 26.534 4.131 7.629 1.00 0.00 H new ATOM 0 HD13 ILE A 123 27.152 5.745 7.203 1.00 0.00 H new ATOM 1814 N ASN A 124 32.603 3.768 9.744 1.00 0.00 N ATOM 1815 CA ASN A 124 33.160 3.735 11.094 1.00 0.00 C ATOM 1816 C ASN A 124 32.519 4.886 11.871 1.00 0.00 C ATOM 1817 O ASN A 124 32.473 6.004 11.360 1.00 0.00 O ATOM 1818 CB ASN A 124 34.682 3.918 11.061 1.00 0.00 C ATOM 1819 CG ASN A 124 35.273 4.026 12.465 1.00 0.00 C ATOM 1820 OD1 ASN A 124 34.812 3.392 13.414 1.00 0.00 O ATOM 1821 ND2 ASN A 124 36.291 4.843 12.619 1.00 0.00 N ATOM 0 H ASN A 124 33.244 4.107 9.027 1.00 0.00 H new ATOM 0 HA ASN A 124 32.953 2.774 11.564 1.00 0.00 H new ATOM 0 HB2 ASN A 124 35.138 3.077 10.539 1.00 0.00 H new ATOM 0 HB3 ASN A 124 34.928 4.816 10.494 1.00 0.00 H new ATOM 0 HD21 ASN A 124 36.715 4.962 13.539 1.00 0.00 H new ATOM 0 HD22 ASN A 124 36.657 5.358 11.818 1.00 0.00 H new ATOM 1828 N ILE A 125 32.046 4.651 13.094 1.00 0.00 N ATOM 1829 CA ILE A 125 31.364 5.660 13.894 1.00 0.00 C ATOM 1830 C ILE A 125 31.949 5.785 15.305 1.00 0.00 C ATOM 1831 O ILE A 125 31.390 6.525 16.115 1.00 0.00 O ATOM 1832 CB ILE A 125 29.836 5.412 13.866 1.00 0.00 C ATOM 1833 CG1 ILE A 125 29.330 4.024 14.319 1.00 0.00 C ATOM 1834 CG2 ILE A 125 29.298 5.666 12.447 1.00 0.00 C ATOM 1835 CD1 ILE A 125 29.704 3.615 15.748 1.00 0.00 C ATOM 0 H ILE A 125 32.127 3.747 13.559 1.00 0.00 H new ATOM 0 HA ILE A 125 31.538 6.638 13.446 1.00 0.00 H new ATOM 0 HB ILE A 125 29.458 6.111 14.612 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.244 4.006 14.228 1.00 0.00 H new ATOM 0 HG13 ILE A 125 29.720 3.273 13.632 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.222 5.491 12.429 1.00 0.00 H new ATOM 0 HG22 ILE A 125 29.503 6.697 12.159 1.00 0.00 H new ATOM 0 HG23 ILE A 125 29.787 4.990 11.746 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.299 2.626 15.961 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.789 3.592 15.848 1.00 0.00 H new ATOM 0 HD13 ILE A 125 29.290 4.336 16.453 1.00 0.00 H new ATOM 1847 N LEU A 126 33.078 5.120 15.602 1.00 0.00 N ATOM 1848 CA LEU A 126 33.690 5.156 16.936 1.00 0.00 C ATOM 1849 C LEU A 126 33.976 6.596 17.390 1.00 0.00 C ATOM 1850 O LEU A 126 33.855 6.906 18.575 1.00 0.00 O ATOM 1851 CB LEU A 126 34.974 4.306 16.956 1.00 0.00 C ATOM 1852 CG LEU A 126 35.599 4.148 18.360 1.00 0.00 C ATOM 1853 CD1 LEU A 126 34.662 3.434 19.344 1.00 0.00 C ATOM 1854 CD2 LEU A 126 36.904 3.355 18.256 1.00 0.00 C ATOM 0 H LEU A 126 33.587 4.547 14.928 1.00 0.00 H new ATOM 0 HA LEU A 126 32.979 4.731 17.644 1.00 0.00 H new ATOM 