USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1099 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 137 SER OG : rot -87:sc= -0.428 USER MOD Set 1.2: A 138 ASN : amide:sc= -1.13 X(o=-1.6,f=-2) USER MOD Set 2.1: A 130 ASN : amide:sc= 0.386 X(o=0.48,f=0.63) USER MOD Set 2.2: A 135 THR OG1 : rot 180:sc= 0.0988 USER MOD Set 3.1: A 95 SER OG : rot 180:sc= 0.939 USER MOD Set 3.2: A 128 SER OG : rot 167:sc= 1.54 USER MOD Set 4.1: A 82 GLN : amide:sc= 0.391 K(o=1.5,f=-1.2) USER MOD Set 4.2: A 114 GLN : amide:sc= 1.11 K(o=1.5,f=-2.8) USER MOD Set 5.1: A 32 LYS NZ :NH3+ 178:sc= 0.748 (180deg=0) USER MOD Set 5.2: A 34 THR OG1 : rot -120:sc= 0.664 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -156:sc= 0.937 (180deg=0.409) USER MOD Single : A 10 THR OG1 : rot 159:sc= 0.451 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= -0.0274 K(o=-0.027,f=-1.1) USER MOD Single : A 15 SER OG : rot 178:sc= 0.631 USER MOD Single : A 27 THR OG1 : rot 84:sc= 1.06 USER MOD Single : A 29 GLN : amide:sc= 0.467 K(o=0.47,f=-3.1!) USER MOD Single : A 31 HIS : no HE2:sc= 0.545 K(o=0.54,f=-2.5!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= 0.906 K(o=0.91,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 169:sc= 1.93 (180deg=1.7) USER MOD Single : A 51 TYR OH : rot 165:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= -0.0433 USER MOD Single : A 58 THR OG1 : rot -140:sc= 0 USER MOD Single : A 59 THR OG1 : rot 100:sc= 0.289 USER MOD Single : A 61 GLN : amide:sc= -0.02 K(o=-0.02,f=-1.9!) USER MOD Single : A 67 SER OG : rot -126:sc= 1.2 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.158 X(o=-0.16,f=-0.16) USER MOD Single : A 87 TYR OH : rot 178:sc= -1.39 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= 0.755 K(o=0.76,f=-0.024) USER MOD Single : A 101 CYS SG : rot 100:sc= 1.55 USER MOD Single : A 102 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= -0.105 X(o=-0.1,f=-0.46) USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 115 SER OG : rot 47:sc= 1.24 USER MOD Single : A 117 GLN : amide:sc= 0.167 X(o=0.17,f=0) USER MOD Single : A 122 MET CE :methyl -165:sc=-0.00743 (180deg=-0.187) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 THR OG1 : rot -56:sc= 1.29 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.605 0.599 0.951 1.00 1.00 N ATOM 2 CA MET A 1 2.097 -0.267 -0.165 1.00 1.00 C ATOM 3 C MET A 1 3.546 -0.729 0.048 1.00 1.00 C ATOM 4 O MET A 1 3.748 -1.922 0.231 1.00 1.00 O ATOM 5 CB MET A 1 1.882 0.376 -1.558 1.00 1.00 C ATOM 6 CG MET A 1 2.305 -0.550 -2.712 1.00 1.00 