USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1074 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 48 GLN : amide:sc= 0.883 K(o=3.6,f=-3.8) USER MOD Set 1.2: A 82 GLN : amide:sc= 1.41 K(o=3.6,f=-3.2!) USER MOD Set 1.3: A 84 ASN : amide:sc= 1.26 K(o=3.6,f=1.7) USER MOD Set 2.1: A 15 SER OG : rot -118:sc= 0.264 USER MOD Set 2.2: A 57 SER OG : rot 180:sc= 0.524 USER MOD Single : A 10 THR OG1 : rot 138:sc= 0.471 USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc=-0.000481 K(o=-0.00048,f=-2.5!) USER MOD Single : A 27 THR OG1 : rot 77:sc= 1.22 USER MOD Single : A 29 GLN : amide:sc= 0.461 K(o=0.46,f=-0.12) USER MOD Single : A 31 HIS : +bothHN:sc= 1.85 K(o=1.9,f=-5.7!) USER MOD Single : A 32 LYS NZ :NH3+ -179:sc= 1.22 (180deg=1.22) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 101:sc= 1.23 USER MOD Single : A 47 TYR OH : rot -146:sc= 0.0105 USER MOD Single : A 50 LYS NZ :NH3+ 152:sc= 1.25 (180deg=1.16) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 160:sc= 0 USER MOD Single : A 58 THR OG1 : rot 75:sc= 0.386 USER MOD Single : A 59 THR OG1 : rot 170:sc= 0 USER MOD Single : A 67 SER OG : rot 148:sc= 1.23 USER MOD Single : A 73 GLN : amide:sc= -0.037 X(o=-0.037,f=-0.04) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 84:sc= 0.898 USER MOD Single : A 87 TYR OH : rot 35:sc= 0.886 USER MOD Single : A 95 SER OG : rot -36:sc= 0.502 USER MOD Single : A 96 SER OG : rot -40:sc= 0.359 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 CYS SG : rot 70:sc= 1.01 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 168:sc= 0.869 (180deg=0.763) USER MOD Single : A 106 GLN : amide:sc= 0.725 K(o=0.73,f=0) USER MOD Single : A 112 GLN : amide:sc= 0.169 X(o=0.17,f=-0.28) USER MOD Single : A 114 GLN : amide:sc= 0.818 K(o=0.82,f=-2.5!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0.88 K(o=0.88,f=-0.01) USER MOD Single : A 122 MET CE :methyl -178:sc= -0.547 (180deg=-0.599) USER MOD Single : A 128 SER OG : rot 60:sc= 0.753 USER MOD Single : A 130 ASN : amide:sc= 1.04 K(o=1,f=-3.5!) USER MOD Single : A 135 THR OG1 : rot -52:sc= 1.21 USER MOD Single : A 137 SER OG : rot 89:sc= 1.15 USER MOD Single : A 138 ASN : amide:sc= 0.689 K(o=0.69,f=-1.7) USER MOD Single : A 143 HIS : no HD1:sc= -0.135 X(o=-0.13,f=0) USER MOD Single : A 146 THR OG1 : rot -84:sc= 1.24 USER MOD Single : A 149 SER OG : rot 44:sc= 0.0164 USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 5.190 0.438 -0.824 1.00 0.00 N ATOM 21 CA ALA A 2 5.536 1.839 -1.102 1.00 0.00 C ATOM 22 C ALA A 2 5.298 2.228 -2.580 1.00 0.00 C ATOM 23 O ALA A 2 4.936 1.392 -3.411 1.00 0.00 O ATOM 24 CB ALA A 2 7.007 2.028 -0.690 1.00 0.00 C ATOM 0 HA ALA A 2 4.887 2.503 -0.530 1.00 0.00 H new ATOM 0 HB1 ALA A 2 7.308 3.058 -0.880 1.00 0.00 H new ATOM 0 HB2 ALA A 2 7.119 1.807 0.371 1.00 0.00 H new ATOM 0 HB3 ALA A 2 7.637 1.353 -1.270 1.00 0.00 H new ATOM 30 N GLU A 3 5.532 3.502 -2.914 1.00 0.00 N ATOM 31 CA GLU A 3 5.406 4.078 -4.262 1.00 0.00 C ATOM 32 C GLU A 3 6.676 4.890 -4.590 1.00 0.00 C ATOM 33 O GLU A 3 6.959 5.882 -3.914 1.00 0.00 O ATOM 34 CB GLU A 3 4.126 4.935 -4.320 1.00 0.00 C ATOM 35 CG GLU A 3 3.859 5.539 -5.709 1.00 0.00 C ATOM 36 CD GLU A 3 2.569 6.388 -5.734 1.00 0.00 C ATOM 37 OE1 GLU A 3 2.449 7.351 -4.939 1.00 0.00 O ATOM 38 OE2 GLU A 3 1.669 6.114 -6.565 1.00 0.00 O1- ATOM 0 H GLU A 3 5.828 4.192 -2.223 1.00 0.00 H new ATOM 0 HA GLU A 3 5.317 3.296 -5.016 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.273 4.322 -4.028 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.204 5.741 -3.590 1.00 0.00 H new ATOM 0 HG2 GLU A 3 4.706 6.158 -6.004 1.00 0.00 H new ATOM 0 HG3 GLU A 3 3.780 4.737 -6.443 1.00 0.00 H new ATOM 45 N ILE A 4 7.458 4.460 -5.597 1.00 0.00 N ATOM 46 CA ILE A 4 8.805 5.002 -5.883 1.00 0.00 C ATOM 47 C ILE A 4 8.860 5.794 -7.198 1.00 0.00 C ATOM 48 O ILE A 4 8.527 5.272 -8.265 1.00 0.00 O ATOM 49 CB ILE A 4 9.898 3.897 -5.929 1.00 0.00 C ATOM 50 CG1 ILE A 4 9.694 2.688 -4.988 1.00 0.00 C ATOM 51 CG2 ILE A 4 11.272 4.536 -5.690 1.00 0.00 C ATOM 52 CD1 ILE A 4 9.665 2.981 -3.488 1.00 0.00 C ATOM 0 H ILE A 4 7.174 3.722 -6.241 1.00 0.00 H new ATOM 0 HA ILE A 4 9.011 5.676 -5.052 1.00 0.00 H new ATOM 0 HB ILE A 4 9.822 3.464 -6.926 1.00 0.00 H new ATOM 0 HG12 ILE A 4 8.756 2.202 -5.258 1.00 0.00 H new ATOM 0 HG13 ILE A 4 10.492 1.970 -5.179 1.00 0.00 H new ATOM 0 HG21 ILE A 4 12.042 3.765 -5.721 1.00 0.00 H new ATOM 0 HG22 ILE A 4 11.468 5.277 -6.465 1.00 0.00 H new ATOM 0 HG23 ILE A 4 11.283 5.021 -4.714 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.516 2.051 -2.939 1.00 0.00 H new ATOM 0 HD12 ILE A 4 10.610 3.433 -3.187 1.00 0.00 H new ATOM 0 HD13 ILE A 4 8.848 3.668 -3.267 1.00 0.00 H new ATOM 64 N GLY A 5 9.351 7.034 -7.142 1.00 0.00 N ATOM 65 CA GLY A 5 9.672 7.817 -8.341 1.00 0.00 C ATOM 66 C GLY A 5 11.092 7.483 -8.808 1.00 0.00 C ATOM 67 O GLY A 5 12.027 7.557 -8.009 1.00 0.00 O ATOM 0 H GLY A 5 9.538 7.524 -6.267 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.957 7.597 -9.133 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.591 8.882 -8.125 1.00 0.00 H new ATOM 71 N ILE A 6 11.263 7.090 -10.074 1.00 0.00 N ATOM 72 CA ILE A 6 12.513 6.535 -10.618 1.00 0.00 C ATOM 73 C ILE A 6 13.036 7.468 -11.711 1.00 0.00 C ATOM 74 O ILE A 6 12.665 7.383 -12.884 1.00 0.00 O ATOM 75 CB ILE A 6 12.340 5.079 -11.111 1.00 0.00 C ATOM 76 CG1 ILE A 6 11.727 4.183 -10.010 1.00 0.00 C ATOM 77 CG2 ILE A 6 13.699 4.521 -11.589 1.00 0.00 C ATOM 78 CD1 ILE A 6 11.575 2.715 -10.417 1.00 0.00 C ATOM 0 H ILE A 6 10.519 7.149 -10.769 1.00 0.00 H new ATOM 0 HA ILE A 6 13.255 6.480 -9.822 1.00 0.00 H new ATOM 0 HB ILE A 6 11.646 5.078 -11.952 1.00 0.00 H new ATOM 0 HG12 ILE A 6 12.353 4.240 -9.119 1.00 0.00 H new ATOM 0 HG13 ILE A 6 10.748 4.577 -9.738 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.570 3.495 -11.935 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.077 5.135 -12.407 1.00 0.00 H new ATOM 0 HG23 ILE A 6 14.410 4.539 -10.763 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.139 2.152 -9.592 1.00 0.00 H new ATOM 0 HD12 ILE A 6 10.924 2.645 -11.289 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.554 2.302 -10.660 1.00 0.00 H new ATOM 90 N PHE A 7 13.880 8.407 -11.301 1.00 0.00 N ATOM 91 CA PHE A 7 14.335 9.513 -12.135 1.00 0.00 C ATOM 92 C PHE A 7 15.608 9.134 -12.888 1.00 0.00 C ATOM 93 O PHE A 7 16.557 8.599 -12.304 1.00 0.00 O ATOM 94 CB PHE A 7 14.531 10.741 -11.245 1.00 0.00 C ATOM 95 CG PHE A 7 13.270 11.083 -10.473 1.00 0.00 C ATOM 96 CD1 PHE A 7 12.274 11.888 -11.053 1.00 0.00 C ATOM 97 CD2 PHE A 7 13.063 10.532 -9.197 1.00 0.00 C ATOM 98 CE1 PHE A 7 11.080 12.141 -10.354 1.00 0.00 C ATOM 99 CE2 PHE A 7 11.893 10.825 -8.482 1.00 0.00 C ATOM 100 CZ PHE A 7 10.887 11.606 -9.070 1.00 0.00 C ATOM 0 H PHE A 7 14.275 8.421 -10.361 1.00 0.00 H new ATOM 0 HA PHE A 7 13.589 9.747 -12.894 1.00 0.00 H new ATOM 0 HB2 PHE A 7 15.347 10.557 -10.546 1.00 0.00 H new ATOM 0 HB3 PHE A 7 14.824 11.593 -11.859 1.00 0.00 H new ATOM 0 HD1 PHE A 7 12.426 12.312 -12.035 1.00 0.00 H new ATOM 0 HD2 PHE A 7 13.808 9.880 -8.765 1.00 0.00 H new ATOM 0 HE1 PHE A 7 10.310 12.748 -10.806 1.00 0.00 H new ATOM 0 HE2 PHE A 7 11.766 10.449 -7.478 1.00 0.00 H new ATOM 0 HZ PHE A 7 9.967 11.795 -8.537 1.00 0.00 H new ATOM 110 N VAL A 8 15.632 9.418 -14.191 1.00 0.00 N ATOM 111 CA VAL A 8 16.675 8.936 -15.100 1.00 0.00 C ATOM 112 C VAL A 8 17.478 10.088 -15.690 1.00 0.00 C ATOM 113 O VAL A 8 16.941 11.152 -16.001 1.00 0.00 O ATOM 114 CB VAL A 8 16.074 8.067 -16.223 1.00 0.00 C ATOM 115 CG1 VAL A 8 17.151 7.346 -17.046 1.00 0.00 C ATOM 116 CG2 VAL A 8 15.155 6.980 -15.649 1.00 0.00 C ATOM 0 H VAL A 8 14.924 9.992 -14.649 1.00 0.00 H new ATOM 0 HA VAL A 8 17.355 8.318 -14.514 1.00 0.00 H new ATOM 0 HB VAL A 8 15.520 8.757 -16.859 1.00 0.00 H new ATOM 0 HG11 VAL A 8 16.675 6.748 -17.823 1.00 0.00 H new ATOM 0 HG12 VAL A 8 17.810 8.082 -17.507 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.733 6.696 -16.393 1.00 0.00 H new ATOM 0 HG21 VAL A 8 14.745 6.383 -16.463 1.00 0.00 H new ATOM 0 HG22 VAL A 8 15.726 6.337 -14.979 1.00 0.00 H new ATOM 0 HG23 VAL A 8 14.340 7.447 -15.096 1.00 0.00 H new ATOM 126 N GLY A 9 18.772 9.842 -15.886 1.00 0.00 N ATOM 127 CA GLY A 9 19.687 10.745 -16.575 1.00 0.00 C ATOM 128 C GLY A 9 20.521 9.974 -17.597 1.00 0.00 C ATOM 129 O GLY A 9 21.448 9.258 -17.226 1.00 0.00 O ATOM 0 H GLY A 9 19.223 8.987 -15.561 1.00 0.00 H new ATOM 0 HA2 GLY A 9 19.124 11.533 -17.075 1.00 0.00 H new ATOM 0 HA3 GLY A 9 20.343 11.231 -15.852 1.00 0.00 H new ATOM 133 N THR A 10 20.197 10.112 -18.883 1.00 0.00 N ATOM 134 CA THR A 10 20.908 9.472 -20.011 1.00 0.00 C ATOM 135 C THR A 10 20.843 10.335 -21.276 1.00 0.00 C ATOM 136 O THR A 10 19.961 11.183 -21.397 1.00 0.00 O ATOM 137 CB THR A 10 20.310 8.083 -20.295 1.00 0.00 C ATOM 138 OG1 THR A 10 21.105 7.408 -21.248 1.00 0.00 O ATOM 139 CG2 THR A 10 18.900 8.092 -20.866 1.00 0.00 C ATOM 0 H THR A 10 19.411 10.687 -19.187 1.00 0.00 H new ATOM 0 HA THR A 10 21.955 9.365 -19.727 1.00 0.00 H new ATOM 0 HB THR A 10 20.282 7.597 -19.320 1.00 0.00 H new ATOM 0 HG1 THR A 10 21.211 6.471 -20.981 1.00 0.00 H new ATOM 0 HG21 THR A 10 18.568 7.067 -21.031 1.00 0.00 H new ATOM 0 HG22 THR A 10 18.226 8.583 -20.164 1.00 0.00 H new ATOM 0 HG23 THR A 10 18.894 8.632 -21.813 1.00 0.00 H new ATOM 147 N MET A 11 21.737 10.084 -22.237 1.00 0.00 N ATOM 148 CA MET A 11 21.689 10.678 -23.585 1.00 0.00 C ATOM 149 C MET A 11 21.241 9.682 -24.675 1.00 0.00 C ATOM 150 O MET A 11 20.941 10.111 -25.791 1.00 0.00 O ATOM 151 CB MET A 11 23.064 11.273 -23.941 1.00 0.00 C ATOM 152 CG MET A 11 23.599 12.275 -22.906 1.00 0.00 C ATOM 153 SD MET A 11 22.468 13.595 -22.372 1.00 0.00 S ATOM 154 CE MET A 11 22.176 14.462 -23.933 1.00 0.00 C ATOM 0 H MET A 11 22.528 9.454 -22.103 1.00 0.00 H new ATOM 0 HA MET A 11 20.935 11.464 -23.558 1.00 0.00 H new ATOM 0 HB2 MET A 11 23.783 10.461 -24.050 1.00 0.00 H new ATOM 0 HB3 MET A 11 22.994 11.769 -24.909 1.00 0.00 H new ATOM 0 HG2 MET A 11 23.909 11.716 -22.023 1.00 0.00 H new ATOM 0 HG3 MET A 11 24.494 12.742 -23.318 1.00 0.00 H new ATOM 0 HE1 MET A 11 21.499 15.299 -23.763 1.00 0.00 H new ATOM 0 HE2 MET A 11 23.122 14.835 -24.325 1.00 0.00 H new ATOM 0 HE3 MET A 11 21.731 13.775 -24.653 1.00 0.00 H new ATOM 164 N TYR A 12 21.179 8.370 -24.370 1.00 0.00 N ATOM 165 CA TYR A 12 20.947 7.304 -25.369 1.00 0.00 C ATOM 166 C TYR A 12 20.146 6.086 -24.863 1.00 0.00 C ATOM 167 O TYR A 12 19.498 5.423 -25.675 1.00 0.00 O ATOM 168 CB TYR A 12 22.295 6.808 -25.927 1.00 0.00 C ATOM 169 CG TYR A 12 23.158 7.858 -26.606 1.00 0.00 C ATOM 170 CD1 TYR A 12 22.807 8.333 -27.886 1.00 0.00 C ATOM 171 CD2 TYR A 12 24.309 8.357 -25.963 1.00 0.00 C ATOM 172 CE1 TYR A 12 23.598 9.315 -28.517 1.00 0.00 C ATOM 173 CE2 TYR A 12 25.102 9.338 -26.591 1.00 0.00 C ATOM 174 CZ TYR A 12 24.747 9.820 -27.868 1.00 0.00 C ATOM 175 OH TYR A 12 25.518 10.767 -28.468 1.00 0.00 O ATOM 0 H TYR A 12 21.289 8.017 -23.419 1.00 0.00 H new ATOM 0 HA TYR A 12 20.332 7.772 -26.138 1.00 0.00 H new ATOM 0 HB2 TYR A 12 22.866 6.370 -25.108 1.00 0.00 H new ATOM 0 HB3 TYR A 12 22.099 6.009 -26.642 1.00 0.00 H new ATOM 0 HD1 TYR A 12 21.931 7.944 -28.384 1.00 0.00 H new ATOM 0 HD2 TYR A 12 24.584 7.986 -24.986 1.00 0.00 H new ATOM 0 HE1 TYR A 12 23.326 9.681 -29.496 1.00 0.00 H new ATOM 0 HE2 TYR A 12 25.981 9.721 -26.095 1.00 0.00 H new ATOM 0 HH TYR A 12 26.266 11.000 -27.880 1.00 0.00 H new ATOM 185 N GLY A 13 20.172 5.777 -23.555 1.00 0.00 N ATOM 186 CA GLY A 13 19.345 4.718 -22.950 1.00 0.00 C ATOM 187 C GLY A 13 20.057 3.750 -21.992 1.00 0.00 C ATOM 188 O GLY A 13 19.387 2.920 -21.379 1.00 0.00 O ATOM 0 H GLY A 13 20.771 6.258 -22.884 1.00 0.00 H new ATOM 0 HA2 GLY A 13 18.527 5.193 -22.408 1.00 0.00 H new ATOM 0 HA3 GLY A 13 18.898 4.134 -23.754 1.00 0.00 H new ATOM 192 N ASN A 14 21.386 3.832 -21.835 1.00 0.00 N ATOM 193 CA ASN A 14 22.169 2.813 -21.115 1.00 0.00 C ATOM 194 C ASN A 14 21.738 2.641 -19.649 1.00 0.00 C ATOM 195 O ASN A 14 21.538 1.520 -19.183 1.00 0.00 O ATOM 196 CB ASN A 14 23.677 3.132 -21.250 1.00 0.00 C ATOM 197 CG ASN A 14 24.486 1.857 -21.433 1.00 0.00 C ATOM 198 OD1 ASN A 14 25.095 1.328 -20.518 1.00 0.00 O ATOM 199 ND2 ASN A 14 24.501 1.330 -22.636 1.00 0.00 N ATOM 0 H ASN A 14 21.947 4.601 -22.201 1.00 0.00 H new ATOM 0 HA ASN A 14 21.969 1.847 -21.579 1.00 0.00 H new ATOM 0 HB2 ASN A 14 23.838 3.795 -22.100 1.00 0.00 H new ATOM 0 HB3 ASN A 14 24.022 3.662 -20.362 1.00 0.00 H new ATOM 0 HD21 ASN A 14 25.025 0.472 -22.810 1.00 0.00 H new ATOM 0 HD22 ASN A 14 23.989 1.779 -23.396 1.00 0.00 H new ATOM 206 N SER A 15 21.524 3.758 -18.945 1.00 0.00 N ATOM 207 CA SER A 15 20.985 3.761 -17.574 1.00 0.00 C ATOM 208 C SER A 15 19.451 3.619 -17.541 1.00 0.00 C ATOM 209 O SER A 15 18.916 2.963 -16.650 1.00 0.00 O ATOM 210 CB SER A 15 21.479 5.025 -16.859 1.00 0.00 C ATOM 211 OG SER A 15 21.050 6.164 -17.573 1.00 0.00 O ATOM 0 H SER A 15 21.719 4.691 -19.309 1.00 0.00 H new ATOM 0 HA SER A 15 21.354 2.884 -17.042 1.00 0.00 H new ATOM 0 HB2 SER A 15 21.093 5.054 -15.840 1.00 0.00 H new ATOM 0 HB3 SER A 15 22.567 5.015 -16.788 1.00 0.00 H new ATOM 0 HG SER A 15 21.831 6.662 -17.894 1.00 0.00 H new ATOM 217 N LEU A 16 18.727 4.119 -18.553 1.00 0.00 N ATOM 218 CA LEU A 16 17.263 3.975 -18.677 1.00 0.00 C ATOM 219 C LEU A 16 16.797 2.512 -18.689 1.00 0.00 C ATOM 220 O LEU A 16 15.802 2.199 -18.039 1.00 0.00 O ATOM 221 CB LEU A 16 16.782 4.721 -19.935 1.00 0.00 C ATOM 222 CG LEU A 16 15.279 4.602 -20.252 1.00 0.00 C ATOM 223 CD1 LEU A 16 14.382 5.135 -19.136 1.00 0.00 C ATOM 224 CD2 LEU A 16 14.986 5.394 -21.523 1.00 0.00 C ATOM 0 H LEU A 16 19.145 4.643 -19.322 1.00 0.00 H new ATOM 0 HA LEU A 16 16.813 4.419 -17.789 1.00 0.00 H new ATOM 0 HB2 LEU A 16 17.028 5.777 -19.824 1.00 0.00 H new ATOM 0 HB3 LEU A 16 17.345 4.350 -20.792 1.00 0.00 H new ATOM 0 HG LEU A 16 15.058 3.541 -20.368 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.337 5.021 -19.424 1.00 0.00 H new ATOM 0 HD12 LEU A 16 14.569 4.575 -18.220 1.00 0.00 H new ATOM 0 HD13 LEU A 16 14.599 6.190 -18.967 1.00 0.00 H new ATOM 0 HD21 LEU A 16 13.925 5.320 -21.761 1.00 0.00 H new ATOM 0 HD22 LEU A 16 15.251 6.440 -21.369 1.00 0.00 H new ATOM 0 HD23 LEU A 16 15.572 4.989 -22.348 1.00 0.00 H new ATOM 236 N LEU A 17 17.527 1.602 -19.346 1.00 0.00 N ATOM 237 CA LEU A 17 17.219 0.162 -19.318 1.00 0.00 C ATOM 238 C LEU A 17 17.089 -0.367 -17.878 1.00 0.00 C ATOM 239 O LEU A 17 16.173 -1.127 -17.560 1.00 0.00 O ATOM 240 CB LEU A 17 18.309 -0.599 -20.099 1.00 0.00 C ATOM 241 CG LEU A 17 18.169 -2.136 -20.053 1.00 0.00 C ATOM 242 CD1 LEU A 17 16.873 -2.626 -20.702 1.00 0.00 C ATOM 243 CD2 LEU A 17 19.343 -2.795 -20.772 1.00 0.00 C ATOM 0 H LEU A 17 18.344 1.839 -19.910 1.00 0.00 H new ATOM 0 HA LEU A 17 16.252 -0.001 -19.794 1.00 0.00 H new ATOM 0 HB2 LEU A 17 18.287 -0.275 -21.140 1.00 0.00 H new ATOM 0 HB3 LEU A 17 19.285 -0.323 -19.700 1.00 0.00 H new ATOM 0 HG LEU A 17 18.154 -2.413 -18.999 1.00 0.00 H new ATOM 0 HD11 LEU A 17 16.825 -3.713 -20.643 1.00 0.00 H new ATOM 0 HD12 LEU A 17 16.019 -2.196 -20.179 1.00 0.00 H new ATOM 0 HD13 LEU A 17 16.851 -2.318 -21.747 1.00 0.00 H new ATOM 0 HD21 LEU A 17 19.232 -3.879 -20.732 1.00 0.00 H new ATOM 0 HD22 LEU A 17 19.361 -2.470 -21.812 1.00 0.00 H new ATOM 0 HD23 LEU A 17 20.275 -2.508 -20.286 1.00 0.00 H new ATOM 255 N VAL A 18 17.990 0.071 -16.993 1.00 0.00 N ATOM 256 CA VAL A 18 17.966 -0.301 -15.574 1.00 0.00 C ATOM 257 C VAL A 18 16.780 0.329 -14.835 1.00 0.00 C ATOM 258 O VAL A 18 16.206 -0.318 -13.965 1.00 0.00 O ATOM 259 CB VAL A 18 19.295 0.054 -14.887 1.00 0.00 C ATOM 260 CG1 VAL A 18 19.246 -0.303 -13.403 1.00 0.00 C ATOM 261 CG2 VAL A 18 20.461 -0.717 -15.519 1.00 0.00 C ATOM 0 H VAL A 18 18.758 0.695 -17.240 1.00 0.00 H new ATOM 