0 HB2 LEU A 126 34.750 3.317 16.556 1.00 0.00 H new ATOM 0 HB3 LEU A 126 35.709 4.760 16.291 1.00 0.00 H new ATOM 0 HG LEU A 126 35.784 5.152 18.742 1.00 0.00 H new ATOM 0 HD11 LEU A 126 35.150 3.349 20.315 1.00 0.00 H new ATOM 0 HD12 LEU A 126 33.741 4.007 19.450 1.00 0.00 H new ATOM 0 HD13 LEU A 126 34.429 2.438 18.967 1.00 0.00 H new ATOM 0 HD21 LEU A 126 37.343 3.245 19.248 1.00 0.00 H new ATOM 0 HD22 LEU A 126 36.698 2.369 17.839 1.00 0.00 H new ATOM 0 HD23 LEU A 126 37.601 3.885 17.607 1.00 0.00 H new ATOM 1981 N ALA A 135 27.017 9.569 2.830 1.00 0.00 N ATOM 1982 CA ALA A 135 25.939 8.590 2.729 1.00 0.00 C ATOM 1983 C ALA A 135 24.919 9.013 1.669 1.00 0.00 C ATOM 1984 O ALA A 135 24.424 8.166 0.935 1.00 0.00 O ATOM 1985 CB ALA A 135 25.242 8.427 4.087 1.00 0.00 C ATOM 0 HA ALA A 135 26.373 7.635 2.432 1.00 0.00 H new ATOM 0 HB1 ALA A 135 24.440 7.694 3.999 1.00 0.00 H new ATOM 0 HB2 ALA A 135 25.965 8.086 4.828 1.00 0.00 H new ATOM 0 HB3 ALA A 135 24.826 9.385 4.400 1.00 0.00 H new ATOM 1991 N GLU A 136 24.634 10.315 1.560 1.00 0.00 N ATOM 1992 CA GLU A 136 23.669 10.845 0.601 1.00 0.00 C ATOM 1993 C GLU A 136 24.123 10.609 -0.844 1.00 0.00 C ATOM 1994 O GLU A 136 23.289 10.363 -1.713 1.00 0.00 O ATOM 1995 CB GLU A 136 23.461 12.349 0.839 1.00 0.00 C ATOM 1996 CG GLU A 136 22.931 12.661 2.246 1.00 0.00 C ATOM 1997 CD GLU A 136 22.604 14.153 2.400 1.00 0.00 C ATOM 1998 OE1 GLU A 136 23.529 14.972 2.606 1.00 0.00 O ATOM 1999 OE2 GLU A 136 21.406 14.511 2.349 1.00 0.00 O ATOM 0 H GLU A 136 25.071 11.032 2.140 1.00 0.00 H new ATOM 0 HA GLU A 136 22.728 10.316 0.751 1.00 0.00 H new ATOM 0 HB2 GLU A 136 24.406 12.870 0.688 1.00 0.00 H new ATOM 0 HB3 GLU A 136 22.762 12.736 0.098 1.00 0.00 H new ATOM 0 HG2 GLU A 136 22.037 12.069 2.440 1.00 0.00 H new ATOM 0 HG3 GLU A 136 23.673 12.370 2.989 1.00 0.00 H new ATOM 2006 N GLU A 137 25.431 10.653 -1.115 1.00 0.00 N ATOM 2007 CA GLU A 137 25.965 10.458 -2.461 1.00 0.00 C ATOM 2008 C GLU A 137 26.005 8.965 -2.790 1.00 0.00 C ATOM 2009 O GLU A 137 25.704 8.569 -3.919 1.00 0.00 O ATOM 2010 CB GLU A 137 27.370 11.076 -2.569 1.00 0.00 C ATOM 2011 CG GLU A 137 27.387 12.604 -2.398 1.00 0.00 C ATOM 2012 CD GLU A 137 26.577 13.334 -3.486 1.00 0.00 C ATOM 2013 OE1 GLU A 137 27.037 13.410 -4.648 1.00 0.00 O ATOM 2014 OE2 GLU A 137 25.483 13.863 -3.187 1.00 0.00 O ATOM 0 H GLU A 137 26.146 10.825 -0.408 1.00 0.00 H new ATOM 0 HA GLU A 137 25.316 10.957 -3.180 1.00 0.00 H new ATOM 0 HB2 GLU A 137 28.014 10.627 -1.813 1.00 0.00 H new ATOM 0 HB3 GLU A 137 27.795 10.823 -3.540 1.00 0.00 H new ATOM 0 HG2 GLU A 137 26.984 12.860 -1.418 1.00 0.00 H new ATOM 0 HG3 GLU A 137 28.418 12.956 -2.421 1.00 0.00 H new ATOM 2021 N TRP A 138 26.313 8.117 -1.807 1.00 0.00 N ATOM 2022 CA TRP A 138 26.278 6.671 -1.982 1.00 0.00 C ATOM 2023 C TRP A 138 24.832 6.202 -2.200 1.00 0.00 C ATOM 2024 O TRP A 138 24.563 5.370 -3.066 1.00 0.00 O ATOM 2025 CB TRP A 138 26.932 5.997 -0.767 1.00 0.00 C ATOM 2026 CG TRP A 138 27.624 4.702 -1.063 1.00 0.00 C ATOM 2027 CD1 TRP A 138 27.021 3.542 -1.403 1.00 0.00 C ATOM 2028 CD2 TRP A 138 29.058 4.412 -1.059 1.00 0.00 C ATOM 2029 NE1 TRP A 138 27.967 2.555 -1.568 1.00 0.00 N ATOM 2030 CE2 TRP A 138 29.243 3.033 -1.374 1.00 0.00 C ATOM 2031 CE3 TRP A 138 30.223 5.170 -0.803 1.00 0.00 C ATOM 2032 CZ2 TRP A 138 30.512 2.439 -1.429 1.00 0.00 C ATOM 2033 CZ3 TRP A 138 31.502 4.583 -0.853 1.00 0.00 C ATOM 2034 CH2 TRP A 138 31.649 3.220 -1.164 1.00 0.00 C ATOM 0 H TRP A 138 26.592 8.415 -0.872 1.00 0.00 H new ATOM 0 HA TRP A 138 26.844 6.385 -2.868 1.00 0.00 H new ATOM 0 HB2 TRP A 138 27.654 6.687 -0.332 1.00 0.00 H new ATOM 0 HB3 TRP A 138 26.166 5.819 -0.012 1.00 0.00 H new ATOM 0 HD1 TRP A 138 25.956 3.409 -1.527 1.00 0.00 H new ATOM 0 HE1 TRP A 138 27.749 1.587 -1.805 1.00 0.00 H new ATOM 0 HE3 TRP A 138 30.131 6.219 -0.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 138 30.614 1.392 -1.673 1.00 0.00 H new ATOM 0 HZ3 TRP A 138 32.376 5.184 -0.651 1.00 0.00 H new ATOM 0 HH2 TRP A 138 32.632 2.775 -1.199 1.00 0.00 H new ATOM 2045 N LEU A 139 23.882 6.785 -1.465 1.00 0.00 N ATOM 2046 CA LEU A 139 22.453 6.550 -1.626 1.00 0.00 C ATOM 2047 C LEU A 139 21.978 7.044 -2.992 1.00 0.00 C ATOM 2048 O LEU A 139 21.229 6.342 -3.669 1.00 0.00 O ATOM 2049 CB LEU A 139 21.710 7.267 -0.489 1.00 0.00 C ATOM 2050 CG LEU A 139 20.203 6.973 -0.440 1.00 0.00 C ATOM 2051 CD1 LEU A 139 19.948 5.488 -0.140 1.00 0.00 C ATOM 2052 CD2 LEU A 139 19.577 7.862 0.641 1.00 0.00 C ATOM 0 H LEU A 139 24.096 7.451 -0.722 1.00 0.00 H new ATOM 0 HA LEU A 139 22.244 5.481 -1.578 1.00 0.00 H new ATOM 0 HB2 LEU A 139 22.157 6.977 0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 139 21.856 8.342 -0.595 1.00 0.00 H new ATOM 0 HG LEU A 139 19.750 7.191 -1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 139 18.874 5.302 -0.110 1.00 0.00 H new ATOM 0 HD12 LEU A 139 20.400 4.876 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU A 139 20.388 5.231 0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 139 18.505 7.670 0.694 1.00 0.00 H new ATOM 0 HD22 LEU A 139 20.034 7.639 1.605 