C ATOM 7 SD MET A 1 2.055 0.158 -4.363 1.00 1.00 S ATOM 8 CE MET A 1 2.777 -1.162 -5.377 1.00 1.00 C ATOM 0 H1 MET A 1 0.567 0.554 0.993 1.00 1.00 H new ATOM 0 H2 MET A 1 2.003 0.264 1.852 1.00 1.00 H new ATOM 0 H3 MET A 1 1.903 1.582 0.785 1.00 1.00 H new ATOM 0 HA MET A 1 1.480 -1.165 -0.146 1.00 1.00 H new ATOM 0 HB2 MET A 1 0.830 0.637 -1.674 1.00 1.00 H new ATOM 0 HB3 MET A 1 2.450 1.305 -1.616 1.00 1.00 H new ATOM 0 HG2 MET A 1 3.359 -0.802 -2.593 1.00 1.00 H new ATOM 0 HG3 MET A 1 1.744 -1.482 -2.640 1.00 1.00 H new ATOM 0 HE1 MET A 1 2.708 -0.891 -6.430 1.00 1.00 H new ATOM 0 HE2 MET A 1 3.824 -1.298 -5.106 1.00 1.00 H new ATOM 0 HE3 MET A 1 2.234 -2.091 -5.205 1.00 1.00 H new ATOM 20 N ALA A 2 4.531 0.179 0.033 1.00 1.00 N ATOM 21 CA ALA A 2 5.982 -0.078 0.066 1.00 1.00 C ATOM 22 C ALA A 2 6.586 -0.757 -1.174 1.00 1.00 C ATOM 23 O ALA A 2 6.066 -1.724 -1.730 1.00 1.00 O ATOM 24 CB ALA A 2 6.405 -0.793 1.359 1.00 1.00 C ATOM 0 H ALA A 2 4.325 1.177 -0.005 1.00 1.00 H new ATOM 0 HA ALA A 2 6.414 0.923 0.049 1.00 1.00 H new ATOM 0 HB1 ALA A 2 7.481 -0.964 1.345 1.00 1.00 H new ATOM 0 HB2 ALA A 2 6.148 -0.174 2.218 1.00 1.00 H new ATOM 0 HB3 ALA A 2 5.886 -1.749 1.432 1.00 1.00 H new ATOM 30 N GLU A 3 7.777 -0.270 -1.525 1.00 1.00 N ATOM 31 CA GLU A 3 8.680 -0.819 -2.530 1.00 1.00 C ATOM 32 C GLU A 3 10.028 -1.156 -1.895 1.00 1.00 C ATOM 33 O GLU A 3 10.662 -0.304 -1.275 1.00 1.00 O ATOM 34 CB GLU A 3 8.889 0.209 -3.644 1.00 1.00 C ATOM 35 CG GLU A 3 7.908 0.019 -4.790 1.00 1.00 C ATOM 36 CD GLU A 3 7.741 1.281 -5.655 1.00 1.00 C ATOM 37 OE1 GLU A 3 7.182 2.293 -5.165 1.00 1.00 O ATOM 38 OE2 GLU A 3 8.155 1.265 -6.838 1.00 1.00 O1- ATOM 0 H GLU A 3 8.157 0.569 -1.087 1.00 1.00 H new ATOM 0 HA GLU A 3 8.241 -1.727 -2.943 1.00 1.00 H new ATOM 0 HB2 GLU A 3 8.778 1.213 -3.235 1.00 1.00 H new ATOM 0 HB3 GLU A 3 9.908 0.130 -4.023 1.00 1.00 H new ATOM 0 HG2 GLU A 3 8.248 -0.804 -5.419 1.00 1.00 H new ATOM 0 HG3 GLU A 3 6.937 -0.269 -4.386 1.00 1.00 H new ATOM 45 N ILE A 4 10.435 -2.414 -2.055 1.00 1.00 N ATOM 46 CA ILE A 4 11.613 -3.033 -1.460 1.00 1.00 C ATOM 47 C ILE A 4 12.503 -3.687 -2.510 1.00 1.00 C ATOM 48 O ILE A 4 12.166 -4.723 -3.083 1.00 1.00 O ATOM 49 CB ILE A 4 11.252 -4.059 -0.366 1.00 1.00 C ATOM 50 CG1 ILE A 4 10.180 -3.507 0.605 1.00 1.00 C ATOM 51 CG2 ILE A 4 12.512 -4.417 0.424 1.00 1.00 C ATOM 52 CD1 ILE A 4 8.873 -4.265 0.452 1.00 1.00 C ATOM 0 H ILE A 4 9.916 -3.068 -2.641 1.00 1.00 H new ATOM 0 HA ILE A 4 12.168 -2.221 -0.990 1.00 1.00 H new ATOM 0 HB ILE A 4 10.842 -4.943 -0.854 1.00 1.00 H new ATOM 0 HG12 ILE A 4 10.536 -3.590 1.632 1.00 1.00 H new ATOM 0 HG13 ILE A 4 10.016 -2.447 0.409 1.00 1.00 H new ATOM 0 HG21 ILE A 4 12.262 -5.142 1.199 1.00 1.00 H new ATOM 0 HG22 ILE A 4 13.254 -4.847 -0.249 1.00 1.00 H new ATOM 0 HG23 ILE A 4 12.919 -3.518 0.886 1.00 1.00 H new ATOM 0 HD11 ILE A 4 8.134 -3.860 1.144 1.00 1.00 H new ATOM 0 HD12 ILE A 4 8.509 -4.160 -0.570 1.00 1.00 H new ATOM 0 HD13 ILE A 4 9.036 -5.320 0.672 1.00 1.00 H new ATOM 64 N GLY A 5 13.691 -3.131 -2.693 1.00 1.00 N ATOM 65 CA GLY A 5 14.731 -3.769 -3.495 1.00 1.00 C ATOM 66 C GLY A 5 15.637 -4.596 -2.606 1.00 1.00 C ATOM 67 O GLY A 5 16.170 -4.074 -1.636 1.00 1.00 O ATOM 0 H GLY A 5 13.963 -2.232 -2.295 1.00 1.00 H new ATOM 0 HA2 GLY A 5 14.277 -4.404 -4.256 1.00 1.00 H new ATOM 0 HA3 GLY A 5 15.314 -3.011 -4.018 1.00 1.00 H new ATOM 71 N ILE A 6 15.799 -5.882 -2.899 1.00 1.00 N ATOM 72 CA ILE A 6 16.633 -6.789 -2.122 1.00 1.00 C ATOM 73 C ILE A 6 17.924 -7.056 -2.869 1.00 1.00 C ATOM 74 O ILE A 6 17.908 -7.548 -3.994 1.00 1.00 O ATOM 75 CB ILE A 6 15.883 -8.079 -1.833 1.00 1.00 C ATOM 76 CG1 ILE A 6 14.643 -7.726 -1.005 1.00 1.00 C ATOM 77 CG2 ILE A 6 16.746 -9.071 -1.040 1.00 1.00 C ATOM 78 CD1 ILE A 6 13.494 -8.617 -1.381 1.00 1.00 C ATOM 0 H ILE A 6 15.347 -6.330 -3.696 1.00 1.00 H new ATOM 0 HA ILE A 6 16.878 -6.329 -1.165 1.00 1.00 H new ATOM 0 HB ILE A 6 15.615 -8.551 -2.778 1.00 1.00 H new ATOM 0 HG12 ILE A 6 14.864 -7.834 0.057 1.00 1.00 H new ATOM 0 HG13 ILE A 6 14.372 -6.683 -1.170 1.00 1.00 H new ATOM 0 HG21 ILE A 6 16.176 -9.981 -0.853 1.00 1.00 H new ATOM 0 HG22 ILE A 6 17.640 -9.315 -1.614 1.00 1.00 H new ATOM 0 HG23 ILE A 6 17.036 -8.622 -0.090 1.00 1.00 H new ATOM 0 HD11 ILE A 6 12.620 -8.355 -0.785 1.00 1.00 H new ATOM 0 HD12 ILE A 6 13.264 -8.487 -2.439 1.00 1.00 H new ATOM 0 HD13 ILE A 6 13.763 -9.656 -1.193 1.00 1.00 H new ATOM 90 N PHE A 7 19.037 -6.773 -2.219 1.00 1.00 N ATOM 91 CA PHE A 7 20.361 -6.753 -2.819 1.00 1.00 C ATOM 92 C PHE A 7 21.197 -7.846 -2.167 1.00 1.00 C ATOM 93 O PHE A 7 21.502 -7.769 -0.972 1.00 1.00 O ATOM 94 CB PHE A 7 20.954 -5.343 -2.652 1.00 1.00 C ATOM 95 CG PHE A 7 20.296 -4.324 -3.569 1.00 1.00 C ATOM 96 CD1 PHE A 7 19.007 -3.831 -3.294 1.00 1.00 C ATOM 97 CD2 PHE A 7 20.955 -3.909 -4.739 1.00 1.00 C ATOM 98 CE1 PHE A 7 18.367 -2.982 -4.209 1.00 1.00 C ATOM 99 CE2 PHE A 7 20.312 -3.070 -5.664 1.00 1.00 C ATOM 100 CZ PHE A 7 19.005 -2.628 -5.404 1.00 1.00 C ATOM 0 H PHE A 7 19.046 -6.543 -1.225 1.00 1.00 H new ATOM 0 HA PHE A 7 20.334 -6.961 -3.889 1.00 