0 HA VAL A 18 17.837 -1.382 -15.528 1.00 0.00 H new ATOM 0 HB VAL A 18 19.446 1.126 -15.012 1.00 0.00 H new ATOM 0 HG11 VAL A 18 20.196 -0.044 -12.935 1.00 0.00 H new ATOM 0 HG12 VAL A 18 18.441 0.252 -12.922 1.00 0.00 H new ATOM 0 HG13 VAL A 18 19.066 -1.372 -13.292 1.00 0.00 H new ATOM 0 HG21 VAL A 18 21.390 -0.449 -15.016 1.00 0.00 H new ATOM 0 HG22 VAL A 18 20.288 -1.788 -15.415 1.00 0.00 H new ATOM 0 HG23 VAL A 18 20.535 -0.463 -16.576 1.00 0.00 H new ATOM 271 N ALA A 19 16.361 1.547 -15.185 1.00 0.00 N ATOM 272 CA ALA A 19 15.160 2.154 -14.605 1.00 0.00 C ATOM 273 C ALA A 19 13.871 1.397 -14.994 1.00 0.00 C ATOM 274 O ALA A 19 13.015 1.161 -14.140 1.00 0.00 O ATOM 275 CB ALA A 19 15.097 3.621 -15.033 1.00 0.00 C ATOM 0 H ALA A 19 16.837 2.134 -15.870 1.00 0.00 H new ATOM 0 HA ALA A 19 15.226 2.090 -13.519 1.00 0.00 H new ATOM 0 HB1 ALA A 19 14.207 4.086 -14.608 1.00 0.00 H new ATOM 0 HB2 ALA A 19 15.985 4.143 -14.676 1.00 0.00 H new ATOM 0 HB3 ALA A 19 15.054 3.681 -16.120 1.00 0.00 H new ATOM 281 N GLU A 20 13.749 0.969 -16.255 1.00 0.00 N ATOM 282 CA GLU A 20 12.643 0.115 -16.722 1.00 0.00 C ATOM 283 C GLU A 20 12.606 -1.239 -15.984 1.00 0.00 C ATOM 284 O GLU A 20 11.537 -1.686 -15.565 1.00 0.00 O ATOM 285 CB GLU A 20 12.731 -0.108 -18.245 1.00 0.00 C ATOM 286 CG GLU A 20 12.524 1.180 -19.055 1.00 0.00 C ATOM 287 CD GLU A 20 12.459 0.867 -20.562 1.00 0.00 C ATOM 288 OE1 GLU A 20 13.521 0.824 -21.230 1.00 0.00 O ATOM 289 OE2 GLU A 20 11.339 0.663 -21.092 1.00 0.00 O1- ATOM 0 H GLU A 20 14.418 1.205 -16.988 1.00 0.00 H new ATOM 0 HA GLU A 20 11.715 0.639 -16.494 1.00 0.00 H new ATOM 0 HB2 GLU A 20 13.706 -0.531 -18.489 1.00 0.00 H new ATOM 0 HB3 GLU A 20 11.982 -0.842 -18.543 1.00 0.00 H new ATOM 0 HG2 GLU A 20 11.603 1.670 -18.740 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.339 1.876 -18.857 1.00 0.00 H new ATOM 296 N GLU A 21 13.771 -1.862 -15.760 1.00 0.00 N ATOM 297 CA GLU A 21 13.902 -3.038 -14.889 1.00 0.00 C ATOM 298 C GLU A 21 13.496 -2.736 -13.442 1.00 0.00 C ATOM 299 O GLU A 21 12.733 -3.500 -12.852 1.00 0.00 O ATOM 300 CB GLU A 21 15.346 -3.557 -14.927 1.00 0.00 C ATOM 301 CG GLU A 21 15.603 -4.487 -16.113 1.00 0.00 C ATOM 302 CD GLU A 21 15.017 -5.888 -15.844 1.00 0.00 C ATOM 303 OE1 GLU A 21 15.614 -6.661 -15.052 1.00 0.00 O ATOM 304 OE2 GLU A 21 13.931 -6.205 -16.390 1.00 0.00 O1- ATOM 0 H GLU A 21 14.652 -1.564 -16.179 1.00 0.00 H new ATOM 0 HA GLU A 21 13.222 -3.802 -15.267 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.031 -2.711 -14.978 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.562 -4.088 -14.000 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.156 -4.067 -17.014 1.00 0.00 H new ATOM 0 HG3 GLU A 21 16.675 -4.564 -16.295 1.00 0.00 H new ATOM 311 N ALA A 22 13.961 -1.626 -12.860 1.00 0.00 N ATOM 312 CA ALA A 22 13.657 -1.259 -11.480 1.00 0.00 C ATOM 313 C ALA A 22 12.151 -1.119 -11.220 1.00 0.00 C ATOM 314 O ALA A 22 11.647 -1.653 -10.232 1.00 0.00 O ATOM 315 CB ALA A 22 14.417 0.024 -11.122 1.00 0.00 C ATOM 0 H ALA A 22 14.562 -0.955 -13.339 1.00 0.00 H new ATOM 0 HA ALA A 22 13.989 -2.069 -10.831 1.00 0.00 H new ATOM 0 HB1 ALA A 22 14.194 0.304 -10.092 1.00 0.00 H new ATOM 0 HB2 ALA A 22 15.488 -0.146 -11.228 1.00 0.00 H new ATOM 0 HB3 ALA A 22 14.109 0.828 -11.791 1.00 0.00 H new ATOM 321 N GLU A 23 11.414 -0.475 -12.132 1.00 0.00 N ATOM 322 CA GLU A 23 9.951 -0.373 -12.073 1.00 0.00 C ATOM 323 C GLU A 23 9.277 -1.759 -12.007 1.00 0.00 C ATOM 324 O GLU A 23 8.420 -1.995 -11.150 1.00 0.00 O ATOM 325 CB GLU A 23 9.467 0.446 -13.286 1.00 0.00 C ATOM 326 CG GLU A 23 7.998 0.873 -13.197 1.00 0.00 C ATOM 327 CD GLU A 23 7.552 1.614 -14.475 1.00 0.00 C ATOM 328 OE1 GLU A 23 7.182 0.939 -15.468 1.00 0.00 O1- ATOM 329 OE2 GLU A 23 7.558 2.870 -14.488 1.00 0.00 O ATOM 0 H GLU A 23 11.821 -0.005 -12.941 1.00 0.00 H new ATOM 0 HA GLU A 23 9.663 0.138 -11.155 1.00 0.00 H new ATOM 0 HB2 GLU A 23 10.089 1.336 -13.384 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.610 -0.144 -14.191 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.370 -0.005 -13.045 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.857 1.520 -12.331 1.00 0.00 H new ATOM 336 N ALA A 24 9.708 -2.704 -12.850 1.00 0.00 N ATOM 337 CA ALA A 24 9.209 -4.080 -12.854 1.00 0.00 C ATOM 338 C ALA A 24 9.572 -4.848 -11.566 1.00 0.00 C ATOM 339 O ALA A 24 8.705 -5.470 -10.956 1.00 0.00 O ATOM 340 CB ALA A 24 9.743 -4.789 -14.106 1.00 0.00 C ATOM 0 H ALA A 24 10.422 -2.530 -13.557 1.00 0.00 H new ATOM 0 HA ALA A 24 8.120 -4.057 -12.880 1.00 0.00 H new ATOM 0 HB1 ALA A 24 9.380 -5.817 -14.125 1.00 0.00 H new ATOM 0 HB2 ALA A 24 9.396 -4.265 -14.997 1.00 0.00 H new ATOM 0 HB3 ALA A 24 10.833 -4.789 -14.087 1.00 0.00 H new ATOM 346 N ILE A 25 10.822 -4.766 -11.098 1.00 0.00 N ATOM 347 CA ILE A 25 11.316 -5.438 -9.889 1.00 0.00 C ATOM 348 C ILE A 25 10.655 -4.918 -8.599 1.00 0.00 C ATOM 349 O ILE A 25 10.464 -5.683 -7.655 1.00 0.00 O ATOM 350 CB ILE A 25 12.850 -5.270 -9.850 1.00 0.00 C ATOM 351 CG1 ILE A 25 13.535 -6.005 -11.026 1.00 0.00 C ATOM 352 CG2 ILE A 25 13.415 -5.803 -8.530 1.00 0.00 C ATOM 353 CD1 ILE A 25 14.944 -5.467 -11.294 1.00 0.00 C ATOM 0 H ILE A 25 11.541 -4.213 -11.564 1.00 0.00 H new ATOM 0 HA ILE A 25 11.050 -6.494 -9.936 1.00 0.00 H new ATOM 0 HB ILE A 25 13.058 -4.204 -9.937 1.00 0.00 H new ATOM 0 HG12 ILE A 25 13.590 -7.071 -10.805 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.928 -5.896 -11.925 1.00 0.00 H new ATOM 0 HG21 ILE A 25 14.498 -5.676 -8.520 1.00 0.00 H new ATOM 0 HG22 ILE A 25 12.978 -5.251 -7.698 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.173 -6.861 -8.431 1.00 0.00 H new ATOM 0 HD11 ILE A 25 15.389 -6.011 -12.127 1.00 0.00 H new ATOM 0 HD12 ILE A 25 14.888 -4.407 -11.541 1.00 0.00 H new ATOM 0 HD13 ILE A 25 15.560 -5.600 -10.404 1.00 0.00 H new ATOM 365 N LEU A 26 10.273 -3.641 -8.532 1.00 0.00 N ATOM 366 CA LEU A 26 9.540 -3.080 -7.394 1.00 0.00 C ATOM 367 C LEU A 26 8.077 -3.526 -7.437 1.00 0.00 C ATOM 368 O LEU A 26 7.534 -3.962 -6.423 1.00 0.00 O ATOM 369 CB LEU A 26 9.675 -1.545 -7.428 1.00 0.00 C ATOM 370 CG LEU A 26 11.053 -1.077 -6.927 1.00 0.00 C ATOM 371 CD1 LEU A 26 11.342 0.334 -7.425 1.00 0.00 C ATOM 372 CD2 LEU A 26 11.126 -1.086 -5.397 1.00 0.00 C ATOM 0 H LEU A 26 10.464 -2.963 -9.270 1.00 0.00 H new ATOM 0 HA LEU A 26 9.958 -3.445 -6.456 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.520 -1.190 -8.447 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.894 -1.099 -6.812 1.00 0.00 H new ATOM 0 HG LEU A 26 11.796 -1.772 -7.318 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.319 0.654 -7.064 1.00 0.00 H new ATOM 0 HD12 LEU A 26 11.337 0.343 -8.515 1.00 0.00 H new ATOM 0 HD13 LEU A 26 10.577 1.015 -7.053 1.00 0.00 H new ATOM 0 HD21 LEU A 26 12.113 -0.750 -5.078 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.366 -0.417 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.951 -2.097 -5.030 1.00 0.00 H new ATOM 384 N THR A 27 7.486 -3.526 -8.632 1.00 0.00 N ATOM 385 CA THR A 27 6.153 -4.085 -8.893 1.00 0.00 C ATOM 386 C THR A 27 6.063 -5.563 -8.481 1.00 0.00 C ATOM 387 O THR A 27 5.124 -5.956 -7.788 1.00 0.00 O ATOM 388 CB THR A 27 5.785 -3.883 -10.375 1.00 0.00 C ATOM 389 OG1 THR A 27 5.796 -2.509 -10.706 1.00 0.00 O ATOM 390 CG2 THR A 27 4.393 -4.397 -10.706 1.00 0.00 C ATOM 0 H THR A 27 7.926 -3.131 -9.463 1.00 0.00 H new ATOM 0 HA THR A 27 5.428 -3.550 -8.279 1.00 0.00 H new ATOM 0 HB THR A 27 6.529 -4.442 -10.942 1.00 0.00 H new ATOM 0 HG1 THR A 27 6.722 -2.204 -10.807 1.00 0.00 H new ATOM 0 HG21 THR A 27 4.185 -4.230 -11.763 1.00 0.00 H new ATOM 0 HG22 THR A 27 4.338 -5.464 -10.490 1.00 0.00 H new ATOM 0 HG23 THR A 27 3.656 -3.866 -10.103 1.00 0.00 H new ATOM 398 N ALA A 28 7.072 -6.377 -8.821 1.00 0.00 N ATOM 399 CA ALA A 28 7.166 -7.793 -8.448 1.00 0.00 C ATOM 400 C ALA A 28 7.280 -8.025 -6.926 1.00 0.00 C ATOM 401 O ALA A 28 6.734 -8.999 -6.405 1.00 0.00 O ATOM 402 CB ALA A 28 8.366 -8.399 -9.184 1.00 0.00 C ATOM 0 H ALA A 28 7.865 -6.059 -9.378 1.00 0.00 H new ATOM 0 HA ALA A 28 6.238 -8.284 -8.742 1.00 0.00 H new ATOM 0 HB1 ALA A 28 8.458 -9.453 -8.923 1.00 0.00 H new ATOM 0 HB2 ALA A 28 8.220 -8.303 -10.260 1.00 0.00 H new ATOM 0 HB3 ALA A 28 9.275 -7.873 -8.893 1.00 0.00 H new ATOM 408 N GLN A 29 7.945 -7.111 -6.202 1.00 0.00 N ATOM 409 CA GLN A 29 8.031 -7.116 -4.730 1.00 0.00 C ATOM 410 C GLN A 29 6.744 -6.615 -4.032 1.00 0.00 C ATOM 411 O GLN A 29 6.649 -6.677 -2.805 1.00 0.00 O ATOM 412 CB GLN A 29 9.261 -6.295 -4.297 1.00 0.00 C ATOM 413 CG GLN A 29 10.559 -7.070 -4.569 1.00 0.00 C ATOM 414 CD GLN A 29 11.798 -6.215 -4.323 1.00 0.00 C ATOM 415 OE1 GLN A 29 12.377 -6.196 -3.250 1.00 0.00 O ATOM 416 NE2 GLN A 29 12.244 -5.472 -5.312 1.00 0.00 N ATOM 0 H GLN A 29 8.448 -6.333 -6.629 1.00 0.00 H new ATOM 0 HA GLN A 29 8.142 -8.152 -4.409 1.00 0.00 H new ATOM 0 HB2 GLN A 29 9.279 -5.347 -4.835 1.00 0.00 H new ATOM 0 HB3 GLN A 29 9.190 -6.058 -3.236 1.00 0.00 H new ATOM 0 HG2 GLN A 29 10.595 -7.952 -3.930 1.00 0.00 H new ATOM 0 HG3 GLN A 29 10.561 -7.423 -5.600 1.00 0.00 H new ATOM 0 HE21 GLN A 29 11.766 -5.482 -6.213 1.00 0.00 H new ATOM 0 HE22 GLN A 29 13.068 -4.886 -5.178 1.00 0.00 H new ATOM 425 N GLY A 30 5.751 -6.134 -4.791 1.00 0.00 N ATOM 426 CA GLY A 30 4.435 -5.701 -4.295 1.00 0.00 C ATOM 427 C GLY A 30 4.277 -4.179 -4.152 1.00 0.00 C ATOM 428 O GLY A 30 3.215 -3.712 -3.735 1.00 0.00 O ATOM 0 H GLY A 30 5.843 -6.031 -5.802 1.00 0.00 H new ATOM 0 HA2 GLY A 30 3.666 -6.071 -4.973 1.00 0.00 H new ATOM 0 HA3 GLY A 30 4.256 -6.165 -3.325 1.00 0.00 H new ATOM 432 N HIS A 31 5.315 -3.404 -4.487 1.00 0.00 N ATOM 433 CA HIS A 31 5.300 -1.933 -4.497 1.00 0.00 C ATOM 434 C HIS A 31 4.675 -1.373 -5.789 1.00 0.00 C ATOM 435 O HIS A 31 4.256 -2.115 -6.682 1.00 0.00 O ATOM 436 CB HIS A 31 6.743 -1.420 -4.322 1.00 0.00 C ATOM 437 CG HIS A 31 7.427 -1.933 -3.085 1.00 0.00 C ATOM 438 ND1 HIS A 31 7.005 -1.705 -1.773 1.00 0.00 N ATOM 439 CD2 HIS A 31 8.576 -2.665 -3.069 1.00 0.00 C ATOM 440 CE1 HIS A 31 7.921 -2.300 -0.991 1.00 0.00 C ATOM 441 NE2 HIS A 31 8.875 -2.878 -1.741 1.00 0.00 N ATOM 0 H HIS A 31 6.216 -3.792 -4.767 1.00 0.00 H new ATOM 0 HA HIS A 31 4.679 -1.584 -3.672 1.00 0.00 H new ATOM 0 HB2 HIS A 31 7.329 -1.708 -5.195 1.00 0.00 H new ATOM 0 HB3 HIS A 31 6.730 -0.330 -4.292 1.00 0.00 H new ATOM 0 HD1 HIS A 31 6.175 -1.194 -1.472 1.00 0.00 H new ATOM 0 HD2 HIS A 31 9.139 -3.009 -3.924 1.00 0.00 H new ATOM 0 HE1 HIS A 31 7.895 -2.312 0.089 1.00 0.00 H new ATOM 0 HE2 HIS A 31 9.684 -3.388 -1.387 1.00 0.00 H new ATOM 449 N LYS A 32 4.673 -0.044 -5.911 1.00 0.00 N ATOM 450 CA LYS A 32 4.331 0.710 -7.125 1.00 0.00 C ATOM 451 C LYS A 32 5.512 1.604 -7.510 1.00 0.00 C ATOM 452 O LYS A 32 6.284 2.019 -6.647 1.00 0.00 O ATOM 453 CB LYS A 32 3.030 1.485 -6.846 1.00 0.00 C ATOM 454 CG LYS A 32 2.478 2.225 -8.072 1.00 0.00 C ATOM 455 CD LYS A 32 1.179 2.947 -7.701 1.00 0.00 C ATOM 456 CE LYS A 32 0.748 3.878 -8.840 1.00 0.00 C ATOM 457 NZ LYS A 32 -0.142 4.958 -8.339 1.00 0.00 N1+ ATOM 0 H LYS A 32 4.921 0.566 -5.132 1.00 0.00 H new ATOM 0 HA LYS A 32 4.150 0.060 -7.981 1.00 0.00 H new ATOM 0 HB2 LYS A 32 2.274 0.789 -6.482 1.00 0.00 H new ATOM 0 HB3 LYS A 32 3.211 2.206 -6.048 1.00 0.00 H new ATOM 0 HG2 LYS A 32 3.213 2.943 -8.436 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.294 1.519 -8.882 1.00 0.00 H new ATOM 0 HD2 LYS A 32 0.394 2.218 -7.500 1.00 0.00 H new ATOM 0 HD3 LYS A 32 1.322 3.522 -6.786 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.629 4.316 -9.309 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.231 3.303 -9.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -0.433 5.564 -9.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.984 4.537 -7.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.368 5.530 -7.636 1.00 0.00 H new ATOM 471 N ALA A 33 5.682 1.895 -8.795 1.00 0.00 N ATOM 472 CA ALA A 33 6.780 2.733 -9.277 1.00 0.00 C ATOM 473 C ALA A 33 6.424 3.525 -10.547 1.00 0.00 C ATOM 474 O ALA A 33 5.406 3.270 -11.193 1.00 0.00 O ATOM 475 CB ALA A 33 8.001 1.826 -9.477 1.00 0.00 C ATOM 0 H ALA A 33 5.064 1.558 -9.533 1.00 0.00 H new ATOM 0 HA ALA A 33 7.000 3.501 -8.536 1.00 0.00 H new ATOM 0 HB1 ALA A 33 8.841 2.420 -9.837 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.267 1.360 -8.528 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.764 1.053 -10.208 1.00 0.00 H new ATOM 481 N THR A 34 7.254 4.508 -10.912 1.00 0.00 N ATOM 482 CA THR A 34 7.119 5.293 -12.153 1.00 0.00 C ATOM 483 C THR A 34 8.481 5.810 -12.620 1.00 0.00 C ATOM 484 O THR A 34 9.135 6.562 -11.894 1.00 0.00 O ATOM 485 CB THR A 34 6.166 6.481 -11.948 1.00 0.00 C ATOM 486 OG1 THR A 34 4.889 6.005 -11.571 1.00 0.00 O ATOM 487 CG2 THR A 34 5.959 7.311 -13.217 1.00 0.00 C ATOM 0 H THR A 34 8.055 4.789 -10.346 1.00 0.00 H new ATOM 0 HA THR A 34 6.707 4.633 -12.916 1.00 0.00 H new ATOM 0 HB THR A 34 6.626 7.105 -11.182 1.00 0.00 H new ATOM 0 HG1 THR A 34 4.283 6.764 -11.439 1.00 0.00 H new ATOM 0 HG21 THR A 34 5.276 8.134 -13.006 1.00 0.00 H new ATOM 0 HG22 THR A 34 6.917 7.710 -13.551 1.00 0.00 H new ATOM 0 HG23 THR A 34 5.536 6.680 -13.999 1.00 0.00 H new ATOM 495 N VAL A 35 8.910 5.415 -13.822 1.00 0.00 N ATOM 496 CA VAL A 35 10.103 5.956 -14.500 1.00 0.00 C ATOM 497 C VAL A 35 9.833 7.362 -15.050 1.00 0.00 C ATOM 498 O VAL A 35 8.740 7.641 -15.552 1.00 0.00 O ATOM 499 CB VAL A 35 10.558 5.005 -15.629 1.00 0.00 C ATOM 500 CG1 VAL A 35 11.750 5.537 -16.435 1.00 0.00 C ATOM 501 CG2 VAL A 35 11.016 3.664 -15.043 1.00 0.00 C ATOM 0 H VAL A 35 8.432 4.697 -14.366 1.00 0.00 H new ATOM 0 HA VAL A 35 10.906 6.032 -13.767 1.00 0.00 H new ATOM 0 HB VAL A 35 9.690 4.907 -16.282 1.00 0.00 H new ATOM 0 HG11 VAL A 35 12.015 4.818 -17.210 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.482 6.487 -16.898 1.00 0.00 H new ATOM 0 HG13 VAL A 35 12.601 5.685 -15.771 1.00 0.00 H new ATOM 0 HG21 VAL A 35 11.334 3.004 -15.850 1.00 0.00 H new ATOM 0 HG22 VAL A 35 11.850 3.831 -14.361 1.00 0.00 H new ATOM 0 HG23 VAL A 35 10.190 3.203 -14.501 1.00 0.00 H new ATOM 511 N PHE A 36 10.859 8.220 -15.032 1.00 0.00 N ATOM 512 CA PHE A 36 10.841 9.575 -15.583 1.00 0.00 C ATOM 513 C PHE A 36 12.107 9.794 -16.428 1.00 0.00 C ATOM 514 O PHE A 36 13.218 9.847 -15.902 1.00 0.00 O ATOM 515 CB PHE A 36 10.734 10.615 -14.458 1.00 0.00 C ATOM 516 CG PHE A 36 9.481 10.529 -13.603 1.00 0.00 C ATOM 517 CD1 PHE A 36 8.290 11.139 -14.042 1.00 0.00 C ATOM 518 CD2 PHE A 36 9.512 9.875 -12.355 1.00 0.00 C ATOM 519 CE1 PHE A 36 7.138 11.103 -13.236 1.00 0.00 C ATOM 520 CE2 PHE A 36 8.358 9.837 -11.552 1.00 0.00 C ATOM 521 CZ PHE A 36 7.174 10.456 -11.990 1.00 0.00 C ATOM 0 H PHE A 36 11.759 7.978 -14.617 1.00 0.00 H new ATOM 0 HA PHE A 36 9.966 9.697 -16.222 1.00 0.00 H new ATOM 0 HB2 PHE A 36 11.603 10.512 -13.809 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.783 11.610 -14.901 1.00 0.00 H new ATOM 0 HD1 PHE A 36 8.261 11.636 -15.000 1.00 0.00 H new ATOM 0 HD2 PHE A 36 10.422 9.403 -12.015 1.00 0.00 H new ATOM 0 HE1 PHE A 36 6.226 11.573 -13.575 1.00 0.00 H new ATOM 0 HE2 PHE A 36 8.381 9.332 -10.598 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.292 10.434 -11.368 1.00 0.00 H new ATOM 531 N GLU A 37 11.932 9.866 -17.750 1.00 0.00 N ATOM 532 CA GLU A 37 13.015 9.858 -18.751 1.00 0.00 C ATOM 533 C GLU A 37 13.711 11.220 -18.962 1.00 0.00 C ATOM 534 O GLU A 37 14.889 11.262 -19.327 1.00 0.00 O ATOM 535 CB GLU A 37 12.404 9.414 -20.088 1.00 0.00 C ATOM 536 CG GLU A 37 11.993 7.938 -20.121 1.00 0.00 C ATOM 537 CD GLU A 37 11.236 7.610 -21.422 1.00 0.00 C ATOM 538 OE1 GLU A 37 11.883 7.459 -22.486 1.00 0.00 O1- ATOM 539 OE2 GLU A 37 9.984 7.503 -21.392 1.00 0.00 O ATOM 0 H GLU A 37 11.006 9.934 -18.172 1.00 0.00 H new ATOM 0 HA GLU A 37 13.785 9.182 -18.380 1.00 0.00 H new ATOM 0 HB2 