1.00 0.00 H new ATOM 0 HD23 LEU A 139 19.746 8.910 0.393 1.00 0.00 H new ATOM 2064 N GLY A 140 22.451 8.220 -3.418 1.00 0.00 N ATOM 2065 CA GLY A 140 22.230 8.762 -4.751 1.00 0.00 C ATOM 2066 C GLY A 140 22.695 7.781 -5.824 1.00 0.00 C ATOM 2067 O GLY A 140 21.981 7.528 -6.796 1.00 0.00 O ATOM 0 H GLY A 140 23.012 8.832 -2.825 1.00 0.00 H new ATOM 0 HA2 GLY A 140 21.171 8.981 -4.888 1.00 0.00 H new ATOM 0 HA3 GLY A 140 22.767 9.705 -4.858 1.00 0.00 H new ATOM 2071 N SER A 141 23.869 7.183 -5.625 1.00 0.00 N ATOM 2072 CA SER A 141 24.418 6.183 -6.526 1.00 0.00 C ATOM 2073 C SER A 141 23.525 4.935 -6.555 1.00 0.00 C ATOM 2074 O SER A 141 23.258 4.413 -7.638 1.00 0.00 O ATOM 2075 CB SER A 141 25.861 5.853 -6.121 1.00 0.00 C ATOM 2076 OG SER A 141 26.651 7.031 -6.028 1.00 0.00 O ATOM 0 H SER A 141 24.468 7.385 -4.824 1.00 0.00 H new ATOM 0 HA SER A 141 24.441 6.582 -7.540 1.00 0.00 H new ATOM 0 HB2 SER A 141 25.863 5.334 -5.162 1.00 0.00 H new ATOM 0 HB3 SER A 141 26.300 5.174 -6.852 1.00 0.00 H new ATOM 0 HG SER A 141 26.379 7.546 -5.240 1.00 0.00 H new ATOM 2082 N TRP A 142 23.005 4.488 -5.404 1.00 0.00 N ATOM 2083 CA TRP A 142 22.080 3.361 -5.355 1.00 0.00 C ATOM 2084 C TRP A 142 20.809 3.649 -6.148 1.00 0.00 C ATOM 2085 O TRP A 142 20.471 2.843 -7.019 1.00 0.00 O ATOM 2086 CB TRP A 142 21.757 2.934 -3.910 1.00 0.00 C ATOM 2087 CG TRP A 142 22.602 1.814 -3.381 1.00 0.00 C ATOM 2088 CD1 TRP A 142 22.838 0.654 -4.034 1.00 0.00 C ATOM 2089 CD2 TRP A 142 23.317 1.700 -2.109 1.00 0.00 C ATOM 2090 NE1 TRP A 142 23.686 -0.137 -3.292 1.00 0.00 N ATOM 2091 CE2 TRP A 142 24.034 0.464 -2.108 1.00 0.00 C ATOM 2092 CE3 TRP A 142 23.446 2.508 -0.957 1.00 0.00 C ATOM 2093 CZ2 TRP A 142 24.880 0.083 -1.059 1.00 0.00 C ATOM 2094 CZ3 TRP A 142 24.275 2.125 0.116 1.00 0.00 C ATOM 2095 CH2 TRP A 142 25.007 0.926 0.053 1.00 0.00 C ATOM 0 H TRP A 142 23.214 4.896 -4.493 1.00 0.00 H new ATOM 0 HA TRP A 142 22.583 2.518 -5.828 1.00 0.00 H new ATOM 0 HB2 TRP A 142 21.874 3.798 -3.256 1.00 0.00 H new ATOM 0 HB3 TRP A 142 20.710 2.635 -3.860 1.00 0.00 H new ATOM 0 HD1 TRP A 142 22.423 0.387 -4.995 1.00 0.00 H new ATOM 0 HE1 TRP A 142 24.015 -1.057 -3.586 1.00 0.00 H new ATOM 0 HE3 TRP A 142 22.899 3.437 -0.