1.00 H new ATOM 0 HB2 PHE A 7 20.838 -5.024 -1.616 1.00 1.00 H new ATOM 0 HB3 PHE A 7 22.024 -5.375 -2.858 1.00 1.00 H new ATOM 0 HD1 PHE A 7 18.509 -4.107 -2.376 1.00 1.00 H new ATOM 0 HD2 PHE A 7 21.966 -4.238 -4.929 1.00 1.00 H new ATOM 0 HE1 PHE A 7 17.380 -2.601 -3.991 1.00 1.00 H new ATOM 0 HE2 PHE A 7 20.819 -2.767 -6.568 1.00 1.00 H new ATOM 0 HZ PHE A 7 18.490 -2.013 -6.128 1.00 1.00 H new ATOM 110 N VAL A 8 21.511 -8.895 -2.931 1.00 1.00 N ATOM 111 CA VAL A 8 22.226 -10.059 -2.392 1.00 1.00 C ATOM 112 C VAL A 8 23.749 -9.888 -2.512 1.00 1.00 C ATOM 113 O VAL A 8 24.245 -9.479 -3.560 1.00 1.00 O ATOM 114 CB VAL A 8 21.718 -11.382 -3.002 1.00 1.00 C ATOM 115 CG1 VAL A 8 22.120 -11.613 -4.462 1.00 1.00 C ATOM 116 CG2 VAL A 8 22.192 -12.580 -2.171 1.00 1.00 C ATOM 0 H VAL A 8 21.283 -8.964 -3.923 1.00 1.00 H new ATOM 0 HA VAL A 8 22.005 -10.118 -1.326 1.00 1.00 H new ATOM 0 HB VAL A 8 20.632 -11.292 -2.983 1.00 1.00 H new ATOM 0 HG11 VAL A 8 21.718 -12.567 -4.803 1.00 1.00 H new ATOM 0 HG12 VAL A 8 21.721 -10.809 -5.081 1.00 1.00 H new ATOM 0 HG13 VAL A 8 23.207 -11.628 -4.542 1.00 1.00 H new ATOM 0 HG21 VAL A 8 21.823 -13.502 -2.619 1.00 1.00 H new ATOM 0 HG22 VAL A 8 23.282 -12.599 -2.148 1.00 1.00 H new ATOM 0 HG23 VAL A 8 21.809 -12.492 -1.154 1.00 1.00 H new ATOM 126 N GLY A 9 24.495 -10.226 -1.454 1.00 1.00 N ATOM 127 CA GLY A 9 25.961 -10.329 -1.466 1.00 1.00 C ATOM 128 C GLY A 9 26.414 -11.715 -1.007 1.00 1.00 C ATOM 129 O GLY A 9 25.913 -12.216 -0.003 1.00 1.00 O ATOM 0 H GLY A 9 24.088 -10.441 -0.544 1.00 1.00 H new ATOM 0 HA2 GLY A 9 26.335 -10.134 -2.471 1.00 1.00 H new ATOM 0 HA3 GLY A 9 26.388 -9.568 -0.814 1.00 1.00 H new ATOM 133 N THR A 10 27.317 -12.382 -1.729 1.00 1.00 N ATOM 134 CA THR A 10 27.714 -13.775 -1.409 1.00 1.00 C ATOM 135 C THR A 10 29.106 -14.172 -1.909 1.00 1.00 C ATOM 136 O THR A 10 29.555 -13.712 -2.958 1.00 1.00 O ATOM 137 CB THR A 10 26.660 -14.769 -1.931 1.00 1.00 C ATOM 138 OG1 THR A 10 27.001 -16.045 -1.461 1.00 1.00 O ATOM 139 CG2 THR A 10 26.544 -14.862 -3.450 1.00 1.00 C ATOM 0 H THR A 10 27.793 -11.989 -2.541 1.00 1.00 H new ATOM 0 HA THR A 10 27.767 -13.817 -0.321 1.00 1.00 H new ATOM 0 HB THR A 10 25.700 -14.402 -1.569 1.00 1.00 H new ATOM 0 HG1 THR A 10 26.210 -16.624 -1.483 1.00 1.00 H new ATOM 0 HG21 THR A 10 25.775 -15.589 -3.712 1.00 1.00 H new ATOM 0 HG22 THR A 10 26.275 -13.886 -3.855 1.00 1.00 H new ATOM 0 HG23 THR A 10 27.499 -15.178 -3.869 1.00 1.00 H new ATOM 147 N MET A 11 29.782 -15.053 -1.163 1.00 1.00 N ATOM 148 CA MET A 11 31.024 -15.732 -1.555 1.00 1.00 C ATOM 149 C MET A 11 30.779 -17.252 -1.465 1.00 1.00 C ATOM 150 O MET A 11 31.262 -17.936 -0.563 1.00 1.00 O ATOM 151 CB MET A 11 32.189 -15.207 -0.703 1.00 1.00 C ATOM 152 CG MET A 11 33.555 -15.721 -1.170 1.00 1.00 C ATOM 153 SD MET A 11 34.944 -15.059 -0.210 1.00 1.00 S ATOM 154 CE MET A 11 36.319 -15.885 -1.060 1.00 1.00 C ATOM 0 H MET A 11 29.467 -15.324 -0.232 1.00 1.00 H new ATOM 0 HA MET A 11 31.312 -15.520 -2.585 1.00 1.00 H new ATOM 0 HB2 MET A 11 32.189 -14.117 -0.730 1.00 1.00 H new ATOM 0 HB3 MET A 11 32.033 -15.500 0.335 1.00 1.00 H new ATOM 0 HG2 MET A 11 33.566 -16.809 -1.107 1.00 1.00 H new ATOM 0 HG3 MET A 11 33.693 -15.461 -2.220 1.00 1.00 H new ATOM 0 HE1 MET A 11 37.261 -15.591 -0.598 1.00 1.00 H new ATOM 0 HE2 MET A 11 36.198 -16.966 -0.983 1.00 1.00 H new ATOM 0 HE3 MET A 11 36.324 -15.595 -2.111 1.00 1.00 H new ATOM 164 N TYR A 12 29.942 -17.753 -2.384 1.00 1.00 N ATOM 165 CA TYR A 12 29.408 -19.126 -2.424 1.00 1.00 C ATOM 166 C TYR A 12 28.561 -19.535 -1.191 1.00 1.00 C ATOM 167 O TYR A 12 28.378 -20.724 -0.917 1.00 1.00 O ATOM 168 CB TYR A 12 30.516 -20.133 -2.793 1.00 1.00 C ATOM 169 CG TYR A 12 31.363 -19.722 -3.984 1.00 1.00 C ATOM 170 CD1 TYR A 12 30.838 -19.824 -5.288 1.00 1.00 C ATOM 171 CD2 TYR A 12 32.664 -19.214 -3.787 1.00 1.00 C ATOM 172 CE1 TYR A 12 31.609 -19.422 -6.395 1.00 1.00 C ATOM 173 CE2 TYR A 12 33.439 -18.813 -4.890 1.00 1.00 C ATOM 174 CZ TYR A 12 32.915 -18.916 -6.199 1.00 1.00 C ATOM 175 OH TYR A 12 33.671 -18.525 -7.262 1.00 1.00 O ATOM 0 H TYR A 12 29.601 -17.185 -3.159 1.00 1.00 H new ATOM 0 HA TYR A 12 28.671 -19.147 -3.227 1.00 1.00 H new ATOM 0 HB2 TYR A 12 31.167 -20.272 -1.930 1.00 1.00 H new ATOM 0 HB3 TYR A 12 30.057 -21.099 -3.004 1.00 1.00 H new ATOM 0 HD1 TYR A 12 29.841 -20.212 -5.438 1.00 1.00 H new ATOM 0 HD2 TYR A 12 33.066 -19.133 -2.788 1.00 1.00 H new ATOM 0 HE1 TYR A 12 31.204 -19.500 -7.393 1.00 1.00 H new ATOM 0 HE2 TYR A 12 34.436 -18.426 -4.737 1.00 1.00 H new ATOM 0 HH TYR A 12 34.540 -18.203 -6.944 1.00 1.00 H new ATOM 185 N GLY A 13 28.020 -18.555 -0.455 1.00 1.00 N ATOM 186 CA GLY A 13 27.024 -18.737 0.612 1.00 1.00 C ATOM 187 C GLY A 13 25.578 -18.728 0.092 1.00 1.00 C ATOM 188 O GLY A 13 25.336 -18.501 -1.095 1.00 1.00 O ATOM 0 H GLY A 13 28.273 -17.576 -0.591 1.00 1.00 H new ATOM 0 HA2 GLY A 13 27.215 -19.681 1.122 1.00 1.00 H new ATOM 0 HA3 GLY A 13 27.143 -17.945 1.352 1.00 1.00 H new ATOM 192 N ASN A 14 24.601 -18.944 0.982 1.00 1.00 N ATOM 193 CA ASN A 14 23.185 -19.131 0.614 1.00 1.00 C ATOM 