GLU A 37 11.530 10.030 -20.299 1.00 0.00 H new ATOM 0 HB3 GLU A 37 13.124 9.599 -20.885 1.00 0.00 H new ATOM 0 HG2 GLU A 37 12.878 7.307 -20.041 1.00 0.00 H new ATOM 0 HG3 GLU A 37 11.362 7.712 -19.261 1.00 0.00 H new ATOM 546 N ASP A 38 12.992 12.324 -18.741 1.00 0.00 N ATOM 547 CA ASP A 38 13.457 13.711 -18.931 1.00 0.00 C ATOM 548 C ASP A 38 12.856 14.652 -17.851 1.00 0.00 C ATOM 549 O ASP A 38 12.124 15.596 -18.175 1.00 0.00 O ATOM 550 CB ASP A 38 13.119 14.134 -20.374 1.00 0.00 C ATOM 551 CG ASP A 38 13.613 15.545 -20.743 1.00 0.00 C ATOM 552 OD1 ASP A 38 14.771 15.902 -20.414 1.00 0.00 O ATOM 553 OD2 ASP A 38 12.859 16.287 -21.420 1.00 0.00 O1- ATOM 0 H ASP A 38 12.028 12.279 -18.411 1.00 0.00 H new ATOM 0 HA ASP A 38 14.537 13.781 -18.800 1.00 0.00 H new ATOM 0 HB2 ASP A 38 13.557 13.414 -21.065 1.00 0.00 H new ATOM 0 HB3 ASP A 38 12.039 14.091 -20.511 1.00 0.00 H new ATOM 558 N PRO A 39 13.065 14.351 -16.551 1.00 0.00 N ATOM 559 CA PRO A 39 12.380 15.016 -15.445 1.00 0.00 C ATOM 560 C PRO A 39 12.851 16.446 -15.137 1.00 0.00 C ATOM 561 O PRO A 39 13.942 16.883 -15.512 1.00 0.00 O ATOM 562 CB PRO A 39 12.650 14.128 -14.224 1.00 0.00 C ATOM 563 CG PRO A 39 14.016 13.519 -14.530 1.00 0.00 C ATOM 564 CD PRO A 39 13.955 13.316 -16.037 1.00 0.00 C ATOM 0 HA PRO A 39 11.329 15.130 -15.710 1.00 0.00 H new ATOM 0 HB2 PRO A 39 12.665 14.707 -13.301 1.00 0.00 H new ATOM 0 HB3 PRO A 39 11.884 13.361 -14.107 1.00 0.00 H new ATOM 0 HG2 PRO A 39 14.830 14.184 -14.243 1.00 0.00 H new ATOM 0 HG3 PRO A 39 14.170 12.579 -14.000 1.00 0.00 H new ATOM 0 HD2 PRO A 39 14.947 13.399 -16.482 1.00 0.00 H new ATOM 0 HD3 PRO A 39 13.579 12.323 -16.281 1.00 0.00 H new ATOM 572 N GLU A 40 12.029 17.144 -14.353 1.00 0.00 N ATOM 573 CA GLU A 40 12.311 18.430 -13.714 1.00 0.00 C ATOM 574 C GLU A 40 11.866 18.386 -12.237 1.00 0.00 C ATOM 575 O GLU A 40 11.209 17.435 -11.805 1.00 0.00 O ATOM 576 CB GLU A 40 11.641 19.596 -14.468 1.00 0.00 C ATOM 577 CG GLU A 40 10.107 19.523 -14.501 1.00 0.00 C ATOM 578 CD GLU A 40 9.494 20.921 -14.696 1.00 0.00 C ATOM 579 OE1 GLU A 40 9.333 21.369 -15.859 1.00 0.00 O1- ATOM 580 OE2 GLU A 40 9.164 21.576 -13.676 1.00 0.00 O ATOM 0 H GLU A 40 11.092 16.806 -14.134 1.00 0.00 H new ATOM 0 HA GLU A 40 13.386 18.607 -13.751 1.00 0.00 H new ATOM 0 HB2 GLU A 40 11.939 20.535 -14.002 1.00 0.00 H new ATOM 0 HB3 GLU A 40 12.015 19.615 -15.492 1.00 0.00 H new ATOM 0 HG2 GLU A 40 9.788 18.866 -15.310 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.740 19.087 -13.572 1.00 0.00 H new ATOM 587 N LEU A 41 12.197 19.413 -11.443 1.00 0.00 N ATOM 588 CA LEU A 41 11.855 19.469 -10.011 1.00 0.00 C ATOM 589 C LEU A 41 10.366 19.192 -9.736 1.00 0.00 C ATOM 590 O LEU A 41 10.061 18.448 -8.811 1.00 0.00 O ATOM 591 CB LEU A 41 12.357 20.815 -9.453 1.00 0.00 C ATOM 592 CG LEU A 41 12.169 21.124 -7.951 1.00 0.00 C ATOM 593 CD1 LEU A 41 10.804 21.735 -7.631 1.00 0.00 C ATOM 594 CD2 LEU A 41 12.428 19.944 -7.017 1.00 0.00 C ATOM 0 H LEU A 41 12.710 20.230 -11.773 1.00 0.00 H new ATOM 0 HA LEU A 41 12.359 18.662 -9.480 1.00 0.00 H new ATOM 0 HB2 LEU A 41 13.423 20.884 -9.672 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.864 21.608 -10.016 1.00 0.00 H new ATOM 0 HG LEU A 41 12.945 21.864 -7.756 1.00 0.00 H new ATOM 0 HD11 LEU A 41 10.734 21.929 -6.561 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.687 22.671 -8.178 1.00 0.00 H new ATOM 0 HD13 LEU A 41 10.017 21.041 -7.926 1.00 0.00 H new ATOM 0 HD21 LEU A 41 12.271 20.256 -5.984 1.00 0.00 H new ATOM 0 HD22 LEU A 41 11.743 19.132 -7.258 1.00 0.00 H new ATOM 0 HD23 LEU A 41 13.455 19.601 -7.141 1.00 0.00 H new ATOM 606 N SER A 42 9.442 19.693 -10.561 1.00 0.00 N ATOM 607 CA SER A 42 7.996 19.433 -10.413 1.00 0.00 C ATOM 608 C SER A 42 7.599 17.942 -10.461 1.00 0.00 C ATOM 609 O SER A 42 6.526 17.591 -9.970 1.00 0.00 O ATOM 610 CB SER A 42 7.194 20.174 -11.494 1.00 0.00 C ATOM 611 OG SER A 42 7.567 21.538 -11.602 1.00 0.00 O ATOM 0 H SER A 42 9.670 20.292 -11.354 1.00 0.00 H new ATOM 0 HA SER A 42 7.757 19.801 -9.415 1.00 0.00 H new ATOM 0 HB2 SER A 42 7.343 19.682 -12.455 1.00 0.00 H new ATOM 0 HB3 SER A 42 6.131 20.108 -11.264 1.00 0.00 H new ATOM 0 HG SER A 42 8.163 21.654 -12.371 1.00 0.00 H new ATOM 617 N ASP A 43 8.437 17.060 -11.022 1.00 0.00 N ATOM 618 CA ASP A 43 8.226 15.604 -11.012 1.00 0.00 C ATOM 619 C ASP A 43 8.754 14.940 -9.724 1.00 0.00 C ATOM 620 O ASP A 43 8.166 13.968 -9.246 1.00 0.00 O ATOM 621 CB ASP A 43 8.916 14.956 -12.222 1.00 0.00 C ATOM 622 CG ASP A 43 8.415 15.523 -13.561 1.00 0.00 C ATOM 623 OD1 ASP A 43 7.196 15.412 -13.850 1.00 0.00 O ATOM 624 OD2 ASP A 43 9.245 16.057 -14.336 1.00 0.00 O1- ATOM 0 H ASP A 43 9.292 17.340 -11.502 1.00 0.00 H new ATOM 0 HA ASP A 43 7.149 15.446 -11.059 1.00 0.00 H new ATOM 0 HB2 ASP A 43 9.993 15.109 -12.147 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.745 13.880 -12.200 1.00 0.00 H new ATOM 629 N TRP A 44 9.840 15.473 -9.146 1.00 0.00 N ATOM 630 CA TRP A 44 10.429 15.005 -7.884 1.00 0.00 C ATOM 631 C TRP A 44 9.655 15.498 -6.654 1.00 0.00 C ATOM 632 O TRP A 44 9.423 14.753 -5.700 1.00 0.00 O ATOM 633 CB TRP A 44 11.888 15.479 -7.833 1.00 0.00 C ATOM 634 CG TRP A 44 12.672 15.056 -6.637 1.00 0.00 C ATOM 635 CD1 TRP A 44 12.639 15.625 -5.410 1.00 0.00 C ATOM 636 CD2 TRP A 44 13.631 13.962 -6.550 1.00 0.00 C ATOM 637 NE1 TRP A 44 13.495 14.943 -4.566 1.00 0.00 N ATOM 638 CE2 TRP A 44 14.134 13.905 -5.220 1.00 0.00 C ATOM 639 CE3 TRP A 44 14.119 13.004 -7.464 1.00 0.00 C ATOM 640 CZ2 TRP A 44 15.062 12.932 -4.826 1.00 0.00 C ATOM 641 CZ3 TRP A 44 15.030 12.007 -7.068 1.00 0.00 C ATOM 642 CH2 TRP A 44 15.516 11.981 -5.754 1.00 0.00 C ATOM 0 H TRP A 44 10.345 16.260 -9.553 1.00 0.00 H new ATOM 0 HA TRP A 44 10.377 13.917 -7.856 1.00 0.00 H new ATOM 0 HB2 TRP A 44 12.399 15.115 -8.725 1.00 0.00 H new ATOM 0 HB3 TRP A 44 11.897 16.568 -7.882 1.00 0.00 H new ATOM 0 HD1 TRP A 44 12.038 16.479 -5.133 1.00 0.00 H new ATOM 0 HE1 TRP A 44 13.638 15.176 -3.583 1.00 0.00 H new ATOM 0 HE3 TRP A 44 13.786 13.037 -8.491 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 15.428 12.913 -3.810 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 15.355 11.261 -7.778 1.00 0.00 H new ATOM 0 HH2 TRP A 44 16.236 11.233 -5.456 1.00 0.00 H new ATOM 653 N LEU A 45 9.227 16.762 -6.705 1.00 0.00 N ATOM 654 CA LEU A 45 8.549 17.542 -5.669 1.00 0.00 C ATOM 655 C LEU A 45 7.458 16.783 -4.864 1.00 0.00 C ATOM 656 O LEU A 45 7.517 16.859 -3.631 1.00 0.00 O ATOM 657 CB LEU A 45 8.098 18.846 -6.372 1.00 0.00 C ATOM 658 CG LEU A 45 7.157 19.801 -5.629 1.00 0.00 C ATOM 659 CD1 LEU A 45 7.783 20.312 -4.334 1.00 0.00 C ATOM 660 CD2 LEU A 45 6.840 21.007 -6.517 1.00 0.00 C ATOM 0 H LEU A 45 9.359 17.316 -7.552 1.00 0.00 H new ATOM 0 HA LEU A 45 9.226 17.771 -4.846 1.00 0.00 H new ATOM 0 HB2 LEU A 45 8.995 19.406 -6.635 1.00 0.00 H new ATOM 0 HB3 LEU A 45 7.612 18.565 -7.307 1.00 0.00 H new ATOM 0 HG LEU A 45 6.250 19.246 -5.389 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.087 20.986 -3.835 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.004 19.469 -3.679 1.00 0.00 H new ATOM 0 HD13 LEU A 45 8.705 20.846 -4.562 1.00 0.00 H new ATOM 0 HD21 LEU A 45 6.171 21.684 -5.986 1.00 0.00 H new ATOM 0 HD22 LEU A 45 7.764 21.530 -6.764 1.00 0.00 H new ATOM 0 HD23 LEU A 45 6.359 20.667 -7.434 1.00 0.00 H new ATOM 672 N PRO A 46 6.515 16.026 -5.471 1.00 0.00 N ATOM 673 CA PRO A 46 5.487 15.260 -4.744 1.00 0.00 C ATOM 674 C PRO A 46 5.997 14.122 -3.835 1.00 0.00 C ATOM 675 O PRO A 46 5.341 13.791 -2.845 1.00 0.00 O ATOM 676 CB PRO A 46 4.571 14.663 -5.822 1.00 0.00 C ATOM 677 CG PRO A 46 4.791 15.553 -7.039 1.00 0.00 C ATOM 678 CD PRO A 46 6.260 15.931 -6.903 1.00 0.00 C ATOM 0 HA PRO A 46 4.997 15.949 -4.056 1.00 0.00 H new ATOM 0 HB2 PRO A 46 4.831 13.626 -6.035 1.00 0.00 H new ATOM 0 HB3 PRO A 46 3.528 14.671 -5.507 1.00 0.00 H new ATOM 0 HG2 PRO A 46 4.592 15.024 -7.971 1.00 0.00 H new ATOM 0 HG3 PRO A 46 4.143 16.429 -7.025 1.00 0.00 H new ATOM 0 HD2 PRO A 46 6.901 15.181 -7.365 1.00 0.00 H new ATOM 0 HD3 PRO A 46 6.468 16.878 -7.401 1.00 0.00 H new ATOM 686 N TYR A 47 7.141 13.502 -4.152 1.00 0.00 N ATOM 687 CA TYR A 47 7.610 12.272 -3.490 1.00 0.00 C ATOM 688 C TYR A 47 8.290 12.488 -2.124 1.00 0.00 C ATOM 689 O TYR A 47 8.719 11.523 -1.492 1.00 0.00 O ATOM 690 CB TYR A 47 8.524 11.486 -4.443 1.00 0.00 C ATOM 691 CG TYR A 47 7.811 10.844 -5.621 1.00 0.00 C ATOM 692 CD1 TYR A 47 7.290 9.540 -5.497 1.00 0.00 C ATOM 693 CD2 TYR A 47 7.692 11.533 -6.842 1.00 0.00 C ATOM 694 CE1 TYR A 47 6.633 8.932 -6.585 1.00 0.00 C ATOM 695 CE2 TYR A 47 7.048 10.922 -7.937 1.00 0.00 C ATOM 696 CZ TYR A 47 6.513 9.623 -7.811 1.00 0.00 C ATOM 697 OH TYR A 47 5.885 9.038 -8.869 1.00 0.00 O ATOM 0 H TYR A 47 7.773 13.839 -4.879 1.00 0.00 H new ATOM 0 HA TYR A 47 6.715 11.694 -3.262 1.00 0.00 H new ATOM 0 HB2 TYR A 47 9.293 12.158 -4.824 1.00 0.00 H new ATOM 0 HB3 TYR A 47 9.034 10.707 -3.876 1.00 0.00 H new ATOM 0 HD1 TYR A 47 7.395 9.005 -4.565 1.00 0.00 H new ATOM 0 HD2 TYR A 47 8.094 12.530 -6.940 1.00 0.00 H new ATOM 0 HE1 TYR A 47 6.222 7.939 -6.482 1.00 0.00 H new ATOM 0 HE2 TYR A 47 6.964 11.450 -8.875 1.00 0.00 H new ATOM 0 HH TYR A 47 6.315 9.322 -9.703 1.00 0.00 H new ATOM 707 N GLN A 48 8.364 13.725 -1.617 1.00 0.00 N ATOM 708 CA GLN A 48 8.894 14.032 -0.275 1.00 0.00 C ATOM 709 C GLN A 48 8.122 13.360 0.879 1.00 0.00 C ATOM 710 O GLN A 48 8.694 13.140 1.946 1.00 0.00 O ATOM 711 CB GLN A 48 8.904 15.551 -0.071 1.00 0.00 C ATOM 712 CG GLN A 48 9.957 16.250 -0.943 1.00 0.00 C ATOM 713 CD GLN A 48 9.862 17.757 -0.765 1.00 0.00 C ATOM 714 OE1 GLN A 48 10.450 18.348 0.130 1.00 0.00 O ATOM 715 NE2 GLN A 48 9.083 18.424 -1.587 1.00 0.00 N ATOM 0 H GLN A 48 8.056 14.552 -2.129 1.00 0.00 H new ATOM 0 HA GLN A 48 9.903 13.621 -0.241 1.00 0.00 H new ATOM 0 HB2 GLN A 48 7.918 15.953 -0.304 1.00 0.00 H new ATOM 0 HB3 GLN A 48 9.099 15.773 0.978 1.00 0.00 H new ATOM 0 HG2 GLN A 48 10.954 15.905 -0.670 1.00 0.00 H new ATOM 0 HG3 GLN A 48 9.805 15.989 -1.990 1.00 0.00 H new ATOM 0 HE21 GLN A 48 8.591 17.934 -2.334 1.00 0.00 H new ATOM 0 HE22 GLN A 48 8.970 19.432 -1.478 1.00 0.00 H new ATOM 724 N ASP A 49 6.852 12.995 0.673 1.00 0.00 N ATOM 725 CA ASP A 49 6.035 12.215 1.622 1.00 0.00 C ATOM 726 C ASP A 49 6.196 10.683 1.446 1.00 0.00 C ATOM 727 O ASP A 49 5.527 9.895 2.119 1.00 0.00 O ATOM 728 CB ASP A 49 4.572 12.652 1.439 1.00 0.00 C ATOM 729 CG ASP A 49 3.634 12.147 2.553 1.00 0.00 C ATOM 730 OD1 ASP A 49 3.908 12.419 3.747 1.00 0.00 O1- ATOM 731 OD2 ASP A 49 2.589 11.530 2.232 1.00 0.00 O ATOM 0 H ASP A 49 6.347 13.238 -0.179 1.00 0.00 H new ATOM 0 HA ASP A 49 6.376 12.418 2.637 1.00 0.00 H new ATOM 0 HB2 ASP A 49 4.528 13.741 1.404 1.00 0.00 H new ATOM 0 HB3 ASP A 49 4.210 12.288 0.478 1.00 0.00 H new ATOM 736 N LYS A 50 7.084 10.256 0.534 1.00 0.00 N ATOM 737 CA LYS A 50 7.241 8.878 0.035 1.00 0.00 C ATOM 738 C LYS A 50 8.733 8.495 -0.070 1.00 0.00 C ATOM 739 O LYS A 50 9.510 8.795 0.844 1.00 0.00 O ATOM 740 CB LYS A 50 6.480 8.773 -1.314 1.00 0.00 C ATOM 741 CG LYS A 50 5.023 9.260 -1.243 1.00 0.00 C ATOM 742 CD LYS A 50 4.311 9.183 -2.596 1.00 0.00 C ATOM 743 CE LYS A 50 2.912 9.790 -2.421 1.00 0.00 C ATOM 744 NZ LYS A 50 2.168 9.800 -3.706 1.00 0.00 N1+ ATOM 0 H LYS A 50 7.749 10.897 0.101 1.00 0.00 H new ATOM 0 HA LYS A 50 6.811 8.158 0.731 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.012 9.355 -2.067 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.491 7.735 -1.647 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.478 8.659 -0.515 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.005 10.289 -0.885 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.872 9.728 -3.355 1.00 0.00 H new ATOM 0 HD3 LYS A 50 4.240 8.149 -2.933 1.00 0.00 H new ATOM 0 HE2 LYS A 50 2.355 9.218 -1.679 1.00 0.00 H new ATOM 0 HE3 LYS A 50 2.999 10.807 -2.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 1.147 9.750 -3.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.381 10.676 -4.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.454 8.981 -4.279 1.00 0.00 H new ATOM 758 N TYR A 51 9.117 7.822 -1.159 1.00 0.00 N ATOM 759 CA TYR A 51 10.484 7.406 -1.482 1.00 0.00 C ATOM 760 C TYR A 51 10.760 7.573 -2.985 1.00 0.00 C ATOM 761 O TYR A 51 9.843 7.702 -3.800 1.00 0.00 O ATOM 762 CB TYR A 51 10.699 5.930 -1.109 1.00 0.00 C ATOM 763 CG TYR A 51 10.298 5.493 0.286 1.00 0.00 C ATOM 764 CD1 TYR A 51 8.959 5.133 0.546 1.00 0.00 C ATOM 765 CD2 TYR A 51 11.278 5.312 1.280 1.00 0.00 C ATOM 766 CE1 TYR A 51 8.600 4.584 1.791 1.00 0.00 C ATOM 767 CE2 TYR A 51 10.927 4.746 2.522 1.00 0.00 C ATOM 768 CZ TYR A 51 9.586 4.388 2.782 1.00 0.00 C ATOM 769 OH TYR A 51 9.249 3.842 3.978 1.00 0.00 O ATOM 0 H TYR A 51 8.448 7.539 -1.875 1.00 0.00 H new ATOM 0 HA TYR A 51 11.166 8.036 -0.911 1.00 0.00 H new ATOM 0 HB2 TYR A 51 10.148 5.319 -1.824 1.00 0.00 H new ATOM 0 HB3 TYR A 51 11.756 5.700 -1.242 1.00 0.00 H new ATOM 0 HD1 TYR A 51 8.206 5.279 -0.214 1.00 0.00 H new ATOM 0 HD2 TYR A 51 12.300 5.607 1.091 1.00 0.00 H new ATOM 0 HE1 TYR A 51 7.573 4.313 1.988 1.00 0.00 H new ATOM 0 HE2 TYR A 51 11.684 4.586 3.275 1.00 0.00 H new ATOM 0 HH TYR A 51 10.046 3.776 4.544 1.00 0.00 H new ATOM 779 N VAL A 52 12.039 7.543 -3.359 1.00 0.00 N ATOM 780 CA VAL A 52 12.533 7.805 -4.723 1.00 0.00 C ATOM 781 C VAL A 52 13.736 6.914 -5.074 1.00 0.00 C ATOM 782 O VAL A 52 14.218 6.140 -4.246 1.00 0.00 O ATOM 783 CB VAL A 52 12.841 9.308 -4.915 1.00 0.00 C ATOM 784 CG1 VAL A 52 11.581 10.171 -4.814 1.00 0.00 C ATOM 785 CG2 VAL A 52 13.844 9.866 -3.909 1.00 0.00 C ATOM 0 H VAL A 52 12.790 7.329 -2.703 1.00 0.00 H new ATOM 0 HA VAL A 52 11.741 7.542 -5.424 1.00 0.00 H new ATOM 0 HB VAL A 52 13.271 9.358 -5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 52 11.845 11.219 -4.955 1.00 0.00 H new ATOM 0 HG12 VAL A 52 10.871 9.869 -5.584 1.00 0.00 H new ATOM 0 HG13 VAL A 52 11.128 10.040 -3.831 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.008 10.925 -4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.453 9.743 -2.899 1.00 0.00 H new ATOM 0 HG23 VAL A 52 14.788 9.329 -4.000 1.00 0.00 H new ATOM 795 N LEU A 53 14.200 6.991 -6.320 1.00 0.00 N ATOM 796 CA LEU A 53 15.313 6.228 -6.887 1.00 0.00 C ATOM 797 C LEU A 53 15.947 7.057 -8.018 1.00 0.00 C ATOM 798 O LEU A 53 15.242 7.763 -8.743 1.00 0.00 O ATOM 799 CB LEU A 53 14.748 4.898 -7.427 1.00 0.00 C ATOM 800 CG LEU A 53 15.650 3.651 -7.376 1.00 0.00 C ATOM 801 CD1 LEU A 53 14.848 2.461 -7.911 1.00 0.00 C ATOM 802 CD2 LEU A 53 16.931 3.751 -8.200 1.00 0.00 C ATOM 0 H LEU A 53 13.785 7.625 -7.002 1.00 0.00 H new ATOM 0 HA LEU A 53 16.078 6.016 -6.140 1.00 0.00 H new ATOM 0 HB2 LEU A 53 13.837 4.673 -6.872 1.00 0.00 H new ATOM 0 HB3 LEU A 53 14.457 5.057 -8.466 1.00 0.00 H new ATOM 0 HG LEU A 53 15.955 3.540 -6.335 1.00 0.00 H new ATOM 0 HD11 LEU A 53 15.467 1.564 -7.885 1.00 0.00 H new ATOM 0 HD12 LEU A 53 13.964 2.310 -7.292 1.00 0.00 H new ATOM 0 HD13 LEU A 53 14.542 2.661 -8.938 1.00 0.00 H new ATOM 0 HD21 LEU A 53 17.500 2.826 -8.102 1.00 0.00 H new ATOM 0 HD22 LEU A 53 16.678 3.912 -9.248 1.00 0.00 H new ATOM 0 HD23 LEU A 53 17.531 4.586 -7.840 1.00 0.00 H new ATOM 814 N VAL A 54 17.261 6.944 -8.199 1.00 0.00 N ATOM 815 CA VAL A 54 18.028 7.696 -9.203 1.00 0.00 C ATOM 816 C VAL A 54 18.829 6.730 -10.066 1.00 0.00 C ATOM 817 O VAL A 54 19.484 5.834 -9.534 1.00 0.00 O ATOM 818 CB VAL A 54 18.977 8.686 -8.513 1.00 0.00 C ATOM 819 CG1 VAL A 54 19.847 9.461 -9.514 1.00 0.00 C ATOM 820 CG2 VAL A 54 18.188 9.708 -7.684 1.00 0.00 C ATOM 0 H VAL A 54 17.839 6.315 -7.642 1.00 0.00 H new ATOM 0 HA VAL A 54 17.335 8.254 -9.833 1.00 0.00 H new ATOM 0 HB VAL A 54 19.623 8.086 -7.873 1.00 0.00 H new ATOM 0 HG11 VAL A 54 20.500 10.147 -8.974 1.00 0.00 H new ATOM 0 HG12 VAL A 54 20.453 