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 25.427 -0.847 -1.106 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 24.349 2.755 0.990 1.00 0.00 H new ATOM 0 HH2 TRP A 142 25.668 0.655 0.863 1.00 0.00 H new ATOM 2106 N VAL A 143 20.118 4.775 -5.914 1.00 0.00 N ATOM 2107 CA VAL A 143 18.898 5.057 -6.649 1.00 0.00 C ATOM 2108 C VAL A 143 19.182 5.177 -8.147 1.00 0.00 C ATOM 2109 O VAL A 143 18.388 4.692 -8.949 1.00 0.00 O ATOM 2110 CB VAL A 143 18.114 6.240 -6.068 1.00 0.00 C ATOM 2111 CG1 VAL A 143 17.641 5.929 -4.640 1.00 0.00 C ATOM 2112 CG2 VAL A 143 18.852 7.581 -6.070 1.00 0.00 C ATOM 0 H VAL A 143 20.385 5.486 -5.233 1.00 0.00 H new ATOM 0 HA VAL A 143 18.229 4.205 -6.526 1.00 0.00 H new ATOM 0 HB VAL A 143 17.269 6.361 -6.746 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.087 6.781 -4.247 1.00 0.00 H new ATOM 0 HG12 VAL A 143 16.995 5.051 -4.654 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.505 5.733 -4.005 1.00 0.00 H new ATOM 0 HG21 VAL A 143 18.211 8.350 -5.639 1.00 0.00 H new ATOM 0 HG22 VAL A 143 19.764 7.495 -5.479 1.00 0.00 H new ATOM 0 HG23 VAL A 143 19.108 7.854 -7.094 1.00 0.00 H new ATOM 2122 N ASN A 144 20.343 5.719 -8.538 1.00 0.00 N ATOM 2123 CA ASN A 144 20.725 5.824 -9.945 1.00 0.00 C ATOM 2124 C ASN A 144 20.850 4.459 -10.622 1.00 0.00 C ATOM 2125 O ASN A 144 20.701 4.399 -11.844 1.00 0.00 O ATOM 2126 CB ASN A 144 22.026 6.628 -10.125 1.00 0.00 C ATOM 2127 CG ASN A 144 21.737 8.108 -10.338 1.00 0.00 C ATOM 2128 OD1 ASN A 144 21.621 8.574 -11.468 1.00 0.00 O ATOM 2129 ND2 ASN A 144 21.590 8.872 -9.270 1.00 0.00 N ATOM 0 H ASN A 144 21.036 6.093 -7.890 1.00 0.00 H new ATOM 0 HA ASN A 144 19.915 6.363 -10.436 1.00 0.00 H new ATOM 0 HB2 ASN A 144 22.659 6.502 -9.246 1.00 0.00 H new ATOM 0 HB3 ASN A 144 22.582 6.238 -10.977 1.00 0.00 H new ATOM 0 HD21 ASN A 144 21.377 9.864 -9.378 1.00 0.00 H new ATOM 0 HD22 ASN A 144 21.689 8.470 -8.338 1.00 0.00 H new ATOM 2136 N LEU A 145 21.103 3.372 -9.883 1.00 0.00 N ATOM 2137 CA LEU A 145 21.156 2.030 -10.463 1.00 0.00 C ATOM 2138 C LEU A 145 19.786 1.350 -10.401 1.00 0.00 C ATOM 2139 O LEU A 145 19.344 0.793 -11.406 1.00 0.00 O ATOM 2140 CB LEU A 145 22.209 1.147 -9.767 1.00 0.00 C ATOM 2141 CG LEU A 145 23.687 1.587 -9.885 1.00 0.00 C ATOM 2142 CD1 LEU A 145 24.587 0.380 -9.613 1.00 0.00 C ATOM 2143 CD2 LEU A 145 24.069 2.177 -11.249 1.00 0.00 C ATOM 0 H LEU A 145 21.275 3.399 -8.878 1.00 0.00 H new ATOM 0 HA LEU A 145 21.447 2.148 -11.507 1.00 0.00 H new ATOM 0 HB2 LEU A 145 21.956 1.090 -8.708 1.00 0.00 H new ATOM 0 HB3 LEU A 145 22.123 0.138 -10.169 1.00 0.00 H new ATOM 0 HG LEU A 145 23.824 2.382 -9.152 1.00 0.00 H new ATOM 0 HD11 LEU A 145 25.632 0.680 -9.694 1.00 0.00 H new ATOM 0 HD12 LEU A 145 24.395 0.002 -8.609 1.00 0.00 H new ATOM 0 HD13 LEU A 145 24.377 -0.402 -10.342 1.00 0.00 H new ATOM 0 HD21 LEU A 145 25.122 2.458 -11.242 1.00 