194 C ASN A 14 22.274 -17.929 0.951 1.00 1.00 C ATOM 195 O ASN A 14 21.084 -18.083 1.228 1.00 1.00 O ATOM 196 CB ASN A 14 22.701 -20.487 1.168 1.00 1.00 C ATOM 197 CG ASN A 14 21.489 -21.050 0.435 1.00 1.00 C ATOM 198 OD1 ASN A 14 21.068 -20.577 -0.612 1.00 1.00 O ATOM 199 ND2 ASN A 14 20.912 -22.114 0.945 1.00 1.00 N ATOM 0 H ASN A 14 24.769 -18.995 1.987 1.00 1.00 H new ATOM 0 HA ASN A 14 23.110 -19.165 -0.473 1.00 1.00 H new ATOM 0 HB2 ASN A 14 23.518 -21.207 1.108 1.00 1.00 H new ATOM 0 HB3 ASN A 14 22.455 -20.371 2.224 1.00 1.00 H new ATOM 0 HD21 ASN A 14 20.118 -22.541 0.469 1.00 1.00 H new ATOM 0 HD22 ASN A 14 21.258 -22.513 1.817 1.00 1.00 H new ATOM 206 N SER A 15 22.805 -16.702 0.903 1.00 1.00 N ATOM 207 CA SER A 15 22.003 -15.473 1.048 1.00 1.00 C ATOM 208 C SER A 15 21.028 -15.258 -0.107 1.00 1.00 C ATOM 209 O SER A 15 20.032 -14.570 0.079 1.00 1.00 O ATOM 210 CB SER A 15 22.909 -14.250 1.168 1.00 1.00 C ATOM 211 OG SER A 15 23.950 -14.364 0.218 1.00 1.00 O ATOM 0 H SER A 15 23.800 -16.529 0.763 1.00 1.00 H new ATOM 0 HA SER A 15 21.418 -15.600 1.959 1.00 1.00 H new ATOM 0 HB2 SER A 15 22.338 -13.338 0.995 1.00 1.00 H new ATOM 0 HB3 SER A 15 23.321 -14.182 2.175 1.00 1.00 H new ATOM 0 HG SER A 15 24.522 -13.570 0.263 1.00 1.00 H new ATOM 217 N LEU A 16 21.248 -15.873 -1.273 1.00 1.00 N ATOM 218 CA LEU A 16 20.293 -15.843 -2.387 1.00 1.00 C ATOM 219 C LEU A 16 18.944 -16.465 -2.013 1.00 1.00 C ATOM 220 O LEU A 16 17.904 -15.891 -2.328 1.00 1.00 O ATOM 221 CB LEU A 16 20.930 -16.552 -3.595 1.00 1.00 C ATOM 222 CG LEU A 16 20.013 -16.642 -4.832 1.00 1.00 C ATOM 223 CD1 LEU A 16 19.571 -15.262 -5.324 1.00 1.00 C ATOM 224 CD2 LEU A 16 20.765 -17.343 -5.960 1.00 1.00 C ATOM 0 H LEU A 16 22.094 -16.407 -1.472 1.00 1.00 H new ATOM 0 HA LEU A 16 20.078 -14.805 -2.642 1.00 1.00 H new ATOM 0 HB2 LEU A 16 21.843 -16.025 -3.871 1.00 1.00 H new ATOM 0 HB3 LEU A 16 21.221 -17.560 -3.298 1.00 1.00 H new ATOM 0 HG LEU A 16 19.123 -17.201 -4.544 1.00 1.00 H new ATOM 0 HD11 LEU A 16 18.927 -15.376 -6.196 1.00 1.00 H new ATOM 0 HD12 LEU A 16 19.023 -14.752 -4.532 1.00 1.00 H new ATOM 0 HD13 LEU A 16 20.448 -14.674 -5.595 1.00 1.00 H new ATOM 0 HD21 LEU A 16 20.123 -17.410 -6.838 1.00 1.00 H new ATOM 0 HD22 LEU A 16 21.661 -16.774 -6.208 1.00 1.00 H new ATOM 0 HD23 LEU A 16 21.049 -18.346 -5.640 1.00 1.00 H new ATOM 236 N LEU A 17 18.948 -17.578 -1.276 1.00 1.00 N ATOM 237 CA LEU A 17 17.714 -18.149 -0.740 1.00 1.00 C ATOM 238 C LEU A 17 17.044 -17.175 0.221 1.00 1.00 C ATOM 239 O LEU A 17 15.866 -16.874 