8.760 -10.088 1.00 0.00 H new ATOM 0 HG13 VAL A 54 19.207 10.026 -10.191 1.00 0.00 H new ATOM 0 HG21 VAL A 54 18.880 10.399 -7.204 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.514 10.264 -8.337 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.608 9.188 -6.922 1.00 0.00 H new ATOM 830 N VAL A 55 18.771 6.920 -11.386 1.00 0.00 N ATOM 831 CA VAL A 55 19.397 6.047 -12.391 1.00 0.00 C ATOM 832 C VAL A 55 20.087 6.925 -13.449 1.00 0.00 C ATOM 833 O VAL A 55 19.467 7.302 -14.443 1.00 0.00 O ATOM 834 CB VAL A 55 18.362 5.067 -12.989 1.00 0.00 C ATOM 835 CG1 VAL A 55 19.083 3.912 -13.683 1.00 0.00 C ATOM 836 CG2 VAL A 55 17.449 4.422 -11.933 1.00 0.00 C ATOM 0 H VAL A 55 18.273 7.708 -11.801 1.00 0.00 H new ATOM 0 HA VAL A 55 20.160 5.421 -11.929 1.00 0.00 H new ATOM 0 HB VAL A 55 17.758 5.664 -13.672 1.00 0.00 H new ATOM 0 HG11 VAL A 55 18.349 3.224 -14.103 1.00 0.00 H new ATOM 0 HG12 VAL A 55 19.712 4.304 -14.483 1.00 0.00 H new ATOM 0 HG13 VAL A 55 19.703 3.383 -12.959 1.00 0.00 H new ATOM 0 HG21 VAL A 55 16.748 3.746 -12.422 1.00 0.00 H new ATOM 0 HG22 VAL A 55 18.055 3.862 -11.221 1.00 0.00 H new ATOM 0 HG23 VAL A 55 16.896 5.200 -11.406 1.00 0.00 H new ATOM 846 N THR A 56 21.371 7.258 -13.255 1.00 0.00 N ATOM 847 CA THR A 56 22.056 8.295 -14.071 1.00 0.00 C ATOM 848 C THR A 56 23.473 7.941 -14.559 1.00 0.00 C ATOM 849 O THR A 56 24.264 7.365 -13.814 1.00 0.00 O ATOM 850 CB THR A 56 22.103 9.597 -13.243 1.00 0.00 C ATOM 851 OG1 THR A 56 20.789 9.999 -12.931 1.00 0.00 O ATOM 852 CG2 THR A 56 22.754 10.786 -13.944 1.00 0.00 C ATOM 0 H THR A 56 21.963 6.830 -12.543 1.00 0.00 H new ATOM 0 HA THR A 56 21.472 8.395 -14.986 1.00 0.00 H new ATOM 0 HB THR A 56 22.707 9.348 -12.371 1.00 0.00 H new ATOM 0 HG1 THR A 56 20.807 10.610 -12.165 1.00 0.00 H new ATOM 0 HG21 THR A 56 22.739 11.652 -13.282 1.00 0.00 H new ATOM 0 HG22 THR A 56 23.786 10.540 -14.196 1.00 0.00 H new ATOM 0 HG23 THR A 56 22.203 11.017 -14.856 1.00 0.00 H new ATOM 860 N SER A 57 23.801 8.339 -15.797 1.00 0.00 N ATOM 861 CA SER A 57 25.110 8.140 -16.464 1.00 0.00 C ATOM 862 C SER A 57 26.060 9.358 -16.319 1.00 0.00 C ATOM 863 O SER A 57 25.807 10.237 -15.499 1.00 0.00 O ATOM 864 CB SER A 57 24.902 7.755 -17.938 1.00 0.00 C ATOM 865 OG SER A 57 23.798 6.869 -18.048 1.00 0.00 O ATOM 0 H SER A 57 23.136 8.831 -16.393 1.00 0.00 H new ATOM 0 HA SER A 57 25.609 7.317 -15.953 1.00 0.00 H new ATOM 0 HB2 SER A 57 24.725 8.649 -18.536 1.00 0.00 H new ATOM 0 HB3 SER A 57 25.802 7.282 -18.331 1.00 0.00 H new ATOM 0 HG SER A 57 23.666 6.626 -18.988 1.00 0.00 H new ATOM 871 N THR A 58 27.148 9.455 -17.106 1.00 0.00 N ATOM 872 CA THR A 58 28.125 10.580 -17.075 1.00 0.00 C ATOM 873 C THR A 58 28.439 11.103 -18.493 1.00 0.00 C ATOM 874 O THR A 58 28.379 10.351 -19.462 1.00 0.00 O ATOM 875 CB THR A 58 29.409 10.127 -16.352 1.00 0.00 C ATOM 876 OG1 THR A 58 29.095 9.628 -15.073 1.00 0.00 O ATOM 877 CG2 THR A 58 30.433 11.233 -16.103 1.00 0.00 C ATOM 0 H THR A 58 27.385 8.744 -17.798 1.00 0.00 H new ATOM 0 HA THR A 58 27.680 11.409 -16.525 1.00 0.00 H new ATOM 0 HB THR A 58 29.840 9.386 -17.025 1.00 0.00 H new ATOM 0 HG1 THR A 58 28.690 8.740 -15.159 1.00 0.00 H new ATOM 0 HG21 THR A 58 31.300 10.817 -15.590 1.00 0.00 H new ATOM 0 HG22 THR A 58 30.745 11.661 -17.056 1.00 0.00 H new ATOM 0 HG23 THR A 58 29.985 12.011 -15.485 1.00 0.00 H new ATOM 885 N THR A 59 28.767 12.395 -18.622 1.00 0.00 N ATOM 886 CA THR A 59 29.023 13.134 -19.879 1.00 0.00 C ATOM 887 C THR A 59 30.071 14.231 -19.629 1.00 0.00 C ATOM 888 O THR A 59 30.761 14.186 -18.617 1.00 0.00 O ATOM 889 CB THR A 59 27.725 13.779 -20.415 1.00 0.00 C ATOM 890 OG1 THR A 59 27.166 14.610 -19.432 1.00 0.00 O ATOM 891 CG2 THR A 59 26.672 12.765 -20.840 1.00 0.00 C ATOM 0 H THR A 59 28.869 12.996 -17.804 1.00 0.00 H new ATOM 0 HA THR A 59 29.393 12.428 -20.622 1.00 0.00 H new ATOM 0 HB THR A 59 28.013 14.345 -21.301 1.00 0.00 H new ATOM 0 HG1 THR A 59 26.440 15.138 -19.825 1.00 0.00 H new ATOM 0 HG21 THR A 59 25.789 13.289 -21.205 1.00 0.00 H new ATOM 0 HG22 THR A 59 27.074 12.134 -21.633 1.00 0.00 H new ATOM 0 HG23 THR A 59 26.399 12.145 -19.986 1.00 0.00 H new ATOM 930 N ASP A 63 30.529 15.566 -16.163 1.00 0.00 N ATOM 931 CA ASP A 63 29.232 16.226 -15.978 1.00 0.00 C ATOM 932 C ASP A 63 28.043 15.244 -15.910 1.00 0.00 C ATOM 933 O ASP A 63 28.165 14.051 -16.216 1.00 0.00 O ATOM 934 CB ASP A 63 29.038 17.209 -17.150 1.00 0.00 C ATOM 935 CG ASP A 63 27.963 18.289 -16.912 1.00 0.00 C ATOM 936 OD1 ASP A 63 27.536 18.500 -15.751 1.00 0.00 O ATOM 937 OD2 ASP A 63 27.590 18.973 -17.895 1.00 0.00 O1- ATOM 0 HA ASP A 63 29.246 16.738 -15.016 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.989 17.701 -17.355 1.00 0.00 H new ATOM 0 HB3 ASP A 63 28.773 16.642 -18.042 1.00 0.00 H new ATOM 942 N LEU A 64 26.881 15.757 -15.507 1.00 0.00 N ATOM 943 CA LEU A 64 25.594 15.068 -15.582 1.00 0.00 C ATOM 944 C LEU A 64 25.042 15.145 -17.028 1.00 0.00 C ATOM 945 O LEU A 64 25.205 16.180 -17.685 1.00 0.00 O ATOM 946 CB LEU A 64 24.566 15.707 -14.625 1.00 0.00 C ATOM 947 CG LEU A 64 24.980 15.747 -13.138 1.00 0.00 C ATOM 948 CD1 LEU A 64 25.524 17.122 -12.749 1.00 0.00 C ATOM 949 CD2 LEU A 64 23.777 15.454 -12.240 1.00 0.00 C ATOM 0 H LEU A 64 26.808 16.692 -15.107 1.00 0.00 H new ATOM 0 HA LEU A 64 25.752 14.029 -15.291 1.00 0.00 H new ATOM 0 HB2 LEU A 64 24.370 16.726 -14.958 1.00 0.00 H new ATOM 0 HB3 LEU A 64 23.628 15.159 -14.709 1.00 0.00 H new ATOM 0 HG LEU A 64 25.754 14.992 -13.003 1.00 0.00 H new ATOM 0 HD11 LEU A 64 25.806 17.117 -11.696 1.00 0.00 H new ATOM 0 HD12 LEU A 64 26.398 17.353 -13.358 1.00 0.00 H new ATOM 0 HD13 LEU A 64 24.756 17.877 -12.915 1.00 0.00 H new ATOM 0 HD21 LEU A 64 24.086 15.486 -11.195 1.00 0.00 H new ATOM 0 HD22 LEU A 64 23.003 16.202 -12.413 1.00 0.00 H new ATOM 0 HD23 LEU A 64 23.383 14.464 -12.471 1.00 0.00 H new ATOM 961 N PRO A 65 24.335 14.110 -17.522 1.00 0.00 N ATOM 962 CA PRO A 65 23.686 14.134 -18.827 1.00 0.00 C ATOM 963 C PRO A 65 22.546 15.153 -18.837 1.00 0.00 C ATOM 964 O PRO A 65 21.793 15.280 -17.869 1.00 0.00 O ATOM 965 CB PRO A 65 23.189 12.707 -19.070 1.00 0.00 C ATOM 966 CG PRO A 65 22.995 12.152 -17.665 1.00 0.00 C ATOM 967 CD PRO A 65 24.013 12.893 -16.810 1.00 0.00 C ATOM 0 HA PRO A 65 24.366 14.441 -19.621 1.00 0.00 H new ATOM 0 HB2 PRO A 65 22.258 12.698 -19.637 1.00 0.00 H new ATOM 0 HB3 PRO A 65 23.913 12.121 -19.636 1.00 0.00 H new ATOM 0 HG2 PRO A 65 21.979 12.324 -17.309 1.00 0.00 H new ATOM 0 HG3 PRO A 65 23.164 11.076 -17.638 1.00 0.00 H new ATOM 0 HD2 PRO A 65 23.604 13.116 -15.825 1.00 0.00 H new ATOM 0 HD3 PRO A 65 24.905 12.286 -16.655 1.00 0.00 H new ATOM 975 N ASP A 66 22.392 15.879 -19.944 1.00 0.00 N ATOM 976 CA ASP A 66 21.486 17.027 -20.008 1.00 0.00 C ATOM 977 C ASP A 66 20.024 16.679 -19.679 1.00 0.00 C ATOM 978 O ASP A 66 19.321 17.498 -19.095 1.00 0.00 O ATOM 979 CB ASP A 66 21.607 17.696 -21.381 1.00 0.00 C ATOM 980 CG ASP A 66 20.815 19.011 -21.449 1.00 0.00 C ATOM 981 OD1 ASP A 66 21.226 19.995 -20.789 1.00 0.00 O ATOM 982 OD2 ASP A 66 19.801 19.072 -22.185 1.00 0.00 O1- ATOM 0 H ASP A 66 22.887 15.691 -20.816 1.00 0.00 H new ATOM 0 HA ASP A 66 21.793 17.726 -19.230 1.00 0.00 H new ATOM 0 HB2 ASP A 66 22.657 17.893 -21.598 1.00 0.00 H new ATOM 0 HB3 ASP A 66 21.245 17.014 -22.150 1.00 0.00 H new ATOM 987 N SER A 67 19.596 15.441 -19.948 1.00 0.00 N ATOM 988 CA SER A 67 18.263 14.916 -19.601 1.00 0.00 C ATOM 989 C SER A 67 17.916 14.931 -18.097 1.00 0.00 C ATOM 990 O SER A 67 16.752 14.737 -17.752 1.00 0.00 O ATOM 991 CB SER A 67 18.105 13.482 -20.124 1.00 0.00 C ATOM 992 OG SER A 67 18.455 13.393 -21.496 1.00 0.00 O ATOM 0 H SER A 67 20.180 14.755 -20.426 1.00 0.00 H new ATOM 0 HA SER A 67 17.567 15.603 -20.082 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.734 12.809 -19.542 1.00 0.00 H new ATOM 0 HB3 SER A 67 17.075 13.154 -19.987 1.00 0.00 H new ATOM 0 HG SER A 67 18.832 12.508 -21.681 1.00 0.00 H new ATOM 998 N ILE A 68 18.885 15.170 -17.194 1.00 0.00 N ATOM 999 CA ILE A 68 18.647 15.336 -15.744 1.00 0.00 C ATOM 1000 C ILE A 68 19.153 16.678 -15.194 1.00 0.00 C ATOM 1001 O ILE A 68 18.903 17.010 -14.038 1.00 0.00 O ATOM 1002 CB ILE A 68 19.182 14.110 -14.966 1.00 0.00 C ATOM 1003 CG1 ILE A 68 18.414 13.901 -13.645 1.00 0.00 C ATOM 1004 CG2 ILE A 68 20.702 14.184 -14.730 1.00 0.00 C ATOM 1005 CD1 ILE A 68 18.739 12.587 -12.926 1.00 0.00 C ATOM 0 H ILE A 68 19.868 15.255 -17.452 1.00 0.00 H new ATOM 0 HA ILE A 68 17.569 15.376 -15.590 1.00 0.00 H new ATOM 0 HB ILE A 68 19.004 13.237 -15.594 1.00 0.00 H new ATOM 0 HG12 ILE A 68 18.635 14.732 -12.975 1.00 0.00 H new ATOM 0 HG13 ILE A 68 17.344 13.933 -13.852 1.00 0.00 H new ATOM 0 HG21 ILE A 68 21.028 13.301 -14.180 1.00 0.00 H new ATOM 0 HG22 ILE A 68 21.218 14.225 -15.689 1.00 0.00 H new ATOM 0 HG23 ILE A 68 20.937 15.078 -14.153 1.00 0.00 H new ATOM 0 HD11 ILE A 68 18.156 12.521 -12.007 1.00 0.00 H new ATOM 0 HD12 ILE A 68 18.491 11.747 -13.574 1.00 0.00 H new ATOM 0 HD13 ILE A 68 19.801 12.558 -12.684 1.00 0.00 H new ATOM 1017 N VAL A 69 19.804 17.512 -16.010 1.00 0.00 N ATOM 1018 CA VAL A 69 20.190 18.879 -15.612 1.00 0.00 C ATOM 1019 C VAL A 69 18.978 19.723 -15.159 1.00 0.00 C ATOM 1020 O VAL A 69 19.058 20.272 -14.060 1.00 0.00 O ATOM 1021 CB VAL A 69 21.058 19.545 -16.702 1.00 0.00 C ATOM 1022 CG1 VAL A 69 21.338 21.026 -16.419 1.00 0.00 C ATOM 1023 CG2 VAL A 69 22.417 18.834 -16.786 1.00 0.00 C ATOM 0 H VAL A 69 20.079 17.266 -16.961 1.00 0.00 H new ATOM 0 HA VAL A 69 20.820 18.813 -14.725 1.00 0.00 H new ATOM 0 HB VAL A 69 20.496 19.465 -17.632 1.00 0.00 H new ATOM 0 HG11 VAL A 69 21.952 21.440 -17.219 1.00 0.00 H new ATOM 0 HG12 VAL A 69 20.395 21.571 -16.366 1.00 0.00 H new ATOM 0 HG13 VAL A 69 21.866 21.122 -15.470 1.00 0.00 H new ATOM 0 HG21 VAL A 69 23.028 19.306 -17.556 1.00 0.00 H new ATOM 0 HG22 VAL A 69 22.926 18.906 -15.825 1.00 0.00 H new ATOM 0 HG23 VAL A 69 22.264 17.784 -17.037 1.00 0.00 H new ATOM 1033 N PRO A 70 17.822 19.756 -15.864 1.00 0.00 N ATOM 1034 CA PRO A 70 16.578 20.373 -15.374 1.00 0.00 C ATOM 1035 C PRO A 70 16.045 19.856 -14.022 1.00 0.00 C ATOM 1036 O PRO A 70 15.165 20.490 -13.435 1.00 0.00 O ATOM 1037 CB PRO A 70 15.526 20.134 -16.466 1.00 0.00 C ATOM 1038 CG PRO A 70 16.341 19.923 -17.734 1.00 0.00 C ATOM 1039 CD PRO A 70 17.611 19.259 -17.217 1.00 0.00 C ATOM 0 HA PRO A 70 16.793 21.424 -15.180 1.00 0.00 H new ATOM 0 HB2 PRO A 70 14.909 19.264 -16.240 1.00 0.00 H new ATOM 0 HB3 PRO A 70 14.853 20.986 -16.563 1.00 0.00 H new ATOM 0 HG2 PRO A 70 15.817 19.290 -18.450 1.00 0.00 H new ATOM 0 HG3 PRO A 70 16.555 20.865 -18.238 1.00 0.00 H new ATOM 0 HD2 PRO A 70 17.509 18.174 -17.219 1.00 0.00 H new ATOM 0 HD3 PRO A 70 18.461 19.500 -17.855 1.00 0.00 H new ATOM 1047 N LEU A 71 16.562 18.734 -13.511 1.00 0.00 N ATOM 1048 CA LEU A 71 16.213 18.181 -12.204 1.00 0.00 C ATOM 1049 C LEU A 71 17.282 18.541 -11.163 1.00 0.00 C ATOM 1050 O LEU A 71 16.951 19.015 -10.075 1.00 0.00 O ATOM 1051 CB LEU A 71 16.000 16.653 -12.354 1.00 0.00 C ATOM 1052 CG LEU A 71 15.591 15.974 -11.038 1.00 0.00 C ATOM 1053 CD1 LEU A 71 14.281 16.525 -10.490 1.00 0.00 C ATOM 1054 CD2 LEU A 71 15.405 14.470 -11.224 1.00 0.00 C ATOM 0 H LEU A 71 17.252 18.173 -14.010 1.00 0.00 H new ATOM 0 HA LEU A 71 15.282 18.616 -11.839 1.00 0.00 H new ATOM 0 HB2 LEU A 71 15.232 16.470 -13.105 1.00 0.00 H new ATOM 0 HB3 LEU A 71 16.920 16.197 -12.721 1.00 0.00 H new ATOM 0 HG LEU A 71 16.401 16.179 -10.338 1.00 0.00 H new ATOM 0 HD11 LEU A 71 14.033 16.015 -9.559 1.00 0.00 H new ATOM 0 HD12 LEU A 71 14.386 17.593 -10.301 1.00 0.00 H new ATOM 0 HD13 LEU A 71 13.485 16.362 -11.217 1.00 0.00 H new ATOM 0 HD21 LEU A 71 15.116 14.019 -10.275 1.00 0.00 H new ATOM 0 HD22 LEU A 71 14.626 14.289 -11.964 1.00 0.00 H new ATOM 0 HD23 LEU A 71 16.340 14.027 -11.566 1.00 0.00 H new ATOM 1066 N PHE A 72 18.559 18.405 -11.523 1.00 0.00 N ATOM 1067 CA PHE A 72 19.700 18.731 -10.673 1.00 0.00 C ATOM 1068 C PHE A 72 19.755 20.231 -10.320 1.00 0.00 C ATOM 1069 O PHE A 72 19.937 20.580 -9.157 1.00 0.00 O ATOM 1070 CB PHE A 72 20.949 18.218 -11.405 1.00 0.00 C ATOM 1071 CG PHE A 72 22.266 18.610 -10.770 1.00 0.00 C ATOM 1072 CD1 PHE A 72 22.869 17.799 -9.791 1.00 0.00 C ATOM 1073 CD2 PHE A 72 22.890 19.801 -11.178 1.00 0.00 C ATOM 1074 CE1 PHE A 72 24.085 18.198 -9.209 1.00 0.00 C ATOM 1075 CE2 PHE A 72 24.113 20.193 -10.606 1.00 0.00 C ATOM 1076 CZ PHE A 72 24.708 19.391 -9.617 1.00 0.00 C ATOM 0 H PHE A 72 18.834 18.055 -12.441 1.00 0.00 H new ATOM 0 HA PHE A 72 19.621 18.244 -9.701 1.00 0.00 H new ATOM 0 HB2 PHE A 72 20.899 17.131 -11.461 1.00 0.00 H new ATOM 0 HB3 PHE A 72 20.931 18.591 -12.429 1.00 0.00 H new ATOM 0 HD1 PHE A 72 22.400 16.874 -9.488 1.00 0.00 H new ATOM 0 HD2 PHE A 72 22.428 20.418 -11.934 1.00 0.00 H new ATOM 0 HE1 PHE A 72 24.542 17.586 -8.446 1.00 0.00 H new ATOM 0 HE2 PHE A 72 24.593 21.106 -10.925 1.00 0.00 H new ATOM 0 HZ PHE A 72 25.644 19.691 -9.170 1.00 0.00 H new ATOM 1086 N GLN A 73 19.509 21.131 -11.283 1.00 0.00 N ATOM 1087 CA GLN A 73 19.466 22.585 -11.024 1.00 0.00 C ATOM 1088 C GLN A 73 18.283 23.015 -10.130 1.00 0.00 C ATOM 1089 O GLN A 73 18.371 24.026 -9.432 1.00 0.00 O ATOM 1090 CB GLN A 73 19.394 23.367 -12.351 1.00 0.00 C ATOM 1091 CG GLN A 73 20.596 23.169 -13.289 1.00 0.00 C ATOM 1092 CD GLN A 73 21.952 23.531 -12.682 1.00 0.00 C ATOM 1093 OE1 GLN A 73 22.112 24.475 -11.920 1.00 0.00 O ATOM 1094 NE2 GLN A 73 22.985 22.779 -12.997 1.00 0.00 N ATOM 0 H GLN A 73 19.335 20.879 -12.256 1.00 0.00 H new ATOM 0 HA GLN A 73 20.386 22.818 -10.488 1.00 0.00 H new ATOM 0 HB2 GLN A 73 18.487 23.073 -12.880 1.00 0.00 H new ATOM 0 HB3 GLN A 73 19.300 24.429 -12.125 1.00 0.00 H new ATOM 0 HG2 GLN A 73 20.623 22.127 -13.606 1.00 0.00 H new ATOM 0 HG3 GLN A 73 20.443 23.771 -14.185 1.00 0.00 H new ATOM 0 HE21 GLN A 73 22.866 21.989 -13.631 1.00 0.00 H new ATOM 0 HE22 GLN A 73 23.904 22.986 -12.607 1.00 0.00 H new ATOM 1103 N GLY A 74 17.179 22.256 -10.135 1.00 0.00 N ATOM 1104 CA GLY A 74 15.917 22.627 -9.492 1.00 0.00 C ATOM 1105 C GLY A 74 15.793 22.096 -8.068 1.00 0.00 C ATOM 1106 O GLY A 74 15.394 22.856 -7.192 1.00 0.00 O ATOM 0 H GLY A 74 17.140 21.347 -10.597 1.00 0.00 H new ATOM 0 HA2 GLY A 74 15.829 23.713 -9.477 1.00 0.00 H new ATOM 0 HA3 GLY A 74 15.087 22.248 -10.088 1.00 0.00 H new ATOM 1110 N ILE A 75 16.196 20.849 -7.793 1.00 0.00 N ATOM 1111 CA ILE A 75 16.246 20.288 -6.424 1.00 0.00 C ATOM 1112 C ILE A 75 17.156 21.130 -5.515 1.00 0.00 C ATOM 1113 O ILE A 75 16.813 21.375 -4.356 1.00 0.00 O ATOM 1114 CB ILE A 75 16.721 18.817 -6.497 1.00 0.00 C ATOM 1115 CG1 ILE A 75 15.590 17.894 -7.003 1.00 0.00 C ATOM 1116 CG2 ILE A 75 17.270 18.286 -5.153 1.00 0.00 C ATOM 1117 CD1 ILE A 75 16.027 16.450 -7.266 1.00 0.00 C ATOM 0 H ILE A 75 16.499 20.193 -8.513 1.00 0.00 H new ATOM 0 HA ILE A 75 15.249 20.316 -5.985 1.00 0.00 H new ATOM 0 HB ILE A 75 17.547 18.805 -7.208 1.00 0.00 H new ATOM 0 HG12 ILE A 75 14.784 17.890 -6.269 1.00 0.00 H new ATOM 0 HG13 ILE A 75 15.181 18.311 -7.923 1.00 0.00 H new ATOM 0 HG21 ILE A 75 17.586 17.250 -5.273 1.00 0.00 H new ATOM 0 HG22 ILE A 75 18.122 18.891 -4.843 1.00 0.00 H new ATOM 0 HG23 ILE A 75 16.490 18.342 -4.394 1.00 0.00 H new ATOM 0 HD11 ILE A 75 15.174 15.870 -7.618 1.00 0.00 H new ATOM 0 HD12 ILE A 75 16.811 16.439 -8.024 1.00 0.00 H new ATOM 0 HD13 ILE A 75 16.408 16.011 -6.344 1.00 0.00 H new ATOM 1129 N LYS A 76 18.304 21.577 -6.044 1.00 0.00 N ATOM 1130 CA LYS A 76 19.329 22.337 -5.305 1.00 0.00 C ATOM 1131 C LYS A 76 18.779 23.645 -4.726 1.00 0.00 C ATOM 1132 O LYS A 76 18.953 23.928 -3.540 1.00 0.00 O ATOM 1133 CB LYS A 76 20.524 22.591 -6.242 1.00 0.00 C ATOM 1134 CG LYS A 76 21.754 23.108 -5.483 1.00 0.00 C ATOM 1135 CD LYS A 76 23.026 23.101 -6.342 1.00 0.00 C ATOM 1136 CE LYS A 76 22.922 24.053 -7.546 1.00 0.00 C ATOM 1137 NZ LYS A 76 24.217 24.160 -8.272 1.00 0.00 N1+ ATOM 0 H LYS A 76 18.554 21.418 -7.020 1.00 0.00 H new ATOM 0 HA LYS A 76 19.654 21.748 -4.448 1.00 0.00 H new ATOM 0 HB2 LYS A 76 20.780 21.667 -6.760 1.00 0.00 H new ATOM 0 HB3 LYS A 76 20.238 23.315 -7.005 1.00 0.00 H new ATOM 0 HG2 LYS A 76 21.561 24.123 -5.135 1.00 0.00 H new ATOM 0 HG3 LYS A 76 21.915 22.493 -4.598 1.00 0.00 H new ATOM 0 HD2 LYS A 76 23.879 23.388 -5.727 1.00 0.00 H new ATOM 0 HD3 LYS A 76 23.216 22.088 -6.698 1.00 0.00 H new ATOM 0 HE2 LYS A 76 22.150 23.696 -8.228 1.00 0.00 H new ATOM 0 HE3 LYS A 76 22.613 25.041 -7.