0.00 H new ATOM 0 HD22 LEU A 145 23.897 1.434 -12.028 1.00 0.00 H new ATOM 0 HD23 LEU A 145 23.460 3.059 -11.448 1.00 0.00 H new ATOM 2155 N LEU A 146 19.110 1.378 -9.246 1.00 0.00 N ATOM 2156 CA LEU A 146 17.868 0.619 -9.027 1.00 0.00 C ATOM 2157 C LEU A 146 16.618 1.292 -9.616 1.00 0.00 C ATOM 2158 O LEU A 146 15.567 0.648 -9.629 1.00 0.00 O ATOM 2159 CB LEU A 146 17.681 0.294 -7.528 1.00 0.00 C ATOM 2160 CG LEU A 146 17.398 1.532 -6.654 1.00 0.00 C ATOM 2161 CD1 LEU A 146 15.912 1.863 -6.453 1.00 0.00 C ATOM 2162 CD2 LEU A 146 18.042 1.382 -5.269 1.00 0.00 C ATOM 0 H LEU A 146 19.406 1.925 -8.438 1.00 0.00 H new ATOM 0 HA LEU A 146 17.982 -0.315 -9.578 1.00 0.00 H new ATOM 0 HB2 LEU A 146 16.858 -0.412 -7.419 1.00 0.00 H new ATOM 0 HB3 LEU A 146 18.578 -0.203 -7.159 1.00 0.00 H new ATOM 0 HG LEU A 146 17.837 2.357 -7.215 1.00 0.00 H new ATOM 0 HD11 LEU A 146 15.818 2.749 -5.825 1.00 0.00 H new ATOM 0 HD12 LEU A 146 15.448 2.053 -7.421 1.00 0.00 H new ATOM 0 HD13 LEU A 146 15.414 1.022 -5.971 1.00 0.00 H new ATOM 0 HD21 LEU A 146 17.829 2.268 -4.671 1.00 0.00 H new ATOM 0 HD22 LEU A 146 17.635 0.501 -4.772 1.00 0.00 H new ATOM 0 HD23 LEU A 146 19.121 1.270 -5.379 1.00 0.00 H new ATOM 2174 N LYS A 147 16.714 2.559 -10.054 1.00 0.00 N ATOM 2175 CA LYS A 147 15.609 3.359 -10.594 1.00 0.00 C ATOM 2176 C LYS A 147 14.686 2.552 -11.512 1.00 0.00 C ATOM 2177 O LYS A 147 13.453 2.681 -11.360 1.00 0.00 O ATOM 2178 CB LYS A 147 16.115 4.639 -11.293 1.00 0.00 C ATOM 2179 CG LYS A 147 17.044 4.398 -12.498 1.00 0.00 C ATOM 2180 CD LYS A 147 17.658 5.713 -13.003 1.00 0.00 C ATOM 2181 CE LYS A 147 18.383 5.567 -14.352 1.00 0.00 C ATOM 2182 NZ LYS A 147 19.450 4.535 -14.345 1.00 0.00 N ATOM 2183 OXT LYS A 147 15.172 1.818 -12.401 1.00 0.00 O ATOM 0 H LYS A 147 17.597 3.070 -10.040 1.00 0.00 H new ATOM 0 HA LYS A 147 15.009 3.664 -9.736 1.00 0.00 H new ATOM 0 HB2 LYS A 147 15.254 5.217 -11.627 1.00 0.00 H new ATOM 0 HB3 LYS A 147 16.644 5.250 -10.561 1.00 0.00 H new ATOM 0 HG2 LYS A 147 17.839 3.708 -12.214 1.00 0.00 H new ATOM 0 HG3 LYS A 147 16.483 3.924 -13.303 1.00 0.00 H new ATOM 0 HD2 LYS A 147 16.870 6.460 -13.101 1.00 0.00 H new ATOM 0 HD3 LYS A 147 18.361 6.087 -12.259 1.00 0.00 H new ATOM 0 HE2 LYS A 147 17.653 5.318 -15.122 1.00 0.00 H new ATOM 0 HE3 LYS A 147 18.820 6.527 -14.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 20.078 4.679 -15.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 20.001 4.611 -13.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 19.019 3.590 -14.402 1.00 0.00 H new