0.090 1.00 1.00 O ATOM 240 CB LEU A 17 18.031 -19.470 -0.028 1.00 1.00 C ATOM 241 CG LEU A 17 16.874 -20.030 0.819 1.00 1.00 C ATOM 242 CD1 LEU A 17 15.664 -20.412 -0.024 1.00 1.00 C ATOM 243 CD2 LEU A 17 17.395 -21.242 1.579 1.00 1.00 C ATOM 0 H LEU A 17 19.791 -18.100 -1.038 1.00 1.00 H new ATOM 0 HA LEU A 17 17.024 -18.339 -1.562 1.00 1.00 H new ATOM 0 HB2 LEU A 17 18.311 -20.213 -0.775 1.00 1.00 H new ATOM 0 HB3 LEU A 17 18.898 -19.323 0.616 1.00 1.00 H new ATOM 0 HG LEU A 17 16.534 -19.254 1.505 1.00 1.00 H new ATOM 0 HD11 LEU A 17 14.878 -20.801 0.623 1.00 1.00 H new ATOM 0 HD12 LEU A 17 15.297 -19.532 -0.553 1.00 1.00 H new ATOM 0 HD13 LEU A 17 15.951 -21.176 -0.746 1.00 1.00 H new ATOM 0 HD21 LEU A 17 16.595 -21.660 2.189 1.00 1.00 H new ATOM 0 HD22 LEU A 17 17.742 -21.994 0.871 1.00 1.00 H new ATOM 0 HD23 LEU A 17 18.222 -20.940 2.222 1.00 1.00 H new ATOM 255 N VAL A 18 17.801 -16.647 1.183 1.00 1.00 N ATOM 256 CA VAL A 18 17.248 -15.655 2.114 1.00 1.00 C ATOM 257 C VAL A 18 16.675 -14.453 1.355 1.00 1.00 C ATOM 258 O VAL A 18 15.614 -13.971 1.719 1.00 1.00 O ATOM 259 CB VAL A 18 18.275 -15.184 3.153 1.00 1.00 C ATOM 260 CG1 VAL A 18 17.668 -14.061 4.006 1.00 1.00 C ATOM 261 CG2 VAL A 18 18.699 -16.346 4.058 1.00 1.00 C ATOM 0 H VAL A 18 18.781 -16.882 1.339 1.00 1.00 H new ATOM 0 HA VAL A 18 16.444 -16.153 2.656 1.00 1.00 H new ATOM 0 HB VAL A 18 19.155 -14.811 2.629 1.00 1.00 H new ATOM 0 HG11 VAL A 18 18.399 -13.728 4.743 1.00 1.00 H new ATOM 0 HG12 VAL A 18 17.393 -13.224 3.364 1.00 1.00 H new ATOM 0 HG13 VAL A 18 16.780 -14.432 4.518 1.00 1.00 H new ATOM 0 HG21 VAL A 18 19.427 -15.992 4.788 1.00 1.00 H new ATOM 0 HG22 VAL A 18 17.826 -16.739 4.578 1.00 1.00 H new ATOM 0 HG23 VAL A 18 19.146 -17.134 3.452 1.00 1.00 H new ATOM 271 N ALA A 19 17.316 -13.984 0.282 1.00 1.00 N ATOM 272 CA ALA A 19 16.795 -12.897 -0.540 1.00 1.00 C ATOM 273 C ALA A 19 15.469 -13.250 -1.208 1.00 1.00 C ATOM 274 O ALA A 19 14.517 -12.475 -1.128 1.00 1.00 O ATOM 275 CB ALA A 19 17.809 -12.551 -1.626 1.00 1.00 C ATOM 0 H ALA A 19 18.212 -14.350 -0.039 1.00 1.00 H new ATOM 0 HA ALA A 19 16.622 -12.049 0.123 1.00 1.00 H new ATOM 0 HB1 ALA A 19 17.421 -11.739 -2.241 1.00 1.00 H new ATOM 0 HB2 ALA A 19 18.746 -12.240 -1.163 1.00 1.00 H new ATOM 0 HB3 ALA A 19 17.986 -13.426 -2.251 1.00 1.00 H new ATOM 281 N GLU A 20 15.409 -14.410 -1.859 1.00 1.00 N ATOM 282 CA GLU A 20 14.200 -14.853 -2.560 1.00 1.00 C ATOM 283 C GLU A 20 13.052 -15.171 -1.587 1.00 1.00 C ATOM 284 O GLU A 20 11.877 -14.997 -1.911 1.00 1.00 O ATOM 285 