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 24.111 24.809 -9.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 24.947 24.524 -7.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 24.499 23.221 -8.619 1.00 0.00 H new ATOM 1151 N ASP A 77 18.073 24.408 -5.558 1.00 0.00 N ATOM 1152 CA ASP A 77 17.500 25.705 -5.188 1.00 0.00 C ATOM 1153 C ASP A 77 16.108 25.591 -4.538 1.00 0.00 C ATOM 1154 O ASP A 77 15.801 26.352 -3.616 1.00 0.00 O ATOM 1155 CB ASP A 77 17.429 26.575 -6.449 1.00 0.00 C ATOM 1156 CG ASP A 77 16.970 28.008 -6.130 1.00 0.00 C ATOM 1157 OD1 ASP A 77 17.759 28.774 -5.525 1.00 0.00 O1- ATOM 1158 OD2 ASP A 77 15.833 28.383 -6.506 1.00 0.00 O ATOM 0 H ASP A 77 17.879 24.141 -6.523 1.00 0.00 H new ATOM 0 HA ASP A 77 18.145 26.157 -4.435 1.00 0.00 H new ATOM 0 HB2 ASP A 77 18.409 26.605 -6.925 1.00 0.00 H new ATOM 0 HB3 ASP A 77 16.741 26.124 -7.164 1.00 0.00 H new ATOM 1163 N SER A 78 15.270 24.642 -4.984 1.00 0.00 N ATOM 1164 CA SER A 78 13.851 24.616 -4.573 1.00 0.00 C ATOM 1165 C SER A 78 13.591 23.956 -3.212 1.00 0.00 C ATOM 1166 O SER A 78 12.710 24.420 -2.485 1.00 0.00 O ATOM 1167 CB SER A 78 12.968 23.913 -5.611 1.00 0.00 C ATOM 1168 OG SER A 78 13.160 24.461 -6.904 1.00 0.00 O ATOM 0 H SER A 78 15.541 23.892 -5.620 1.00 0.00 H new ATOM 0 HA SER A 78 13.590 25.671 -4.490 1.00 0.00 H new ATOM 0 HB2 SER A 78 13.199 22.848 -5.627 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.920 24.008 -5.325 1.00 0.00 H new ATOM 0 HG SER A 78 13.945 24.048 -7.321 1.00 0.00 H new ATOM 1174 N LEU A 79 14.317 22.879 -2.855 1.00 0.00 N ATOM 1175 CA LEU A 79 14.059 22.168 -1.590 1.00 0.00 C ATOM 1176 C LEU A 79 14.705 22.868 -0.382 1.00 0.00 C ATOM 1177 O LEU A 79 14.057 23.038 0.651 1.00 0.00 O ATOM 1178 CB LEU A 79 14.516 20.696 -1.670 1.00 0.00 C ATOM 1179 CG LEU A 79 13.872 19.836 -2.779 1.00 0.00 C ATOM 1180 CD1 LEU A 79 14.224 18.367 -2.543 1.00 0.00 C ATOM 1181 CD2 LEU A 79 12.346 19.943 -2.830 1.00 0.00 C ATOM 0 H LEU A 79 15.075 22.488 -3.415 1.00 0.00 H new ATOM 0 HA LEU A 79 12.980 22.188 -1.439 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.597 20.681 -1.811 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.313 20.223 -0.709 1.00 0.00 H new ATOM 0 HG LEU A 79 14.266 20.212 -3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.772 17.755 -3.323 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.307 18.244 -2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 79 13.845 18.054 -1.570 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.964 19.312 -3.633 1.00 0.00 H new ATOM 0 HD22 LEU A 79 11.926 19.615 -1.879 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.060 20.978 -3.015 1.00 0.00 H new ATOM 1193 N GLY A 80 15.976 23.267 -0.505 1.00 0.00 N ATOM 1194 CA GLY A 80 16.791 23.917 0.539 1.00 0.00 C ATOM 1195 C GLY A 80 17.196 23.013 1.721 1.00 0.00 C ATOM 1196 O GLY A 80 18.328 23.087 2.201 1.00 0.00 O ATOM 0 H GLY A 80 16.493 23.141 -1.375 1.00 0.00 H new ATOM 0 HA2 GLY A 80 17.697 24.310 0.077 1.00 0.00 H new ATOM 0 HA3 GLY A 80 16.237 24.770 0.930 1.00 0.00 H new ATOM 1200 N PHE A 81 16.289 22.143 2.173 1.00 0.00 N ATOM 1201 CA PHE A 81 16.474 21.161 3.245 1.00 0.00 C ATOM 1202 C PHE A 81 15.386 20.073 3.163 1.00 0.00 C ATOM 1203 O PHE A 81 14.226 20.365 2.858 1.00 0.00 O ATOM 1204 CB PHE A 81 16.387 21.888 4.598 1.00 0.00 C ATOM 1205 CG PHE A 81 16.552 21.000 5.820 1.00 0.00 C ATOM 1206 CD1 PHE A 81 17.799 20.411 6.104 1.00 0.00 C ATOM 1207 CD2 PHE A 81 15.467 20.783 6.693 1.00 0.00 C ATOM 1208 CE1 PHE A 81 17.964 19.616 7.253 1.00 0.00 C ATOM 1209 CE2 PHE A 81 15.633 19.989 7.844 1.00 0.00 C ATOM 1210 CZ PHE A 81 16.880 19.405 8.123 1.00 0.00 C ATOM 0 H PHE A 81 15.350 22.103 1.777 1.00 0.00 H new ATOM 0 HA PHE A 81 17.448 20.683 3.141 1.00 0.00 H new ATOM 0 HB2 PHE A 81 17.153 22.663 4.626 1.00 0.00 H new ATOM 0 HB3 PHE A 81 15.422 22.391 4.661 1.00 0.00 H new ATOM 0 HD1 PHE A 81 18.633 20.570 5.437 1.00 0.00 H new ATOM 0 HD2 PHE A 81 14.506 21.227 6.479 1.00 0.00 H new ATOM 0 HE1 PHE A 81 18.923 19.168 7.467 1.00 0.00 H new ATOM 0 HE2 PHE A 81 14.801 19.829 8.513 1.00 0.00 H new ATOM 0 HZ PHE A 81 17.006 18.795 9.005 1.00 0.00 H new ATOM 1220 N GLN A 82 15.749 18.819 3.445 1.00 0.00 N ATOM 1221 CA GLN A 82 14.832 17.675 3.494 1.00 0.00 C ATOM 1222 C GLN A 82 15.326 16.598 4.487 1.00 0.00 C ATOM 1223 O GLN A 82 16.233 15.835 4.148 1.00 0.00 O ATOM 1224 CB GLN A 82 14.646 17.076 2.077 1.00 0.00 C ATOM 1225 CG GLN A 82 13.176 17.097 1.624 1.00 0.00 C ATOM 1226 CD GLN A 82 12.183 16.507 2.630 1.00 0.00 C ATOM 1227 OE1 GLN A 82 12.487 15.633 3.438 1.00 0.00 O ATOM 1228 NE2 GLN A 82 10.966 16.992 2.639 1.00 0.00 N ATOM 0 H GLN A 82 16.715 18.564 3.651 1.00 0.00 H new ATOM 0 HA GLN A 82 13.866 18.030 3.852 1.00 0.00 H new ATOM 0 HB2 GLN A 82 15.252 17.637 1.365 1.00 0.00 H new ATOM 0 HB3 GLN A 82 15.012 16.049 2.068 1.00 0.00 H new ATOM 0 HG2 GLN A 82 12.890 18.128 1.415 1.00 0.00 H new ATOM 0 HG3 GLN A 82 13.092 16.547 0.687 1.00 0.00 H new ATOM 0 HE21 GLN A 82 10.701 17.718 1.973 1.00 0.00 H new ATOM 0 HE22 GLN A 82 10.283 16.644 3.312 1.00 0.00 H new ATOM 1237 N PRO A 83 14.753 16.497 5.705 1.00 0.00 N ATOM 1238 CA PRO A 83 15.186 15.518 6.704 1.00 0.00 C ATOM 1239 C PRO A 83 14.624 14.099 6.492 1.00 0.00 C ATOM 1240 O PRO A 83 15.161 13.150 7.065 1.00 0.00 O ATOM 1241 CB PRO A 83 14.701 16.101 8.038 1.00 0.00 C ATOM 1242 CG PRO A 83 13.410 16.825 7.657 1.00 0.00 C ATOM 1243 CD PRO A 83 13.710 17.356 6.251 1.00 0.00 C ATOM 0 HA PRO A 83 16.265 15.377 6.649 1.00 0.00 H new ATOM 0 HB2 PRO A 83 14.521 15.320 8.777 1.00 0.00 H new ATOM 0 HB3 PRO A 83 15.433 16.784 8.468 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.554 16.150 7.659 1.00 0.00 H new ATOM 0 HG3 PRO A 83 13.181 17.633 8.352 1.00 0.00 H new ATOM 0 HD2 PRO A 83 12.817 17.329 5.626 1.00 0.00 H new ATOM 0 HD3 PRO A 83 14.041 18.394 6.289 1.00 0.00 H new ATOM 1251 N ASN A 84 13.572 13.930 5.674 1.00 0.00 N ATOM 1252 CA ASN A 84 12.807 12.671 5.554 1.00 0.00 C ATOM 1253 C ASN A 84 12.783 12.062 4.133 1.00 0.00 C ATOM 1254 O ASN A 84 12.264 10.962 3.939 1.00 0.00 O ATOM 1255 CB ASN A 84 11.403 12.895 6.170 1.00 0.00 C ATOM 1256 CG ASN A 84 10.257 12.945 5.166 1.00 0.00 C ATOM 1257 OD1 ASN A 84 9.315 12.170 5.233 1.00 0.00 O ATOM 1258 ND2 ASN A 84 10.289 13.837 4.201 1.00 0.00 N ATOM 0 H ASN A 84 13.222 14.672 5.068 1.00 0.00 H new ATOM 0 HA ASN A 84 13.326 11.897 6.120 1.00 0.00 H new ATOM 0 HB2 ASN A 84 11.205 12.096 6.884 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.414 13.829 6.732 1.00 0.00 H new ATOM 0 HD21 ASN A 84 9.532 13.877 3.518 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.070 14.489 4.135 1.00 0.00 H new ATOM 1265 N LEU A 85 13.342 12.758 3.139 1.00 0.00 N ATOM 1266 CA LEU A 85 13.544 12.253 1.780 1.00 0.00 C ATOM 1267 C LEU A 85 14.495 11.040 1.806 1.00 0.00 C ATOM 1268 O LEU A 85 15.648 11.179 2.213 1.00 0.00 O ATOM 1269 CB LEU A 85 14.079 13.434 0.950 1.00 0.00 C ATOM 1270 CG LEU A 85 14.292 13.190 -0.552 1.00 0.00 C ATOM 1271 CD1 LEU A 85 13.008 12.755 -1.266 1.00 0.00 C ATOM 1272 CD2 LEU A 85 14.759 14.507 -1.180 1.00 0.00 C ATOM 0 H LEU A 85 13.675 13.714 3.262 1.00 0.00 H new ATOM 0 HA LEU A 85 12.622 11.890 1.327 1.00 0.00 H new ATOM 0 HB2 LEU A 85 13.387 14.269 1.063 1.00 0.00 H new ATOM 0 HB3 LEU A 85 15.030 13.748 1.381 1.00 0.00 H new ATOM 0 HG LEU A 85 15.024 12.390 -0.663 1.00 0.00 H new ATOM 0 HD11 LEU A 85 13.216 12.596 -2.324 1.00 0.00 H new ATOM 0 HD12 LEU A 85 12.643 11.827 -0.825 1.00 0.00 H new ATOM 0 HD13 LEU A 85 12.250 13.531 -1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 85 14.919 14.364 -2.249 1.00 0.00 H new ATOM 0 HD22 LEU A 85 13.999 15.273 -1.026 1.00 0.00 H new ATOM 0 HD23 LEU A 85 15.692 14.822 -0.713 1.00 0.00 H new ATOM 1284 N ARG A 86 14.023 9.855 1.393 1.00 0.00 N ATOM 1285 CA ARG A 86 14.734 8.564 1.486 1.00 0.00 C ATOM 1286 C ARG A 86 14.759 7.866 0.131 1.00 0.00 C ATOM 1287 O ARG A 86 13.732 7.803 -0.552 1.00 0.00 O ATOM 1288 CB ARG A 86 14.015 7.643 2.487 1.00 0.00 C ATOM 1289 CG ARG A 86 14.131 8.105 3.950 1.00 0.00 C ATOM 1290 CD ARG A 86 12.944 7.614 4.795 1.00 0.00 C ATOM 1291 NE ARG A 86 11.658 8.118 4.255 1.00 0.00 N ATOM 1292 CZ ARG A 86 10.451 7.627 4.452 1.00 0.00 C ATOM 1293 NH1 ARG A 86 10.216 6.739 5.376 1.00 0.00 N1+ ATOM 1294 NH2 ARG A 86 9.458 8.021 3.706 1.00 0.00 N ATOM 0 H ARG A 86 13.100 9.762 0.968 1.00 0.00 H new ATOM 0 HA ARG A 86 15.754 8.763 1.815 1.00 0.00 H new ATOM 0 HB2 ARG A 86 12.961 7.582 2.218 1.00 0.00 H new ATOM 0 HB3 ARG A 86 14.425 6.637 2.400 1.00 0.00 H new ATOM 0 HG2 ARG A 86 15.062 7.731 4.377 1.00 0.00 H new ATOM 0 HG3 ARG A 86 14.178 9.193 3.986 1.00 0.00 H new ATOM 0 HD2 ARG A 86 12.932 6.524 4.812 1.00 0.00 H new ATOM 0 HD3 ARG A 86 13.065 7.948 5.826 1.00 0.00 H new ATOM 0 HE ARG A 86 11.715 8.944 3.659 1.00 0.00 H new ATOM 0 HH11 ARG A 86 10.976 6.407 5.969 1.00 0.00 H new ATOM 0 HH12 ARG A 86 9.272 6.376 5.506 1.00 0.00 H new ATOM 0 HH21 ARG A 86 9.615 8.709 2.970 1.00 0.00 H new ATOM 0 HH22 ARG A 86 8.524 7.641 3.858 1.00 0.00 H new ATOM 1308 N TYR A 87 15.921 7.345 -0.253 1.00 0.00 N ATOM 1309 CA TYR A 87 16.112 6.811 -1.603 1.00 0.00 C ATOM 1310 C TYR A 87 17.228 5.765 -1.730 1.00 0.00 C ATOM 1311 O TYR A 87 17.764 5.276 -0.734 1.00 0.00 O ATOM 1312 CB TYR A 87 16.263 8.015 -2.556 1.00 0.00 C ATOM 1313 CG TYR A 87 17.642 8.524 -2.870 1.00 0.00 C ATOM 1314 CD1 TYR A 87 18.405 9.190 -1.893 1.00 0.00 C ATOM 1315 CD2 TYR A 87 18.127 8.374 -4.180 1.00 0.00 C ATOM 1316 CE1 TYR A 87 19.699 9.644 -2.203 1.00 0.00 C ATOM 1317 CE2 TYR A 87 19.407 8.841 -4.501 1.00 0.00 C ATOM 1318 CZ TYR A 87 20.203 9.451 -3.511 1.00 0.00 C ATOM 1319 OH TYR A 87 21.464 9.797 -3.848 1.00 0.00 O ATOM 0 H TYR A 87 16.743 7.280 0.347 1.00 0.00 H new ATOM 0 HA TYR A 87 15.236 6.226 -1.883 1.00 0.00 H new ATOM 0 HB2 TYR A 87 15.787 7.750 -3.500 1.00 0.00 H new ATOM 0 HB3 TYR A 87 15.694 8.843 -2.133 1.00 0.00 H new ATOM 0 HD1 TYR A 87 17.997 9.352 -0.906 1.00 0.00 H new ATOM 0 HD2 TYR A 87 17.516 7.901 -4.935 1.00 0.00 H new ATOM 0 HE1 TYR A 87 20.301 10.134 -1.452 1.00 0.00 H new ATOM 0 HE2 TYR A 87 19.784 8.734 -5.507 1.00 0.00 H new ATOM 0 HH TYR A 87 22.061 9.639 -3.087 1.00 0.00 H new ATOM 1329 N GLY A 88 17.554 5.392 -2.966 1.00 0.00 N ATOM 1330 CA GLY A 88 18.713 4.579 -3.339 1.00 0.00 C ATOM 1331 C GLY A 88 19.237 4.993 -4.718 1.00 0.00 C ATOM 1332 O GLY A 88 18.512 5.607 -5.508 1.00 0.00 O ATOM 0 H GLY A 88 16.992 5.660 -3.774 1.00 0.00 H new ATOM 0 HA2 GLY A 88 19.501 4.695 -2.594 1.00 0.00 H new ATOM 0 HA3 GLY A 88 18.437 3.525 -3.350 1.00 0.00 H new ATOM 1336 N VAL A 89 20.493 4.647 -5.024 1.00 0.00 N ATOM 1337 CA VAL A 89 21.201 5.173 -6.205 1.00 0.00 C ATOM 1338 C VAL A 89 21.772 4.085 -7.098 1.00 0.00 C ATOM 1339 O VAL A 89 22.462 3.170 -6.651 1.00 0.00 O ATOM 1340 CB VAL A 89 22.389 6.098 -5.834 1.00 0.00 C ATOM 1341 CG1 VAL A 89 22.503 7.269 -6.817 1.00 0.00 C ATOM 1342 CG2 VAL A 89 22.366 6.644 -4.408 1.00 0.00 C ATOM 0 H VAL A 89 21.048 3.998 -4.466 1.00 0.00 H new ATOM 0 HA VAL A 89 20.428 5.730 -6.734 1.00 0.00 H new ATOM 0 HB VAL A 89 23.263 5.449 -5.900 1.00 0.00 H new ATOM 0 HG11 VAL A 89 23.344 7.902 -6.533 1.00 0.00 H new ATOM 0 HG12 VAL A 89 22.662 6.884 -7.824 1.00 0.00 H new ATOM 0 HG13 VAL A 89 21.584 7.855 -6.793 1.00 0.00 H new ATOM 0 HG21 VAL A 89 23.237 7.279 -4.247 1.00 0.00 H new ATOM 0 HG22 VAL A 89 21.459 7.229 -4.257 1.00 0.00 H new ATOM 0 HG23 VAL A 89 22.386 5.815 -3.701 1.00 0.00 H new ATOM 1352 N ILE A 90 21.569 4.277 -8.391 1.00 0.00 N ATOM 1353 CA ILE A 90 22.196 3.524 -9.468 1.00 0.00 C ATOM 1354 C ILE A 90 22.914 4.554 -10.352 1.00 0.00 C ATOM 1355 O ILE A 90 22.296 5.463 -10.911 1.00 0.00 O ATOM 1356 CB ILE A 90 21.144 2.709 -10.238 1.00 0.00 C ATOM 1357 CG1 ILE A 90 20.455 1.693 -9.294 1.00 0.00 C ATOM 1358 CG2 ILE A 90 21.823 2.022 -11.433 1.00 0.00 C ATOM 1359 CD1 ILE A 90 19.417 0.799 -9.970 1.00 0.00 C ATOM 0 H ILE A 90 20.933 4.996 -8.736 1.00 0.00 H new ATOM 0 HA ILE A 90 22.914 2.794 -9.094 1.00 0.00 H new ATOM 0 HB ILE A 90 20.363 3.366 -10.620 1.00 0.00 H new ATOM 0 HG12 ILE A 90 21.219 1.061 -8.841 1.00 0.00 H new ATOM 0 HG13 ILE A 90 19.972 2.239 -8.484 1.00 0.00 H new ATOM 0 HG21 ILE A 90 21.085 1.441 -11.986 1.00 0.00 H new ATOM 0 HG22 ILE A 90 22.256 2.777 -12.089 1.00 0.00 H new ATOM 0 HG23 ILE A 90 22.610 1.360 -11.073 1.00 0.00 H new ATOM 0 HD11 ILE A 90 18.987 0.120 -9.234 1.00 0.00 H new ATOM 0 HD12 ILE A 90 18.628 1.417 -10.398 1.00 0.00 H new ATOM 0 HD13 ILE A 90 19.895 0.221 -10.761 1.00 0.00 H new ATOM 1371 N ALA A 91 24.230 4.422 -10.477 1.00 0.00 N ATOM 1372 CA ALA A 91 25.081 5.327 -11.239 1.00 0.00 C ATOM 1373 C ALA A 91 25.869 4.537 -12.294 1.00 0.00 C ATOM 1374 O ALA A 91 26.213 3.369 -12.097 1.00 0.00 O ATOM 1375 CB ALA A 91 25.975 6.085 -10.252 1.00 0.00 C ATOM 0 H ALA A 91 24.748 3.661 -10.038 1.00 0.00 H new ATOM 0 HA ALA A 91 24.493 6.062 -11.789 1.00 0.00 H new ATOM 0 HB1 ALA A 91 26.622 6.770 -10.800 1.00 0.00 H new ATOM 0 HB2 ALA A 91 25.353 6.650 -9.558 1.00 0.00 H new ATOM 0 HB3 ALA A 91 26.586 5.375 -9.695 1.00 0.00 H new ATOM 1381 N LEU A 92 26.133 5.176 -13.435 1.00 0.00 N ATOM 1382 CA LEU A 92 26.673 4.515 -14.619 1.00 0.00 C ATOM 1383 C LEU A 92 27.750 5.354 -15.307 1.00 0.00 C ATOM 1384 O LEU A 92 27.711 6.587 -15.319 1.00 0.00 O ATOM 1385 CB LEU A 92 25.471 4.179 -15.540 1.00 0.00 C ATOM 1386 CG LEU A 92 25.784 3.303 -16.770 1.00 0.00 C ATOM 1387 CD1 LEU A 92 24.577 2.453 -17.159 1.00 0.00 C ATOM 1388 CD2 LEU A 92 26.120 4.122 -18.018 1.00 0.00 C ATOM 0 H LEU A 92 25.976 6.176 -13.562 1.00 0.00 H new ATOM 0 HA LEU A 92 27.189 3.595 -14.346 1.00 0.00 H new ATOM 0 HB2 LEU A 92 24.712 3.674 -14.943 1.00 0.00 H new ATOM 0 HB3 LEU A 92 25.033 5.115 -15.887 1.00 0.00 H new ATOM 0 HG LEU A 92 26.640 2.699 -16.468 1.00 0.00 H new ATOM 0 HD11 LEU A 92 24.825 1.845 -18.029 1.00 0.00 H new ATOM 0 HD12 LEU A 92 24.307 1.803 -16.327 1.00 0.00 H new ATOM 0 HD13 LEU A 92 23.736 3.104 -17.399 1.00 0.00 H new ATOM 0 HD21 LEU A 92 26.331 3.449 -18.849 1.00 0.00 H new ATOM 0 HD22 LEU A 92 25.274 4.760 -18.273 1.00 0.00 H new ATOM 0 HD23 LEU A 92 26.995 4.741 -17.822 1.00 0.00 H new ATOM 1400 N GLY A 93 28.707 4.661 -15.913 1.00 0.00 N ATOM 1401 CA GLY A 93 29.678 5.276 -16.801 1.00 0.00 C ATOM 1402 C GLY A 93 30.782 4.309 -17.233 1.00 0.00 C ATOM 1403 O GLY A 93 30.517 3.137 -17.496 1.00 0.00 O ATOM 0 H GLY A 93 28.829 3.655 -15.800 1.00 0.00 H new ATOM 0 HA2 GLY A 93 29.166 5.654 -17.686 1.00 0.00 H new ATOM 0 HA3 GLY A 93 30.128 6.134 -16.302 1.00 0.00 H new ATOM 1407 N ASP A 94 32.020 4.797 -17.321 1.00 0.00 N ATOM 1408 CA ASP A 94 33.170 4.052 -17.839 1.00 0.00 C ATOM 1409 C ASP A 94 34.447 4.369 -17.036 1.00 0.00 C ATOM 1410 O ASP A 94 34.879 5.523 -16.954 1.00 0.00 O ATOM 1411 CB ASP A 94 33.331 4.398 -19.323 1.00 0.00 C ATOM 1412 CG ASP A 94 34.377 3.502 -20.004 1.00 0.00 C ATOM 1413 OD1 ASP A 94 35.573 3.638 -19.666 1.00 0.00 O ATOM 1414 OD2 ASP A 94 34.000 2.695 -20.887 1.00 0.00 O1- ATOM 0 H ASP A 94 32.257 5.744 -17.027 1.00 0.00 H new ATOM 0 HA ASP A 94 33.001 2.981 -17.732 1.00 0.00 H new ATOM 0 HB2 ASP A 94 32.372 4.287 -19.829 1.00 0.00 H new ATOM 0 HB3 ASP A 94 33.626 5.443 -19.423 1.00 0.00 H new ATOM 1419 N SER A 95 35.029 3.350 -16.399 1.00 0.00 N ATOM 1420 CA SER A 95 36.193 3.464 -15.505 1.00 0.00 C ATOM 1421 C SER A 95 37.536 3.708 -16.214 1.00 0.00 C ATOM 1422 O SER A 95 38.558 3.850 -15.539 1.00 0.00 O ATOM 1423 CB SER A 95 36.288 2.218 -14.614 1.00 0.00 C ATOM 1424 OG SER A 95 37.190 2.427 -13.537 1.00 0.00 O ATOM 0 H SER A 95 34.695 2.391 -16.492 1.00 0.00 H new ATOM 0 HA SER A 95 36.016 4.359 -14.908 1.00 0.00 H new ATOM 0 HB2 SER A 95 35.301 1.971 -14.223 1.00 0.00 H new ATOM 0 HB3 SER A 95 36.618 1.366 -15.209 1.00 0.00 H new ATOM 0 HG SER A 95 37.938 2.982 -13.840 1.00 0.00 H new ATOM 1430 N SER A 96 37.571 3.799 -17.549 1.00 0.00 N ATOM 1431 CA SER A 96 38.775 4.195 -18.308 1.00 0.00 C ATOM 1432 C SER A 96 39.111 5.701 -18.198 1.00 0.00 C ATOM 1433 O SER A 96 40.046 6.176 -18.848 1.00 0.00 O ATOM 1434 CB SER A 96 38.632 3.790 -19.782 1.00 0.00 C ATOM 1435 OG SER A 96 39.896 3.812 -20.432 1.00 0.00 O ATOM 0 H SER A 96 36.764 3.600 -18.140 1.00 0.00 H new ATOM 0 HA SER A 96 39.610 3.661 -17.854 1.00 0.00 H new ATOM 0 HB2 SER A 96 38.199 2.792 -19.850 1.00 0.00 H new ATOM 0 HB3 SER A 96 37.946 4.470 -20.287 1.00 0.00 H new ATOM 0 HG SER A 96 40.405 4.593 -20.131 1.00 0.00 H new ATOM 1441 N TYR A 97 38.365 6.455 -17.382 1.00 0.00 N ATOM 1442 CA TYR A 97 38.440 7.911 -17.236 1.00 0.00 C ATOM 1443 C TYR A 97 38.421 8.335 -15.759 1.00 0.00 C ATOM 1444 O TYR A 97 37.934 7.618 -14.881 1.00 0.00 O ATOM 1445 CB TYR A 97 37.266 8.540 -17.996 1.00 0.00 C ATOM 1446 CG TYR A 97 37.193 8.226 -19.480 1.00 0.00 C ATOM 1447 CD1 TYR A 97 37.920 9.004 -20.402 1.00 0.00 C ATOM 1448 CD2 TYR A 97 36.391 7.161 -19.935 1.00 0.00 C ATOM 1449 CE1 TYR A 97 37.842 8.718 -21.780 1.00 0.00 C ATOM 1450 CE2 TYR A 97 36.312 6.872 -21.312 1.00 0.00 C ATOM 1451 CZ TYR A 97 37.040 7.651 -22.238 1.00 0.00 C ATOM 1452 OH TYR A 97 36.972 7.379 -23.568 1.00 0.00 O ATOM 0 H TYR A 97 37.656 6.043 -16.775 1.00 0.00 H new ATOM 0 HA TYR A 97 39.384 8.261 -17.653 1.00 0.00 H new ATOM 0 HB2 TYR A 97 36.338 8.211 -17.529 1.00 0.00 H new ATOM 0 HB3 TYR A 97 37.318 9.622 -17.875 1.00 0.00 H new ATOM 0 HD1 TYR A 97 38.537 9.819 -20.053 1.00 0.00 H new ATOM 0 HD2 TYR A 97 35.835 6.564 -19.227 1.00 0.00 H new ATOM 0 HE1 TYR A 97 38.397 9.317 -22.487 1.00 0.00 H new ATOM 0 HE2 TYR A 97 35.696 6.056 -21.659 1.00 0.00 H new ATOM 0 HH TYR A 97 36.378 6.614 -23.715 1.00 0.00 H new ATOM 1462 N VAL A 98 38.938 9.538 -15.498 1.00 0.00 N ATOM 1463 CA VAL A 98 39.235 10.064 -14.150 1.00 0.00 C ATOM 1464 C VAL A 98 38.025 10.505 -13.302 1.00 0.00 C ATOM 1465 O VAL A 98 38.206 10.904 -12.151 1.00 0.00 O ATOM 1466 CB VAL A 98 40.293 11.184 -14.237 1.00 0.00 C ATOM 1467 CG1 VAL A 98 41.580 10.692 -14.918 1.00 0.00 C ATOM 1468 CG2 VAL A 98 39.798 12.440 -14.964 1.00 0.00 C ATOM 0 H VAL A 98 39.171 10.199 -16.239 1.00 0.00 H new ATOM 0 HA VAL A 98 39.627 9.207 -13.602 1.00 0.00 H new ATOM 0 HB VAL A 98 40.499 11.457 -13.202 1.00 0.00 H new ATOM 0 HG11 VAL A 98 42.303 11.507 -14.962 1.00 0.00 H new ATOM 0 HG12 VAL A 98 42.000 9.864 -14.347 1.00 0.00 H new ATOM 0 HG13 VAL A 98 41.351 10.355 -15.929 1.00 0.00 H new ATOM 0 HG21 VAL A 98 40.594 13.184 -14.987 1.00 0.00 H new ATOM 0 HG22 VAL A 98 39.513 12.182 -15.984 1.00 0.00 H new ATOM 0 HG23 VAL A 98 38.935 12.848 -14.438 1.00 0.00 H new ATOM 1478 N ASN A 99 36.794 10.416 -13.826 1.00 0.00 N ATOM 1479 CA ASN A 99 35.556 10.841 -13.145 1.00 0.00 C ATOM 1480 C ASN A 99 34.561 9.674 -13.047 1.00 0.00 C ATOM 1481 O ASN A 99 33.405 9.819 -13.438 1.00 0.00 O ATOM 1482 CB ASN A 99 34.923 12.071 -13.846 1.00 0.00 C ATOM 1483 CG ASN A 99 35.920 13.084 -14.380 1.00 0.00 C ATOM 1484 OD1 ASN A 99 36.346 13.995 -13.683 1.00 0.00 O ATOM 1485 ND2 ASN A 99 36.317 12.946 -15.624 1.00 0.00 N ATOM 0 H ASN A 99 36.624 10.038 -14.758 1.00 0.00 H new ATOM 0 HA ASN A 99 35.815 11.145 -12.131 1.00 0.00 H new ATOM 0 HB2 ASN A 99 34.304 11.722 -14.672 1.00 0.00 H new ATOM 0 HB3 ASN A 99 34.260 12.572 -13.141 1.00 0.00 H new ATOM 0 HD21 ASN A 99 36.989 13.603 -16.021 1.00 0.00 H new ATOM 0 HD22 ASN A 99 35.954 12.182 -16.194 1.00 0.00 H new ATOM 1492 N PHE A 100 35.001 8.468 -12.676 1.00 0.00 N ATOM 1493 CA PHE A 100 34.166 7.259 -12.748 1.00 0.00 C ATOM 1494 C PHE A 100 32.791 7.431 -12.067 1.00 0.00 C ATOM 1495 O PHE A 100 32.701 7.665 -10.862 1.00 0.00 O ATOM 1496 CB PHE A 100 34.919 6.031 -12.221 1.00 0.00 C ATOM 1497 CG PHE A 100 34.088 4.762 -12.324 1.00 0.00 C ATOM 1498 CD1 PHE A 100 33.532 4.388 -13.563 1.00 0.00 C ATOM 1499 CD2 PHE A 100 33.822 3.984 -11.181 1.00 0.00 C ATOM 1500 CE1 PHE A 100 32.713 3.253 -13.663 1.00 0.00 C ATOM 1501 CE2 PHE A 100 32.990 2.854 -11.276 1.00 0.00 C ATOM 1502 CZ PHE A 100 32.423 2.499 -12.512 1.00 0.00 C ATOM 0 H PHE A 100 35.941 8.300 -12.318 1.00 0.00 H new ATOM 0 HA PHE A 100 33.953 7.091 -13.804 1.00 0.00 H new ATOM 0 HB2 PHE A 100 35.844 5.905 -12.784 1.00 0.00 H new ATOM 0 HB3 PHE A 100 35.199 6.197 -11.181 1.00 0.00 H new ATOM 0 HD1 PHE A 100 33.738 4.979 -14.443 1.00 0.00 H new ATOM 0 HD2 PHE A 100 34.257 4.255 -10.231 1.00 0.00 H new ATOM 0 HE1 PHE A 100 32.307 2.960 -14.620 1.00 0.00 H new ATOM 0 HE2 PHE A 100 32.787 2.258 -10.398 1.00 0.00 H new ATOM 0 HZ PHE A 100 31.764 1.646 -12.578 1.00 0.00 H new ATOM 1512 N CYS A 101 31.728 7.344 -12.873 1.00 0.00 N ATOM 1513 CA CYS A 101 30.324 7.629 -12.543 1.00 0.00 C ATOM 1514 C CYS A 101 30.029 8.996 -11.895 1.00 0.00 C ATOM 1515 O CYS A 101 29.014 9.151 -11.214 1.00 0.00 O ATOM 1516 CB CYS A 101 29.741 6.459 -11.727 1.00 0.00 C ATOM 1517 SG CYS A 101 29.842 4.880 -12.615 1.00 0.00 S ATOM 0 H CYS A 101 31.832 7.051 -13.845 1.00 0.00 H new ATOM 0 HA CYS A 101 29.814 7.717 -13.503 1.00 0.00 H new ATOM 0 HB2 CYS A 101 30.277 6.376 -10.782 1.00 0.00 H new ATOM 0 HB3 CYS A 101 28.699 6.671 -11.485 1.00 0.00 H new ATOM 0 HG CYS A 101 31.084 4.504 -12.692 1.00 0.00 H new ATOM 1523 N ASN A 102 30.869 10.015 -12.097 1.00 0.00 N ATOM 1524 CA ASN A 102 30.694 11.325 -11.457 1.00 0.00 C ATOM 1525 C ASN A 102 29.368 12.013 -11.825 1.00 0.00 C ATOM 1526 O ASN A 102 28.812 12.755 -11.018 1.00 0.00 O ATOM 1527 CB ASN A 102 31.907 12.209 -11.774 1.00 0.00 C ATOM 1528 CG ASN A 102 31.972 13.436 -10.871 1.00 0.00 C ATOM 1529 OD1 ASN A 102 32.144 13.336 -9.665 1.00 0.00 O ATOM 1530 ND2 ASN A 102 31.840 14.624 -11.415 1.00 0.00 N ATOM 0 H ASN A 102 31.686 9.958 -12.705 1.00 0.00 H new ATOM 0 HA ASN A 102 30.635 11.165 -10.380 1.00 0.00 H new ATOM 0 HB2 ASN A 102 32.821 11.626 -11.659 1.00 0.00 H new ATOM 0 HB3 ASN A 102 31.861 12.527 -12.815 1.00 0.00 H new ATOM 0 HD21 ASN A 102 31.881 15.460 -10.831 1.00 0.00 H new ATOM 0 HD22 ASN A 102 31.696 14.711 -12.421 1.00 0.00 H new ATOM 1537 N GLY A 103 28.810 11.730 -13.006 1.00 0.00 N ATOM 1538 CA GLY A 103 27.492 12.222 -13.421 1.00 0.00 C ATOM 1539 C GLY A 103 26.342 11.696 -12.551 1.00 0.00 C ATOM 1540 O GLY A 103 25.367 12.412 -12.328 1.00 0.00 O ATOM 0 H GLY A 103 29.265 11.147 -13.708 1.00 0.00 H new ATOM 0 HA2 GLY A 103 27.493 13.312 -13.389 1.00 0.00 H new ATOM 0 HA3 GLY A 103 27.315 11.934 -14.457 1.00 0.00 H new ATOM 1544 N GLY A 104 26.491 10.501 -11.964 1.00 0.00 N ATOM 1545 CA GLY A 104 25.569 9.960 -10.954 1.00 0.00 C ATOM 1546 C GLY A 104 25.926 10.383 -9.525 1.00 0.00 C ATOM 1547 O GLY A 104 25.041 10.775 -8.768 1.00 0.00 O ATOM 0 H GLY A 104 27.266 9.874 -12.180 1.00 0.00 H new ATOM 0 HA2 GLY A 104 24.556 10.291 -11.182 1.00 0.00 H new ATOM 0 HA3 GLY A 104 25.571 8.872 -11.015 1.00 0.00 H new ATOM 1551 N LYS A 105 27.221 10.410 -9.164 1.00 0.00 N ATOM 1552 CA LYS A 105 27.690 10.853 -7.827 1.00 0.00 C ATOM 1553 C LYS A 105 27.286 12.284 -7.479 1.00 0.00 C ATOM 1554 O LYS A 105 26.866 12.543 -6.352 1.00 0.00 O ATOM 1555 CB LYS A 105 29.216 10.704 -7.711 1.00 0.00 C ATOM 1556 CG LYS A 105 29.637 9.233 -7.633 1.00 0.00 C ATOM 1557 CD LYS A 105 31.148 9.073 -7.833 1.00 0.00 C ATOM 1558 CE LYS A 105 31.551 7.604 -7.650 1.00 0.00 C ATOM 1559 NZ LYS A 105 32.985 7.385 -8.002 1.00 0.00 N1+ ATOM 0 H LYS A 105 27.977 10.126 -9.787 1.00 0.00 H new ATOM 0 HA LYS A 105 27.194 10.201 -7.108 1.00 0.00 H new ATOM 0 HB2 LYS A 105 29.694 11.174 -8.570 1.00 0.00 H new ATOM 0 HB3 LYS A 105 29.567 11.231 -6.823 1.00 0.00 H new ATOM 0 HG2 LYS A 105 29.351 8.822 -6.665 1.00 0.00 H new ATOM 0 HG3 LYS A 105 29.105 8.660 -8.392 1.00 0.00 H new ATOM 0 HD2 LYS A 105 31.429 9.414 -8.829 1.00 0.00 H new ATOM 0 HD3 LYS A 105 31.685 9.697 -7.119 1.00 0.00 H new ATOM 0 HE2 LYS A 105 31.379 7.304 -6.616 1.00 0.00 H new ATOM 0 HE3 LYS A 105 30.921 6.972 -8.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 33.281 6.442 -7.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 33.103 7.451 -9.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 33.571 8.109 -7.539 1.00 0.00 H new ATOM 1573 N GLN A 106 27.323 13.197 -8.453 1.00 0.00 N ATOM 1574 CA GLN A 106 26.805 14.567 -8.291 1.00 0.00 C ATOM 1575 C GLN A 106 25.329 14.596 -7.860 1.00 0.00 C ATOM 1576 O GLN A 106 24.943 15.473 -7.094 1.00 0.00 O ATOM 1577 CB GLN A 106 27.006 15.361 -9.592 1.00 0.00 C ATOM 1578 CG GLN A 106 28.468 15.798 -9.766 1.00 0.00 C ATOM 1579 CD GLN A 106 28.761 16.284 -11.184 1.00 0.00 C ATOM 1580 OE1 GLN A 106 28.993 17.456 -11.450 1.00 0.00 O ATOM 1581 NE2 GLN A 106 28.792 15.382 -12.136 1.00 0.00 N ATOM 0 H GLN A 106 27.712 13.012 -9.378 1.00 0.00 H new ATOM 0 HA GLN A 106 27.373 15.036 -7.487 1.00 0.00 H new ATOM 0 HB2 GLN A 106 26.704 14.750 -10.443 1.00 0.00 H new ATOM 0 HB3 GLN A 106 26.361 16.240 -9.586 1.00 0.00 H new ATOM 0 HG2 GLN A 106 28.694 16.594 -9.057 1.00 0.00 H new ATOM 0 HG3 GLN A 106 29.126 14.962 -9.527 1.00 0.00 H new ATOM 0 HE21 GLN A 106 28.599 14.404 -11.919 1.00 0.00 H new ATOM 0 HE22 GLN A 106 29.009 15.658 -13.094 1.00 0.00 H new ATOM 1590 N PHE A 107 24.512 13.622 -8.276 1.00 0.00 N ATOM 1591 CA PHE A 107 23.114 13.531 -7.851 1.00 0.00 C ATOM 1592 C PHE A 107 22.950 13.005 -6.406 1.00 0.00 C ATOM 1593 O PHE A 107 21.978 13.356 -5.740 1.00 0.00 O ATOM 1594 CB PHE A 107 22.311 12.723 -8.877 1.00 0.00 C ATOM 1595 CG PHE A 107 20.869 13.181 -8.968 1.00 0.00 C ATOM 1596 CD1 PHE A 107 19.933 12.730 -8.022 1.00 0.00 C ATOM 1597 CD2 PHE A 107 20.472 14.097 -9.960 1.00 0.00 C ATOM 1598 CE1 PHE A 107 18.599 13.163 -8.085 1.00 0.00 C ATOM 1599 CE2 PHE A 107 19.141 14.550 -10.008 1.00 0.00 C ATOM 1600 CZ PHE A 107 18.204 14.069 -9.079 1.00 0.00 C ATOM 0 H PHE A 107 24.801 12.879 -8.913 1.00 0.00 H new ATOM 0 HA PHE A 107 22.706 14.541 -7.819 1.00 0.00 H new ATOM 0 HB2 PHE A 107 22.781 12.814 -9.856 1.00 0.00 H new ATOM 0 HB3 PHE A 107 22.338 11.667 -8.607 1.00 0.00 H new ATOM 0 HD1 PHE A 107 20.241 12.048 -7.244 1.00 0.00 H new ATOM 0 HD2 PHE A 107 21.190 14.452 -10.685 1.00 0.00 H new ATOM 0 HE1 PHE A 107 17.878 12.798 -7.368 1.00 0.00 H new ATOM 0 HE2 PHE A 107 18.840 15.267 -10.758 1.00 0.00 H new ATOM 0 HZ PHE A 107 17.177 14.398 -9.131 1.00 0.00 H new ATOM 1610 N ASP A 108 23.895 12.225 -5.864 1.00 0.00 N ATOM 1611 CA ASP A 108 23.873 11.912 -4.424 1.00 0.00 C ATOM 1612 C ASP A 108 24.353 13.118 -3.611 1.00 0.00 C ATOM 1613 O ASP A 108 23.699 13.503 -2.640 1.00 0.00 O ATOM 1614 CB ASP A 108 24.687 10.655 -4.091 1.00 0.00 C ATOM 1615 CG ASP A 108 24.531 10.250 -2.612 1.00 0.00 C ATOM 1616 OD1 ASP A 108 23.383 10.102 -2.129 1.00 0.00 O1- ATOM 1617 OD2 ASP A 108 25.555 10.010 -1.931 1.00 0.00 O ATOM 0 H ASP A 108 24.667 11.807 -6.383 1.00 0.00 H new ATOM 0 HA ASP A 108 22.841 11.695 -4.149 1.00 0.00 H new ATOM 0 HB2 ASP A 108 24.364 9.833 -4.729 1.00 0.00 H new ATOM 0 HB3 ASP A 108 25.740 10.834 -4.310 1.00 0.00 H new ATOM 1622 N ALA A 109 25.425 13.788 -4.055 1.00 0.00 N ATOM 1623 CA ALA A 109 25.859 15.066 -3.476 1.00 0.00 C ATOM 1624 C ALA A 109 24.735 16.130 -3.450 1.00 0.00 C ATOM 1625 O ALA A 109 24.539 16.778 -2.422 1.00 0.00 O ATOM 1626 CB ALA A 109 27.098 15.555 -4.233 1.00 0.00 C ATOM 0 H ALA A 109 26.013 13.461 -4.822 1.00 0.00 H new ATOM 0 HA ALA A 109 26.115 14.902 -2.429 1.00 0.00 H new ATOM 0 HB1 ALA A 109 27.430 16.504 -3.812 1.00 0.00 H new ATOM 0 HB2 ALA A 109 27.896 14.818 -4.140 1.00 0.00 H new ATOM 0 HB3 ALA A 109 26.851 15.692 -5.286 1.00 0.00 H new ATOM 1632 N LEU A 110 23.949 16.252 -4.531 1.00 0.00 N ATOM 1633 CA LEU A 110 22.759 17.109 -4.639 1.00 0.00 C ATOM 1634 C LEU A 110 21.792 16.914 -3.464 1.00 0.00 C ATOM 1635 O LEU A 110 21.275 17.892 -2.927 1.00 0.00 O ATOM 1636 CB LEU A 110 22.044 16.776 -5.967 1.00 0.00 C ATOM 1637 CG LEU A 110 20.694 17.469 -6.230 1.00 0.00 C ATOM 1638 CD1 LEU A 110 20.912 18.923 -6.619 1.00 0.00 C ATOM 1639 CD2 LEU A 110 19.923 16.733 -7.330 1.00 0.00 C ATOM 0 H LEU A 110 24.134 15.734 -5.390 1.00 0.00 H new ATOM 0 HA LEU A 110 23.079 18.151 -4.616 1.00 0.00 H new ATOM 0 HB2 LEU A 110 22.718 17.027 -6.786 1.00 0.00 H new ATOM 0 HB3 LEU A 110 21.884 15.698 -6.004 1.00 0.00 H new ATOM 0 HG LEU A 110 20.105 17.440 -5.314 1.00 0.00 H new ATOM 0 HD11 LEU A 110 19.949 19.399 -6.802 1.00 0.00 H new ATOM 0 HD12 LEU A 110 21.426 19.443 -5.811 1.00 0.00 H new ATOM 0 HD13 LEU A 110 21.518 18.971 -7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 110 18.971 17.234 -7.505 1.00 0.00 H new ATOM 0 HD22 LEU A 110 20.509 16.736 -8.249 1.00 0.00 H new ATOM 0 HD23 LEU A 110 19.740 15.704 -7.020 1.00 0.00 H new ATOM 1651 N LEU A 111 21.542 15.662 -3.073 1.00 0.00 N ATOM 1652 CA LEU A 111 20.534 15.301 -2.075 1.00 0.00 C ATOM 1653 C LEU A 111 21.102 15.279 -0.649 1.00 0.00 C ATOM 1654 O LEU A 111 20.449 15.740 0.288 1.00 0.00 O ATOM 1655 CB LEU A 111 19.947 13.934 -2.472 1.00 0.00 C ATOM 1656 CG LEU A 111 19.137 13.968 -3.784 1.00 0.00 C ATOM 1657 CD1 LEU A 111 18.792 12.545 -4.212 1.00 0.00 C ATOM 1658 CD2 LEU A 111 17.836 14.753 -3.617 1.00 0.00 C ATOM 0 H LEU A 111 22.044 14.857 -3.448 1.00 0.00 H new ATOM 0 HA LEU A 111 19.751 16.059 -2.063 1.00 0.00 H new ATOM 0 HB2 LEU A 111 20.760 13.215 -2.575 1.00 0.00 H new ATOM 0 HB3 LEU A 111 19.305 13.576 -1.667 1.00 0.00 H new ATOM 0 HG LEU A 111 19.751 14.459 -4.539 1.00 0.00 H new ATOM 0 HD11 LEU A 111 18.220 12.573 -5.139 1.00 0.00 H new ATOM 0 HD12 LEU A 111 19.711 11.980 -4.369 1.00 0.00 H new ATOM 0 HD13 LEU A 111 18.199 12.065 -3.434 1.00 0.00 H new ATOM 0 HD21 LEU A 111 17.290 14.757 -4.560 1.00 0.00 H new ATOM 0 HD22 LEU A 111 17.225 14.284 -2.846 1.00 0.00 H new ATOM 0 HD23 LEU A 111 18.064 15.778 -3.326 1.00 0.00 H new ATOM 1670 N GLN A 112 22.342 14.820 -0.474 1.00 0.00 N ATOM 1671 CA GLN A 112 23.052 14.894 0.807 1.00 0.00 C ATOM 1672 C GLN A 112 23.322 16.345 1.239 1.00 0.00 C ATOM 1673 O GLN A 112 23.267 16.643 2.431 1.00 0.00 O ATOM 1674 CB GLN A 112 24.339 14.056 0.739 1.00 0.00 C ATOM 1675 CG GLN A 112 24.022 12.552 0.629 1.00 0.00 C ATOM 1676 CD GLN A 112 23.259 12.038 1.845 1.00 0.00 C ATOM 1677 OE1 GLN A 112 23.770 11.946 2.952 1.00 0.00 O ATOM 1678 NE2 GLN A 112 21.986 11.743 1.693 1.00 0.00 N ATOM 0 H GLN A 112 22.886 14.384 -1.219 1.00 0.00 H new ATOM 0 HA GLN A 112 22.410 14.472 1.580 1.00 0.00 H new ATOM 0 HB2 GLN A 112 24.934 14.368 -0.119 1.00 0.00 H new ATOM 0 HB3 GLN A 112 24.942 14.239 1.628 1.00 0.00 H new ATOM 0 HG2 GLN A 112 23.434 12.370 -0.271 1.00 0.00 H new ATOM 0 HG3 GLN A 112 24.951 11.993 0.521 1.00 0.00 H new ATOM 0 HE21 GLN A 112 21.552 11.817 0.773 1.00 0.00 H new ATOM 0 HE22 GLN A 112 21.433 11.440 2.495 1.00 0.00 H new ATOM 1687 N GLU A 113 23.495 17.274 0.291 1.00 0.00 N ATOM 1688 CA GLU A 113 23.541 18.717 0.575 1.00 0.00 C ATOM 1689 C GLU A 113 22.208 19.262 1.143 1.00 0.00 C ATOM 1690 O GLU A 113 22.226 20.236 1.898 1.00 0.00 O ATOM 1691 CB GLU A 113 23.972 19.470 -0.696 1.00 0.00 C ATOM 1692 CG GLU A 113 24.232 20.961 -0.453 1.00 0.00 C ATOM 1693 CD GLU A 113 24.952 21.604 -1.654 1.00 0.00 C ATOM 1694 OE1 GLU A 113 24.269 22.061 -2.603 1.00 0.00 O1- ATOM 1695 OE2 GLU A 113 26.206 21.669 -1.651 1.00 0.00 O ATOM 0 H GLU A 113 23.607 17.048 -0.697 1.00 0.00 H new ATOM 0 HA GLU A 113 24.278 18.885 1.360 1.00 0.00 H new ATOM 0 HB2 GLU A 113 24.876 19.010 -1.095 1.00 0.00 H new ATOM 0 HB3 GLU A 113 23.198 19.361 -1.456 1.00 0.00 H new ATOM 0 HG2 GLU A 113 23.287 21.474 -0.275 1.00 0.00 H new ATOM 0 HG3 GLU A 113 24.836 21.086 0.446 1.00 0.00 H new ATOM 1702 N GLN A 114 21.069 18.600 0.869 1.00 0.00 N ATOM 1703 CA GLN A 114 19.770 18.929 1.484 1.00 0.00 C ATOM 1704 C GLN A 114 19.503 18.116 2.768 1.00 0.00 C ATOM 1705 O GLN A 114 18.470 18.314 3.403 1.00 0.00 O ATOM 1706 CB GLN A 114 18.602 18.748 0.487 1.00 0.00 C ATOM 1707 CG GLN A 114 18.766 19.342 -0.927 1.00 0.00 C ATOM 1708 CD GLN A 114 19.001 20.854 -1.013 1.00 0.00 C ATOM 1709 OE1 GLN A 114 19.744 21.463 -0.262 1.00 0.00 O ATOM 1710 NE2 GLN A 114 18.399 21.539 -1.966 1.00 0.00 N ATOM 0 H GLN A 114 21.024 17.820 0.213 1.00 0.00 H new ATOM 0 HA GLN A 114 19.827 19.981 1.763 1.00 0.00 H new ATOM 0 HB2 GLN A 114 18.414 17.680 0.382 1.00 0.00 H new ATOM 0 HB3 GLN A 114 17.709 19.187 0.933 1.00 0.00 H new ATOM 0 HG2 GLN A 114 19.602 18.839 -1.413 1.00 0.00 H new ATOM 0 HG3 GLN A 114 17.872 19.103 -1.503 1.00 0.00 H new ATOM 0 HE21 GLN A 114 17.770 21.066 -2.615 1.00 0.00 H new ATOM 0 HE22 GLN A 114 18.563 22.542 -2.054 1.00 0.00 H new ATOM 1719 N SER A 115 20.408 17.206 3.151 1.00 0.00 N ATOM 1720 CA SER A 115 20.344 16.333 4.341 1.00 0.00 C ATOM 1721 C SER A 115 19.354 15.159 4.209 1.00 0.00 C ATOM 1722 O SER A 115 18.897 14.612 5.217 1.00 0.00 O ATOM 1723 CB SER A 115 20.136 17.122 5.647 1.00 0.00 C ATOM 1724 OG SER A 115 21.062 18.195 5.766 1.00 0.00 O ATOM 0 H SER A 115 21.257 17.046 2.609 1.00 0.00 H new ATOM 0 HA SER A 115 21.331 15.874 4.399 1.00 0.00 H new ATOM 0 HB2 SER A 115 19.119 17.514 5.678 1.00 0.00 H new ATOM 0 HB3 SER A 115 20.245 16.451 6.499 1.00 0.00 H new ATOM 0 HG SER A 115 20.900 18.675 6.605 1.00 0.00 H new ATOM 1730 N ALA A 116 19.053 14.752 2.965 1.00 0.00 N ATOM 1731 CA ALA A 116 18.304 13.531 2.645 1.00 0.00 C ATOM 1732 C ALA A 116 18.979 12.253 3.202 1.00 0.00 C ATOM 1733 O ALA A 116 20.087 12.290 3.745 1.00 0.00 O ATOM 1734 CB ALA A 116 18.146 13.464 1.117 1.00 0.00 C ATOM 0 H ALA A 116 19.331 15.277 2.136 1.00 0.00 H new ATOM 0 HA ALA A 116 17.327 13.574 3.127 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.592 12.565 0.848 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.603 14.343 0.768 1.00 0.00 H new ATOM 0 HB3 ALA A 116 19.131 13.437 0.650 1.00 0.00 H new ATOM 1740 N GLN A 117 18.350 11.089 3.021 1.00 0.00 N ATOM 1741 CA GLN A 117 18.782 9.814 3.582 1.00 0.00 C ATOM 1742 C GLN A 117 18.696 8.719 2.531 1.00 0.00 C ATOM 1743 O GLN A 117 18.032 8.864 1.503 1.00 0.00 O ATOM 1744 CB GLN A 117 17.925 9.470 4.819 1.00 0.00 C ATOM 1745 CG GLN A 117 18.031 10.497 5.962 1.00 0.00 C ATOM 1746 CD GLN A 117 17.390 9.985 7.254 1.00 0.00 C ATOM 1747 OE1 GLN A 117 17.743 8.941 7.789 1.00 0.00 O ATOM 1748 NE2 GLN A 117 16.427 10.685 7.822 1.00 0.00 N ATOM 0 H GLN A 117 17.500 11.009 2.462 1.00 0.00 H new ATOM 0 HA GLN A 117 19.823 9.893 3.897 1.00 0.00 H new ATOM 0 HB2 GLN A 117 16.882 9.388 4.514 1.00 0.00 H new ATOM 0 HB3 GLN A 117 18.225 8.492 5.195 1.00 0.00 H new ATOM 0 HG2 GLN A 117 19.080 10.729 6.145 1.00 0.00 H new ATOM 0 HG3 GLN A 117 17.547 11.426 5.661 1.00 0.00 H new ATOM 0 HE21 GLN A 117 16.113 11.558 7.398 1.00 0.00 H new ATOM 0 HE22 GLN A 117 15.996 10.353 8.685 1.00 0.00 H new ATOM 1757 N ARG A 118 19.351 7.593 2.797 1.00 0.00 N ATOM 1758 CA ARG A 118 19.320 6.421 1.925 1.00 0.00 C ATOM 1759 C ARG A 118 19.011 5.117 2.649 1.00 0.00 C ATOM 1760 O ARG A 118 19.507 4.849 3.740 1.00 0.00 O ATOM 1761 CB ARG A 118 20.631 6.318 1.120 1.00 0.00 C ATOM 1762 CG ARG A 118 20.626 7.279 -0.071 1.00 0.00 C ATOM 1763 CD ARG A 118 21.731 6.970 -1.082 1.00 0.00 C ATOM 1764 NE ARG A 118 22.999 7.652 -0.776 1.00 0.00 N ATOM 1765 CZ ARG A 118 24.063 7.187 -0.151 1.00 0.00 C ATOM 1766 NH1 ARG A 118 24.099 6.017 0.428 1.00 0.00 N1+ ATOM 1767 NH2 ARG A 118 25.135 7.920 -0.113 1.00 0.00 N ATOM 0 H ARG A 118 19.924 7.466 3.631 1.00 0.00 H new ATOM 0 HA ARG A 118 18.486 6.572 1.239 1.00 0.00 H new ATOM 0 HB2 ARG A 118 21.478 6.543 1.769 1.00 0.00 H new ATOM 0 HB3 ARG A 118 20.764 5.296 0.765 1.00 0.00 H new ATOM 0 HG2 ARG A 118 19.658 7.228 -0.570 1.00 0.00 H new ATOM 0 HG3 ARG A 118 20.745 8.300 0.291 1.00 0.00 H new ATOM 0 HD2 ARG A 118 21.901 5.894 -1.108 1.00 0.00 H new ATOM 0 HD3 ARG A 118 21.398 7.264 -2.077 1.00 0.00 H new ATOM 0 HE ARG A 118 23.064 8.620 -1.092 1.00 0.00 H new ATOM 0 HH11 ARG A 118 23.277 5.414 0.410 1.00 0.00 H new ATOM 0 HH12 ARG A 118 24.949 5.706 0.898 1.00 0.00 H new ATOM 0 HH21 ARG A 118 25.143 8.836 -0.561 1.00 0.00 H new ATOM 0 HH22 ARG A 118 25.969 7.579 0.365 1.00 0.00 H new ATOM 1781 N VAL A 119 18.236 4.282 1.952 1.00 0.00 N ATOM 1782 CA VAL A 119 17.900 2.891 2.326 1.00 0.00 C ATOM 1783 C VAL A 119 18.832 1.872 1.629 1.00 0.00 C ATOM 1784 O VAL A 119 18.469 0.726 1.379 1.00 0.00 O ATOM 1785 CB VAL A 119 16.395 2.581 2.084 1.00 0.00 C ATOM 1786 CG1 VAL A 119 15.892 1.532 3.085 1.00 0.00 C ATOM 1787 CG2 VAL A 119 15.463 3.797 2.227 1.00 0.00 C ATOM 0 H VAL A 119 17.803 4.562 1.072 1.00 0.00 H new ATOM 0 HA VAL A 119 18.072 2.788 3.397 1.00 0.00 H new ATOM 0 HB VAL A 119 16.356 2.231 1.053 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.837 1.329 2.900 1.00 0.00 H new ATOM 0 HG12 VAL A 119 16.465 0.612 2.967 1.00 0.00 H new ATOM 0 HG13 VAL A 119 16.016 1.909 4.100 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.434 3.490 2.042 1.00 0.00 H new ATOM 0 HG22 VAL A 119 15.545 4.202 3.236 1.00 0.00 H new ATOM 0 HG23 VAL A 119 15.749 4.562 1.505 1.00 0.00 H new ATOM 1797 N GLY A 120 20.040 2.312 1.259 1.00 0.00 N ATOM 1798 CA GLY A 120 21.022 1.534 0.492 1.00 0.00 C ATOM 1799 C GLY A 120 22.258 2.327 0.055 1.00 0.00 C ATOM 1800 O GLY A 120 22.461 3.480 0.446 1.00 0.00 O ATOM 0 H GLY A 120 20.372 3.248 1.492 1.00 0.00 H new ATOM 0 HA2 GLY A 120 21.345 0.685 1.094 1.00 0.00 H new ATOM 0 HA3 GLY A 120 20.534 1.129 -0.394 1.00 0.00 H new ATOM 1804 N GLU A 121 23.081 1.704 -0.790 1.00 0.00 N ATOM 1805 CA GLU A 121 24.359 2.242 -1.284 1.00 0.00 C ATOM 1806 C GLU A 121 24.411 2.259 -2.821 1.00 0.00 C ATOM 1807 O GLU A 121 23.702 1.512 -3.499 1.00 0.00 O ATOM 1808 CB GLU A 121 25.531 1.424 -0.710 1.00 0.00 C ATOM 1809 CG GLU A 121 25.651 1.542 0.817 1.00 0.00 C ATOM 1810 CD GLU A 121 26.892 0.787 1.328 1.00 0.00 C ATOM 1811 OE1 GLU A 121 27.993 1.389 1.382 1.00 0.00 O1- ATOM 1812 OE2 GLU A 121 26.778 -0.413 1.682 1.00 0.00 O ATOM 0 H GLU A 121 22.873 0.779 -1.165 1.00 0.00 H new ATOM 0 HA GLU A 121 24.445 3.274 -0.945 1.00 0.00 H new ATOM 0 HB2 GLU A 121 25.402 0.376 -0.979 1.00 0.00 H new ATOM 0 HB3 GLU A 121 26.461 1.759 -1.169 1.00 0.00 H new ATOM 0 HG2 GLU A 121 25.716 2.592 1.101 1.00 0.00 H new ATOM 0 HG3 GLU A 121 24.755 1.139 1.289 1.00 0.00 H new ATOM 1819 N MET A 122 25.245 3.149 -3.376 1.00 0.00 N ATOM 1820 CA MET A 122 25.300 3.454 -4.810 1.00 0.00 C ATOM 1821 C MET A 122 25.842 2.280 -5.632 1.00 0.00 C ATOM 1822 O MET A 122 26.981 1.848 -5.432 1.00 0.00 O ATOM 1823 CB MET A 122 26.158 4.713 -5.023 1.00 0.00 C ATOM 1824 CG MET A 122 26.204 5.191 -6.485 1.00 0.00 C ATOM 1825 SD MET A 122 27.215 6.666 -6.806 1.00 0.00 S ATOM 1826 CE MET A 122 26.752 7.756 -5.436 1.00 0.00 C ATOM 0 H MET A 122 25.915 3.688 -2.827 1.00 0.00 H new ATOM 0 HA MET A 122 24.284 3.635 -5.162 1.00 0.00 H new ATOM 0 HB2 MET A 122 25.768 5.517 -4.399 1.00 0.00 H new ATOM 0 HB3 MET A 122 27.174 4.511 -4.684 1.00 0.00 H new ATOM 0 HG2 MET A 122 26.580 4.375 -7.102 1.00 0.00 H new ATOM 0 HG3 MET A 122 25.185 5.395 -6.813 1.00 0.00 H new ATOM 0 HE1 MET A 122 27.274 8.707 -5.536 1.00 0.00 H new ATOM 0 HE2 MET A 122 25.676 7.929 -5.456 1.00 0.00 H new ATOM 0 HE3 MET A 122 27.027 7.289 -4.490 1.00 0.00 H new ATOM 1836 N LEU A 123 25.043 1.792 -6.584 1.00 0.00 N ATOM 1837 CA LEU A 123 25.506 0.828 -7.581 1.00 0.00 C ATOM 1838 C LEU A 123 26.338 1.575 -8.641 1.00 0.00 C ATOM 1839 O LEU A 123 25.940 2.657 -9.069 1.00 0.00 O ATOM 1840 CB LEU A 123 24.271 0.107 -8.164 1.00 0.00 C ATOM 1841 CG LEU A 123 24.481 -1.269 -8.822 1.00 0.00 C ATOM 1842 CD1 LEU A 123 24.983 -1.163 -10.255 1.00 0.00 C ATOM 1843 CD2 LEU A 123 25.417 -2.180 -8.026 1.00 0.00 C ATOM 0 H LEU A 123 24.062 2.053 -6.684 1.00 0.00 H new ATOM 0 HA LEU A 123 26.155 0.066 -7.149 1.00 0.00 H new ATOM 0 HB2 LEU A 123 23.545 -0.015 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 123 23.819 0.766 -8.905 1.00 0.00 H new ATOM 0 HG LEU A 123 23.490 -1.722 -8.830 1.00 0.00 H new ATOM 0 HD11 LEU A 123 25.113 -2.163 -10.670 1.00 0.00 H new ATOM 0 HD12 LEU A 123 24.258 -0.613 -10.855 1.00 0.00 H new ATOM 0 HD13 LEU A 123 25.938 -0.637 -10.268 1.00 0.00 H new ATOM 0 HD21 LEU A 123 25.523 -3.134 -8.543 1.00 0.00 H new ATOM 0 HD22 LEU A 123 26.394 -1.706 -7.934 1.00 0.00 H new ATOM 0 HD23 LEU A 123 25.001 -2.350 -7.033 1.00 0.00 H new ATOM 1855 N LEU A 124 27.485 1.024 -9.054 1.00 0.00 N ATOM 1856 CA LEU A 124 28.486 1.701 -9.893 1.00 0.00 C ATOM 1857 C LEU A 124 28.803 0.867 -11.151 1.00 0.00 C ATOM 1858 O LEU A 124 29.719 0.041 -11.167 1.00 0.00 O ATOM 1859 CB LEU A 124 29.738 2.003 -9.046 1.00 0.00 C ATOM 1860 CG LEU A 124 29.546 3.109 -7.991 1.00 0.00 C ATOM 1861 CD1 LEU A 124 30.696 3.098 -6.985 1.00 0.00 C ATOM 1862 CD2 LEU A 124 29.525 4.497 -8.631 1.00 0.00 C ATOM 0 H LEU A 124 27.752 0.070 -8.809 1.00 0.00 H new ATOM 0 HA LEU A 124 28.088 2.650 -10.252 1.00 0.00 H new ATOM 0 HB2 LEU A 124 30.049 1.088 -8.542 1.00 0.00 H new ATOM 0 HB3 LEU A 124 30.551 2.292 -9.713 1.00 0.00 H new ATOM 0 HG LEU A 124 28.594 2.907 -7.500 1.00 0.00 H new ATOM 0 HD11 LEU A 124 30.542 3.886 -6.248 1.00 0.00 H new ATOM 0 HD12 LEU A 124 30.730 2.132 -6.481 1.00 0.00 H new ATOM 0 HD13 LEU A 124 31.638 3.268 -7.507 1.00 0.00 H new ATOM 0 HD21 LEU A 124 29.388 5.252 -7.857 1.00 0.00 H new ATOM 0 HD22 LEU A 124 30.468 4.674 -9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 124 28.704 4.556 -9.345 1.00 0.00 H new ATOM 1874 N ILE A 125 27.974 1.045 -12.180 1.00 0.00 N ATOM 1875 CA ILE A 125 27.997 0.290 -13.443 1.00 0.00 C ATOM 1876 C ILE A 125 29.172 0.748 -14.328 1.00 0.00 C ATOM 1877 O ILE A 125 29.340 1.946 -14.561 1.00 0.00 O ATOM 1878 CB ILE A 125 26.655 0.488 -14.186 1.00 0.00 C ATOM 1879 CG1 ILE A 125 25.442 0.112 -13.305 1.00 0.00 C ATOM 1880 CG2 ILE A 125 26.633 -0.333 -15.485 1.00 0.00 C ATOM 1881 CD1 ILE A 125 24.083 0.523 -13.876 1.00 0.00 C ATOM 0 H ILE A 125 27.235 1.748 -12.160 1.00 0.00 H new ATOM 0 HA ILE A 125 28.133 -0.768 -13.221 1.00 0.00 H new ATOM 0 HB ILE A 125 26.575 1.548 -14.426 1.00 0.00 H new ATOM 0 HG12 ILE A 125 25.444 -0.967 -13.150 1.00 0.00 H new ATOM 0 HG13 ILE A 125 25.564 0.575 -12.326 1.00 0.00 H new ATOM 0 HG21 ILE A 125 25.682 -0.182 -15.995 1.00 0.00 H new ATOM 0 HG22 ILE A 125 27.447 -0.010 -16.133 1.00 0.00 H new ATOM 0 HG23 ILE A 125 26.754 -1.390 -15.249 1.00 0.00 H new ATOM 0 HD11 ILE A 125 23.293 0.218 -13.190 1.00 0.00 H new ATOM 0 HD12 ILE A 125 24.055 1.605 -14.004 1.00 0.00 H new ATOM 0 HD13 ILE A 125 23.932 0.039 -14.841 1.00 0.00 H new ATOM 1893 N ASP A 126 29.939 -0.204 -14.883 1.00 0.00 N ATOM 1894 CA ASP A 126 31.161 0.072 -15.654 1.00 0.00 C ATOM 1895 C ASP A 126 31.153 -0.528 -17.071 1.00 0.00 C ATOM 1896 O ASP A 126 31.399 -1.722 -17.279 1.00 0.00 O ATOM 1897 CB ASP A 126 32.389 -0.418 -14.873 1.00 0.00 C ATOM 1898 CG ASP A 126 33.705 -0.029 -15.570 1.00 0.00 C ATOM 1899 OD1 ASP A 126 33.701 0.844 -16.476 1.00 0.00 O1- ATOM 1900 OD2 ASP A 126 34.759 -0.600 -15.213 1.00 0.00 O ATOM 0 H ASP A 126 29.725 -1.198 -14.808 1.00 0.00 H new ATOM 0 HA ASP A 126 31.205 1.153 -15.789 1.00 0.00 H new ATOM 0 HB2 ASP A 126 32.372 0.004 -13.868 1.00 0.00 H new ATOM 0 HB3 ASP A 126 32.342 -1.502 -14.765 1.00 0.00 H new ATOM 1905 N ALA A 127 30.938 0.335 -18.066 1.00 0.00 N ATOM 1906 CA ALA A 127 31.039 0.004 -19.484 1.00 0.00 C ATOM 1907 C ALA A 127 32.422 -0.541 -19.919 1.00 0.00 C ATOM 1908 O ALA A 127 32.512 -1.147 -20.991 1.00 0.00 O ATOM 1909 CB ALA A 127 30.635 1.240 -20.294 1.00 0.00 C ATOM 0 H ALA A 127 30.682 1.308 -17.901 1.00 0.00 H new ATOM 0 HA ALA A 127 30.358 -0.824 -19.681 1.00 0.00 H new ATOM 0 HB1 ALA A 127 30.703 1.016 -21.358 1.00 0.00 H new ATOM 0 HB2 ALA A 127 29.611 1.518 -20.047 1.00 0.00 H new ATOM 0 HB3 ALA A 127 31.304 2.067 -20.054 1.00 0.00 H new ATOM 1915 N SER A 128 33.484 -0.398 -19.107 1.00 0.00 N ATOM 1916 CA SER A 128 34.802 -1.008 -19.381 1.00 0.00 C ATOM 1917 C SER A 128 34.784 -2.545 -19.365 1.00 0.00 C ATOM 1918 O SER A 128 35.662 -3.170 -19.962 1.00 0.00 O ATOM 1919 CB SER A 128 35.880 -0.579 -18.369 1.00 0.00 C ATOM 1920 OG SER A 128 35.772 0.769 -17.976 1.00 0.00 O ATOM 0 H SER A 128 33.455 0.143 -18.243 1.00 0.00 H new ATOM 0 HA SER A 128 35.040 -0.646 -20.381 1.00 0.00 H new ATOM 0 HB2 SER A 128 35.812 -1.214 -17.486 1.00 0.00 H new ATOM 0 HB3 SER A 128 36.865 -0.745 -18.806 1.00 0.00 H new ATOM 0 HG SER A 128 34.898 0.919 -17.558 1.00 0.00 H new ATOM 1926 N GLU A 129 33.809 -3.158 -18.680 1.00 0.00 N ATOM 1927 CA GLU A 129 33.754 -4.614 -18.454 1.00 0.00 C ATOM 1928 C GLU A 129 32.345 -5.236 -18.531 1.00 0.00 C ATOM 1929 O GLU A 129 32.233 -6.464 -18.543 1.00 0.00 O ATOM 1930 CB GLU A 129 34.436 -4.962 -17.117 1.00 0.00 C ATOM 1931 CG GLU A 129 33.747 -4.359 -15.884 1.00 0.00 C ATOM 1932 CD GLU A 129 34.392 -4.887 -14.587 1.00 0.00 C ATOM 1933 OE1 GLU A 129 35.554 -4.524 -14.279 1.00 0.00 O1- ATOM 1934 OE2 GLU A 129 33.743 -5.681 -13.862 1.00 0.00 O ATOM 0 H GLU A 129 33.027 -2.654 -18.262 1.00 0.00 H new ATOM 0 HA GLU A 129 34.297 -5.062 -19.286 1.00 0.00 H new ATOM 0 HB2 GLU A 129 34.466 -6.046 -17.009 1.00 0.00 H new ATOM 0 HB3 GLU A 129 35.469 -4.616 -17.148 1.00 0.00 H new ATOM 0 HG2 GLU A 129 33.820 -3.272 -15.916 1.00 0.00 H new ATOM 0 HG3 GLU A 129 32.686 -4.608 -15.896 1.00 0.00 H new ATOM 1941 N ASN A 130 31.277 -4.432 -18.621 1.00 0.00 N ATOM 1942 CA ASN A 130 29.896 -4.917 -18.692 1.00 0.00 C ATOM 1943 C ASN A 130 29.048 -4.181 -19.761 1.00 0.00 C ATOM 1944 O ASN A 130 28.662 -3.030 -19.536 1.00 0.00 O ATOM 1945 CB ASN A 130 29.254 -4.815 -17.295 1.00 0.00 C ATOM 1946 CG ASN A 130 27.835 -5.361 -17.304 1.00 0.00 C ATOM 1947 OD1 ASN A 130 27.466 -6.179 -18.133 1.00 0.00 O ATOM 1948 ND2 ASN A 130 26.977 -4.903 -16.425 1.00 0.00 N ATOM 0 H ASN A 130 31.351 -3.415 -18.647 1.00 0.00 H new ATOM 0 HA ASN A 130 29.921 -5.959 -19.010 1.00 0.00 H new ATOM 0 HB2 ASN A 130 29.855 -5.368 -16.574 1.00 0.00 H new ATOM 0 HB3 ASN A 130 29.245 -3.774 -16.971 1.00 0.00 H new ATOM 0 HD21 ASN A 130 26.011 -5.230 -16.437 1.00 0.00 H new ATOM 0 HD22 ASN A 130 27.276 -4.220 -15.729 1.00 0.00 H new ATOM 1955 N PRO A 131 28.713 -4.830 -20.897 1.00 0.00 N ATOM 1956 CA PRO A 131 27.778 -4.306 -21.900 1.00 0.00 C ATOM 1957 C PRO A 131 26.284 -4.508 -21.547 1.00 0.00 C ATOM 1958 O PRO A 131 25.414 -4.061 -22.298 1.00 0.00 O ATOM 1959 CB PRO A 131 28.151 -5.044 -23.190 1.00 0.00 C ATOM 1960 CG PRO A 131 28.593 -6.418 -22.690 1.00 0.00 C ATOM 1961 CD PRO A 131 29.261 -6.104 -21.352 1.00 0.00 C ATOM 0 HA PRO A 131 27.872 -3.223 -21.978 1.00 0.00 H new ATOM 0 HB2 PRO A 131 27.304 -5.117 -23.872 1.00 0.00 H new ATOM 0 HB3 PRO A 131 28.950 -4.535 -23.728 1.00 0.00 H new ATOM 0 HG2 PRO A 131 27.746 -7.094 -22.569 1.00 0.00 H new ATOM 0 HG3 PRO A 131 29.285 -6.895 -23.384 1.00 0.00 H new ATOM 0 HD2 PRO A 131 29.062 -6.892 -20.626 1.00 0.00 H new ATOM 0 HD3 PRO A 131 30.343 -6.041 -21.465 1.00 0.00 H new ATOM 1969 N GLU A 132 25.965 -5.157 -20.421 1.00 0.00 N ATOM 1970 CA GLU A 132 24.605 -5.527 -19.992 1.00 0.00 C ATOM 1971 C GLU A 132 24.315 -4.977 -18.578 1.00 0.00 C ATOM 1972 O GLU A 132 24.400 -5.716 -17.589 1.00 0.00 O ATOM 1973 CB GLU A 132 24.419 -7.057 -20.068 1.00 0.00 C ATOM 1974 CG GLU A 132 24.475 -7.588 -21.507 1.00 0.00 C ATOM 1975 CD GLU A 132 24.208 -9.105 -21.551 1.00 0.00 C ATOM 1976 OE1 GLU A 132 23.023 -9.516 -21.630 1.00 0.00 O ATOM 1977 OE2 GLU A 132 25.180 -9.900 -21.518 1.00 0.00 O1- ATOM 0 H GLU A 132 26.676 -5.453 -19.753 1.00 0.00 H new ATOM 0 HA GLU A 132 23.881 -5.074 -20.669 1.00 0.00 H new ATOM 0 HB2 GLU A 132 25.194 -7.543 -19.475 1.00 0.00 H new ATOM 0 HB3 GLU A 132 23.461 -7.325 -19.623 1.00 0.00 H new ATOM 0 HG2 GLU A 132 23.737 -7.068 -22.118 1.00 0.00 H new ATOM 0 HG3 GLU A 132 25.453 -7.375 -21.938 1.00 0.00 H new ATOM 1984 N PRO A 133 23.989 -3.675 -18.435 1.00 0.00 N ATOM 1985 CA PRO A 133 23.897 -2.976 -17.141 1.00 0.00 C ATOM 1986 C PRO A 133 22.836 -3.549 -16.185 1.00 0.00 C ATOM 1987 O PRO A 133 22.964 -3.445 -14.964 1.00 0.00 O ATOM 1988 CB PRO A 133 23.652 -1.507 -17.509 1.00 0.00 C ATOM 1989 CG PRO A 133 22.976 -1.566 -18.872 1.00 0.00 C ATOM 1990 CD PRO A 133 23.674 -2.754 -19.523 1.00 0.00 C ATOM 0 HA PRO A 133 24.812 -3.105 -16.563 1.00 0.00 H new ATOM 0 HB2 PRO A 133 23.018 -1.013 -16.772 1.00 0.00 H new ATOM 0 HB3 PRO A 133 24.586 -0.947 -17.553 1.00 0.00 H new ATOM 0 HG2 PRO A 133 21.900 -1.721 -18.787 1.00 0.00 H new ATOM 0 HG3 PRO A 133 23.121 -0.647 -19.439 1.00 0.00 H new ATOM 0 HD2 PRO A 133 23.030 -3.229 -20.263 1.00 0.00 H new ATOM 0 HD3 PRO A 133 24.579 -2.439 -20.043 1.00 0.00 H new ATOM 1998 N GLU A 134 21.831 -4.236 -16.731 1.00 0.00 N ATOM 1999 CA GLU A 134 20.845 -5.036 -15.995 1.00 0.00 C ATOM 2000 C GLU A 134 21.502 -6.060 -15.062 1.00 0.00 C ATOM 2001 O GLU A 134 21.108 -6.187 -13.906 1.00 0.00 O ATOM 2002 CB GLU A 134 19.992 -5.767 -17.041 1.00 0.00 C ATOM 2003 CG GLU A 134 18.896 -6.659 -16.444 1.00 0.00 C ATOM 2004 CD GLU A 134 18.061 -7.326 -17.557 1.00 0.00 C ATOM 2005 OE1 GLU A 134 17.339 -6.616 -18.301 1.00 0.00 O ATOM 2006 OE2 GLU A 134 18.145 -8.570 -17.715 1.00 0.00 O1- ATOM 0 H GLU A 134 21.674 -4.252 -17.739 1.00 0.00 H new ATOM 0 HA GLU A 134 20.247 -4.378 -15.364 1.00 0.00 H new ATOM 0 HB2 GLU A 134 19.528 -5.029 -17.696 1.00 0.00 H new ATOM 0 HB3 GLU A 134 20.645 -6.379 -17.663 1.00 0.00 H new ATOM 0 HG2 GLU A 134 19.348 -7.425 -15.814 1.00 0.00 H new ATOM 0 HG3 GLU A 134 18.246 -6.063 -15.804 1.00 0.00 H new ATOM 2013 N THR A 135 22.539 -6.760 -15.532 1.00 0.00 N ATOM 2014 CA THR A 135 23.156 -7.900 -14.815 1.00 0.00 C ATOM 2015 C THR A 135 23.859 -7.514 -13.510 1.00 0.00 C ATOM 2016 O THR A 135 24.075 -8.364 -12.646 1.00 0.00 O ATOM 2017 CB THR A 135 24.144 -8.668 -15.710 1.00 0.00 C ATOM 2018 OG1 THR A 135 25.226 -7.864 -16.130 1.00 0.00 O ATOM 2019 CG2 THR A 135 23.444 -9.226 -16.948 1.00 0.00 C ATOM 0 H THR A 135 22.984 -6.556 -16.427 1.00 0.00 H new ATOM 0 HA THR A 135 22.315 -8.542 -14.552 1.00 0.00 H new ATOM 0 HB THR A 135 24.531 -9.484 -15.100 1.00 0.00 H new ATOM 0 HG1 THR A 135 24.884 -7.035 -16.524 1.00 0.00 H new ATOM 0 HG21 THR A 135 24.166 -9.764 -17.563 1.00 0.00 H new ATOM 0 HG22 THR A 135 22.650 -9.907 -16.641 1.00 0.00 H new ATOM 0 HG23 THR A 135 23.016 -8.406 -17.525 1.00 0.00 H new ATOM 2027 N GLU A 136 24.154 -6.224 -13.333 1.00 0.00 N ATOM 2028 CA GLU A 136 24.733 -5.658 -12.100 1.00 0.00 C ATOM 2029 C GLU A 136 23.705 -4.891 -11.255 1.00 0.00 C ATOM 2030 O GLU A 136 23.992 -4.545 -10.109 1.00 0.00 O ATOM 2031 CB GLU A 136 25.913 -4.736 -12.470 1.00 0.00 C ATOM 2032 CG GLU A 136 27.145 -5.492 -12.995 1.00 0.00 C ATOM 2033 CD GLU A 136 27.826 -6.327 -11.890 1.00 0.00 C ATOM 2034 OE1 GLU A 136 28.517 -5.740 -11.020 1.00 0.00 O ATOM 2035 OE2 GLU A 136 27.693 -7.575 -11.888 1.00 0.00 O1- ATOM 0 H GLU A 136 23.995 -5.523 -14.057 1.00 0.00 H new ATOM 0 HA GLU A 136 25.079 -6.490 -11.487 1.00 0.00 H new ATOM 0 HB2 GLU A 136 25.584 -4.025 -13.228 1.00 0.00 H new ATOM 0 HB3 GLU A 136 26.200 -4.157 -11.592 1.00 0.00 H new ATOM 0 HG2 GLU A 136 26.846 -6.148 -13.813 1.00 0.00 H new ATOM 0 HG3 GLU A 136 27.861 -4.779 -13.404 1.00 0.00 H new ATOM 2042 N SER A 137 22.488 -4.682 -11.771 1.00 0.00 N ATOM 2043 CA SER A 137 21.502 -3.774 -11.169 1.00 0.00 C ATOM 2044 C SER A 137 20.155 -4.416 -10.842 1.00 0.00 C ATOM 2045 O SER A 137 19.475 -3.980 -9.918 1.00 0.00 O ATOM 2046 CB SER A 137 21.269 -2.590 -12.105 1.00 0.00 C ATOM 2047 OG SER A 137 22.480 -2.065 -12.616 1.00 0.00 O ATOM 0 H SER A 137 22.157 -5.139 -12.621 1.00 0.00 H new ATOM 0 HA SER A 137 21.930 -3.464 -10.216 1.00 0.00 H new ATOM 0 HB2 SER A 137 20.633 -2.903 -12.933 1.00 0.00 H new ATOM 0 HB3 SER A 137 20.733 -1.806 -11.570 1.00 0.00 H new ATOM 0 HG SER A 137 22.714 -2.531 -13.446 1.00 0.00 H new ATOM 2053 N ASN A 138 19.753 -5.480 -11.536 1.00 0.00 N ATOM 2054 CA ASN A 138 18.541 -6.223 -11.194 1.00 0.00 C ATOM 2055 C ASN A 138 18.614 -6.815 -9.759 1.00 0.00 C ATOM 2056 O ASN A 138 17.729 -6.492 -8.961 1.00 0.00 O ATOM 2057 CB ASN A 138 18.265 -7.203 -12.345 1.00 0.00 C ATOM 2058 CG ASN A 138 17.200 -8.255 -12.060 1.00 0.00 C ATOM 2059 OD1 ASN A 138 17.299 -9.037 -11.128 1.00 0.00 O ATOM 2060 ND2 ASN A 138 16.168 -8.345 -12.866 1.00 0.00 N ATOM 0 H ASN A 138 20.254 -5.849 -12.345 1.00 0.00 H new ATOM 0 HA ASN A 138 17.664 -5.580 -11.119 1.00 0.00 H new ATOM 0 HB2 ASN A 138 17.963 -6.632 -13.223 1.00 0.00 H new ATOM 0 HB3 ASN A 138 19.195 -7.711 -12.600 1.00 0.00 H new ATOM 0 HD21 ASN A 138 15.460 -9.063 -12.710 1.00 0.00 H new ATOM 0 HD22 ASN A 138 16.074 -7.697 -13.648 1.00 0.00 H new ATOM 2067 N PRO A 139 19.684 -7.538 -9.353 1.00 0.00 N ATOM 2068 CA PRO A 139 19.898 -7.934 -7.956 1.00 0.00 C ATOM 2069 C PRO A 139 19.897 -6.773 -6.950 1.00 0.00 C ATOM 2070 O PRO A 139 19.419 -6.939 -5.829 1.00 0.00 O ATOM 2071 CB PRO A 139 21.245 -8.662 -7.925 1.00 0.00 C ATOM 2072 CG PRO A 139 21.332 -9.238 -9.331 1.00 0.00 C ATOM 2073 CD PRO A 139 20.722 -8.132 -10.187 1.00 0.00 C ATOM 0 HA PRO A 139 19.063 -8.560 -7.641 1.00 0.00 H new ATOM 0 HB2 PRO A 139 22.070 -7.982 -7.712 1.00 0.00 H new ATOM 0 HB3 PRO A 139 21.269 -9.442 -7.164 1.00 0.00 H new ATOM 0 HG2 PRO A 139 22.362 -9.450 -9.618 1.00 0.00 H new ATOM 0 HG3 PRO A 139 20.777 -10.172 -9.421 1.00 0.00 H new ATOM 0 HD2 PRO A 139 21.472 -7.393 -10.470 1.00 0.00 H new ATOM 0 HD3 PRO A 139 20.305 -8.533 -11.111 1.00 0.00 H new ATOM 2081 N TRP A 140 20.399 -5.595 -7.342 1.00 0.00 N ATOM 2082 CA TRP A 140 20.370 -4.395 -6.500 1.00 0.00 C ATOM 2083 C TRP A 140 18.931 -3.974 -6.170 1.00 0.00 C ATOM 2084 O TRP A 140 18.600 -3.803 -4.997 1.00 0.00 O ATOM 2085 CB TRP A 140 21.148 -3.256 -7.175 1.00 0.00 C ATOM 2086 CG TRP A 140 21.281 -2.005 -6.351 1.00 0.00 C ATOM 2087 CD1 TRP A 140 22.339 -1.663 -5.579 1.00 0.00 C ATOM 2088 CD2 TRP A 140 20.309 -0.923 -6.174 1.00 0.00 C ATOM 2089 NE1 TRP A 140 22.099 -0.442 -4.970 1.00 0.00 N ATOM 2090 CE2 TRP A 140 20.843 0.033 -5.262 1.00 0.00 C ATOM 2091 CE3 TRP A 140 19.022 -0.661 -6.682 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 20.127 1.168 -4.852 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 18.287 0.468 -6.278 1.00 0.00 C ATOM 2094 CH2 TRP A 140 18.835 1.380 -5.362 1.00 0.00 C ATOM 0 H TRP A 140 20.836 -5.448 -8.252 1.00 0.00 H new ATOM 0 HA TRP A 140 20.857 -4.629 -5.553 1.00 0.00 H new ATOM 0 HB2 TRP A 140 22.146 -3.616 -7.426 1.00 0.00 H new ATOM 0 HB3 TRP A 140 20.654 -3.005 -8.114 1.00 0.00 H new ATOM 0 HD1 TRP A 140 23.235 -2.253 -5.456 1.00 0.00 H new ATOM 0 HE1 TRP A 140 22.772 0.045 -4.378 1.00 0.00 H new ATOM 0 HE3 TRP A 140 18.589 -1.343 -7.399 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 20.563 1.868 -4.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 17.296 0.634 -6.674 1.00 0.00 H new ATOM 0 HH2 TRP A 140 18.265 2.243 -5.050 1.00 0.00 H new ATOM 2105 N VAL A 141 18.040 -3.876 -7.168 1.00 0.00 N ATOM 2106 CA VAL A 141 16.629 -3.513 -6.914 1.00 0.00 C ATOM 2107 C VAL A 141 15.876 -4.659 -6.217 1.00 0.00 C ATOM 2108 O VAL A 141 15.018 -4.405 -5.367 1.00 0.00 O ATOM 2109 CB VAL A 141 15.870 -3.078 -8.187 1.00 0.00 C ATOM 2110 CG1 VAL A 141 14.554 -2.382 -7.801 1.00 0.00 C ATOM 2111 CG2 VAL A 141 16.628 -2.084 -9.076 1.00 0.00 C ATOM 0 H VAL A 141 18.263 -4.040 -8.150 1.00 0.00 H new ATOM 0 HA VAL A 141 16.662 -2.648 -6.252 1.00 0.00 H new ATOM 0 HB VAL A 141 15.723 -4.002 -8.746 1.00 0.00 H new ATOM 0 HG11 VAL A 141 14.025 -2.078 -8.704 1.00 0.00 H new ATOM 0 HG12 VAL A 141 13.932 -3.071 -7.230 1.00 0.00 H new ATOM 0 HG13 VAL A 141 14.772 -1.503 -7.195 1.00 0.00 H new ATOM 0 HG21 VAL A 141 16.019 -1.836 -9.945 1.00 0.00 H new ATOM 0 HG22 VAL A 141 16.839 -1.177 -8.510 1.00 0.00 H new ATOM 0 HG23 VAL A 141 17.565 -2.532 -9.406 1.00 0.00 H new ATOM 2121 N GLU A 142 16.212 -5.925 -6.510 1.00 0.00 N ATOM 2122 CA GLU A 142 15.676 -7.087 -5.783 1.00 0.00 C ATOM 2123 C GLU A 142 16.136 -7.147 -4.308 1.00 0.00 C ATOM 2124 O GLU A 142 15.533 -7.870 -3.513 1.00 0.00 O ATOM 2125 CB GLU A 142 16.037 -8.401 -6.498 1.00 0.00 C ATOM 2126 CG GLU A 142 15.263 -8.638 -7.807 1.00 0.00 C ATOM 2127 CD GLU A 142 15.448 -10.070 -8.360 1.00 0.00 C ATOM 2128 OE1 GLU A 142 16.480 -10.732 -8.082 1.00 0.00 O1- ATOM 2129 OE2 GLU A 142 14.528 -10.563 -9.059 1.00 0.00 O ATOM 0 H GLU A 142 16.862 -6.172 -7.256 1.00 0.00 H new ATOM 0 HA GLU A 142 14.593 -6.962 -5.777 1.00 0.00 H new ATOM 0 HB2 GLU A 142 17.105 -8.402 -6.715 1.00 0.00 H new ATOM 0 HB3 GLU A 142 15.848 -9.234 -5.821 1.00 0.00 H new ATOM 0 HG2 GLU A 142 14.202 -8.454 -7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 142 15.595 -7.918 -8.556 1.00 0.00 H new ATOM 2136 N HIS A 143 17.164 -6.379 -3.919 1.00 0.00 N ATOM 2137 CA HIS A 143 17.597 -6.203 -2.528 1.00 0.00 C ATOM 2138 C HIS A 143 16.995 -4.937 -1.904 1.00 0.00 C ATOM 2139 O HIS A 143 16.299 -5.034 -0.894 1.00 0.00 O ATOM 2140 CB HIS A 143 19.134 -6.172 -2.466 1.00 0.00 C ATOM 2141 CG HIS A 143 19.665 -5.841 -1.091 1.00 0.00 C ATOM 2142 ND1 HIS A 143 19.885 -6.759 -0.060 1.00 0.00 N ATOM 2143 CD2 HIS A 143 19.960 -4.587 -0.639 1.00 0.00 C ATOM 2144 CE1 HIS A 143 20.316 -6.033 0.989 1.00 0.00 C ATOM 2145 NE2 HIS A 143 20.373 -4.728 0.668 1.00 0.00 N ATOM 0 H HIS A 143 17.731 -5.850 -4.582 1.00 0.00 H new ATOM 0 HA HIS A 143 17.234 -7.049 -1.944 1.00 0.00 H new ATOM 0 HB2 HIS A 143 19.524 -7.142 -2.776 1.00 0.00 H new ATOM 0 HB3 HIS A 143 19.506 -5.436 -3.179 1.00 0.00 H new ATOM 0 HD2 HIS A 143 19.884 -3.665 -1.197 1.00 0.00 H new ATOM 0 HE1 HIS A 143 20.579 -6.442 1.953 1.00 0.00 H new ATOM 0 HE2 HIS A 143 20.671 -3.973 1.286 1.00 0.00 H new ATOM 2153 N TRP A 144 17.223 -3.760 -2.502 1.00 0.00 N ATOM 2154 CA TRP A 144 16.797 -2.453 -1.977 1.00 0.00 C ATOM 2155 C TRP A 144 15.298 -2.430 -1.653 1.00 0.00 C ATOM 2156 O TRP A 144 14.917 -2.119 -0.525 1.00 0.00 O ATOM 2157 CB TRP A 144 17.198 -1.355 -2.981 1.00 0.00 C ATOM 2158 CG TRP A 144 16.843 0.058 -2.615 1.00 0.00 C ATOM 2159 CD1 TRP A 144 17.560 0.875 -1.809 1.00 0.00 C ATOM 2160 CD2 TRP A 144 15.706 0.859 -3.062 1.00 0.00 C ATOM 2161 NE1 TRP A 144 16.942 2.101 -1.698 1.00 0.00 N ATOM 2162 CE2 TRP A 144 15.794 2.146 -2.448 1.00 0.00 C ATOM 2163 CE3 TRP A 144 14.608 0.632 -3.922 1.00 0.00 C ATOM 2164 CZ2 TRP A 144 14.831 3.140 -2.645 1.00 0.00 C ATOM 2165 CZ3 TRP A 144 13.643 1.636 -4.140 1.00 0.00 C ATOM 2166 CH2 TRP A 144 13.753 2.881 -3.499 1.00 0.00 C ATOM 0 H TRP A 144 17.722 -3.687 -3.388 1.00 0.00 H new ATOM 0 HA TRP A 144 17.304 -2.262 -1.031 1.00 0.00 H new ATOM 0 HB2 TRP A 144 18.277 -1.407 -3.129 1.00 0.00 H new ATOM 0 HB3 TRP A 144 16.733 -1.585 -3.940 1.00 0.00 H new ATOM 0 HD1 TRP A 144 18.485 0.604 -1.322 1.00 0.00 H new ATOM 0 HE1 TRP A 144 17.292 2.874 -1.132 1.00 0.00 H new ATOM 0 HE3 TRP A 144 14.507 -0.322 -4.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 144 14.918 4.094 -2.146 1.00 0.00 H new ATOM 0 HZ3 TRP A 144 12.813 1.447 -4.805 1.00 0.00 H new ATOM 0 HH2 TRP A 144 13.004 3.641 -3.666 1.00 0.00 H new ATOM 2177 N GLY A 145 14.455 -2.884 -2.591 1.00 0.00 N ATOM 2178 CA GLY A 145 13.003 -2.996 -2.428 1.00 0.00 C ATOM 2179 C GLY A 145 12.529 -3.793 -1.199 1.00 0.00 C ATOM 2180 O GLY A 145 11.439 -3.516 -0.699 1.00 0.00 O ATOM 0 H GLY A 145 14.776 -3.192 -3.509 1.00 0.00 H new ATOM 0 HA2 GLY A 145 12.584 -1.992 -2.371 1.00 0.00 H new ATOM 0 HA3 GLY A 145 12.590 -3.463 -3.322 1.00 0.00 H new ATOM 2184 N THR A 146 13.324 -4.725 -0.654 1.00 0.00 N ATOM 2185 CA THR A 146 12.957 -5.488 0.560 1.00 0.00 C ATOM 2186 C THR A 146 12.936 -4.637 1.841 1.00 0.00 C ATOM 2187 O THR A 146 12.353 -5.050 2.845 1.00 0.00 O ATOM 2188 CB THR A 146 13.877 -6.698 0.805 1.00 0.00 C ATOM 2189 OG1 THR A 146 15.182 -6.304 1.162 1.00 0.00 O ATOM 2190 CG2 THR A 146 13.973 -7.627 -0.403 1.00 0.00 C ATOM 0 H THR A 146 14.236 -4.974 -1.036 1.00 0.00 H new ATOM 0 HA THR A 146 11.944 -5.832 0.351 1.00 0.00 H new ATOM 0 HB THR A 146 13.414 -7.239 1.630 1.00 0.00 H new ATOM 0 HG1 THR A 146 15.701 -6.119 0.352 1.00 0.00 H new ATOM 0 HG21 THR A 146 14.635 -8.461 -0.169 1.00 0.00 H new ATOM 0 HG22 THR A 146 12.982 -8.009 -0.648 1.00 0.00 H new ATOM 0 HG23 THR A 146 14.371 -7.076 -1.255 1.00 0.00 H new ATOM 2198 N LEU A 147 13.554 -3.450 1.808 1.00 0.00 N ATOM 2199 CA LEU A 147 13.747 -2.558 2.957 1.00 0.00 C ATOM 2200 C LEU A 147 12.721 -1.406 3.005 1.00 0.00 C ATOM 2201 O LEU A 147 12.576 -0.746 4.037 1.00 0.00 O ATOM 2202 CB LEU A 147 15.180 -1.999 2.894 1.00 0.00 C ATOM 2203 CG LEU A 147 16.305 -3.054 2.812 1.00 0.00 C ATOM 2204 CD1 LEU A 147 17.666 -2.369 2.716 1.00 0.00 C ATOM 2205 CD2 LEU A 147 16.322 -3.983 4.030 1.00 0.00 C ATOM 0 H LEU A 147 13.948 -3.070 0.947 1.00 0.00 H new ATOM 0 HA LEU A 147 13.592 -3.135 3.869 1.00 0.00 H new ATOM 0 HB2 LEU A 147 15.257 -1.343 2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 147 15.349 -1.382 3.776 1.00 0.00 H new ATOM 0 HG LEU A 147 16.107 -3.650 1.921 1.00 0.00 H new ATOM 0 HD11 LEU A 147 18.450 -3.124 2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 147 17.697 -1.745 1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.824 -1.748 3.598 1.00 0.00 H new ATOM 0 HD21 LEU A 147 17.130 -4.706 3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 147 16.477 -3.395 4.934 1.00 0.00 H new ATOM 0 HD23 LEU A 147 15.370 -4.510 4.099 1.00 0.00 H new ATOM 2217 N LEU A 148 12.016 -1.165 1.895 1.00 0.00 N ATOM 2218 CA LEU A 148 10.972 -0.140 1.763 1.00 0.00 C ATOM 2219 C LEU A 148 9.714 -0.499 2.582 1.00 0.00 C ATOM 2220 O LEU A 148 9.285 -1.658 2.621 1.00 0.00 O ATOM 2221 CB LEU A 148 10.611 0.007 0.268 1.00 0.00 C ATOM 2222 CG LEU A 148 11.535 0.910 -0.572 1.00 0.00 C ATOM 2223 CD1 LEU A 148 11.292 2.384 -0.271 1.00 0.00 C ATOM 2224 CD2 LEU A 148 13.020 0.639 -0.385 1.00 0.00 C ATOM 0 H LEU A 148 12.160 -1.694 1.035 1.00 0.00 H new ATOM 0 HA LEU A 148 11.354 0.803 2.155 1.00 0.00 H new ATOM 0 HB2 LEU A 148 10.603 -0.986 -0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 148 9.596 0.397 0.198 1.00 0.00 H new ATOM 0 HG LEU A 148 11.276 0.668 -1.603 1.00 0.00 H new ATOM 0 HD11 LEU A 148 11.959 2.994 -0.879 1.00 0.00 H new ATOM 0 HD12 LEU A 148 10.257 2.637 -0.502 1.00 0.00 H new ATOM 0 HD13 LEU A 148 11.486 2.577 0.784 1.00 0.00 H new ATOM 0 HD21 LEU A 148 13.596 1.319 -1.013 1.00 0.00 H new ATOM 0 HD22 LEU A 148 13.289 0.794 0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 148 13.240 -0.390 -0.668 1.00 0.00 H new ATOM 2236 N SER A 149 9.065 0.524 3.158 1.00 0.00 N ATOM 2237 CA SER A 149 7.907 0.413 4.078 1.00 0.00 C ATOM 2238 C SER A 149 8.075 -0.658 5.178 1.00 0.00 C ATOM 2239 O SER A 149 8.960 -0.465 6.043 1.00 0.00 O ATOM 2240 CB SER A 149 6.597 0.309 3.289 1.00 0.00 C ATOM 2241 OG SER A 149 6.690 -0.807 2.429 1.00 0.00 O ATOM 2242 OXT SER A 149 7.316 -1.656 5.220 1.00 0.00 O1- ATOM 0 H SER A 149 9.338 1.493 2.994 1.00 0.00 H new ATOM 0 HA SER A 149 7.860 1.340 4.649 1.00 0.00 H new ATOM 0 HB2 SER A 149 5.752 0.197 3.968 1.00 0.00 H new ATOM 0 HB3 SER A 149 6.426 1.219 2.714 1.00 0.00 H new ATOM 0 HG SER A 149 7.077 -1.564 2.916 1.00 0.00 H new