CB GLU A 20 14.523 -16.004 -3.532 1.00 1.00 C ATOM 286 CG GLU A 20 14.359 -17.427 -2.989 1.00 1.00 C ATOM 287 CD GLU A 20 14.698 -18.473 -4.070 1.00 1.00 C ATOM 288 OE1 GLU A 20 13.829 -18.760 -4.930 1.00 1.00 O1- ATOM 289 OE2 GLU A 20 15.827 -19.020 -4.072 1.00 1.00 O ATOM 0 H GLU A 20 16.188 -15.066 -1.917 1.00 1.00 H new ATOM 0 HA GLU A 20 13.835 -14.026 -3.169 1.00 1.00 H new ATOM 0 HB2 GLU A 20 13.885 -15.898 -4.409 1.00 1.00 H new ATOM 0 HB3 GLU A 20 15.552 -15.885 -3.871 1.00 1.00 H new ATOM 0 HG2 GLU A 20 15.009 -17.568 -2.125 1.00 1.00 H new ATOM 0 HG3 GLU A 20 13.335 -17.573 -2.645 1.00 1.00 H new ATOM 296 N GLU A 21 13.403 -15.548 -0.359 1.00 1.00 N ATOM 297 CA GLU A 21 12.469 -15.679 0.749 1.00 1.00 C ATOM 298 C GLU A 21 12.000 -14.309 1.194 1.00 1.00 C ATOM 299 O GLU A 21 10.806 -14.073 1.315 1.00 1.00 O ATOM 300 CB GLU A 21 13.067 -16.418 1.949 1.00 1.00 C ATOM 301 CG GLU A 21 13.160 -17.932 1.701 1.00 1.00 C ATOM 302 CD GLU A 21 11.789 -18.619 1.481 1.00 1.00 C ATOM 303 OE1 GLU A 21 10.726 -18.086 1.888 1.00 1.00 O ATOM 304 OE2 GLU A 21 11.764 -19.710 0.861 1.00 1.00 O1- ATOM 0 H GLU A 21 14.365 -15.775 -0.105 1.00 1.00 H new ATOM 0 HA GLU A 21 11.631 -16.272 0.383 1.00 1.00 H new ATOM 0 HB2 GLU A 21 14.061 -16.023 2.160 1.00 1.00 H new ATOM 0 HB3 GLU A 21 12.455 -16.232 2.832 1.00 1.00 H new ATOM 0 HG2 GLU A 21 13.788 -18.109 0.828 1.00 1.00 H new ATOM 0 HG3 GLU A 21 13.657 -18.399 2.551 1.00 1.00 H new ATOM 311 N ALA A 22 12.922 -13.376 1.402 1.00 1.00 N ATOM 312 CA ALA A 22 12.607 -12.057 1.898 1.00 1.00 C ATOM 313 C ALA A 22 11.676 -11.290 0.972 1.00 1.00 C ATOM 314 O ALA A 22 10.690 -10.716 1.421 1.00 1.00 O ATOM 315 CB ALA A 22 13.917 -11.296 2.114 1.00 1.00 C ATOM 0 H ALA A 22 13.916 -13.523 1.227 1.00 1.00 H new ATOM 0 HA ALA A 22 12.070 -12.160 2.841 1.00 1.00 H new ATOM 0 HB1 ALA A 22 13.699 -10.296 2.489 1.00 1.00 H new ATOM 0 HB2 ALA A 22 14.532 -11.829 2.839 1.00 1.00 H new ATOM 0 HB3 ALA A 22 14.454 -11.220 1.168 1.00 1.00 H new ATOM 321 N GLU A 23 11.952 -11.343 -0.322 1.00 1.00 N ATOM 322 CA GLU A 23 11.071 -10.862 -1.372 1.00 1.00 C ATOM 323 C GLU A 23 9.671 -11.454 -1.200 1.00 1.00 C ATOM 324 O GLU A 23 8.677 -10.735 -1.125 1.00 1.00 O ATOM 325 CB GLU A 23 11.685 -11.371 -2.687 1.00 1.00 C ATOM 326 CG GLU A 23 10.984 -10.891 -3.951 1.00 1.00 C ATOM 327 CD GLU A 23 11.319 -11.750 -5.186 1.00 1.00 C ATOM 328 OE1 GLU A 23 10.832 -12.902 -5.277 1.00 1.00 O1- ATOM 329 OE2 GLU A 23 12.057 -11.257 -6.076 1.00 1.00 O ATOM 0 H GLU A 23 12.823 -11.735 -0.680 1.00 1.00 H new ATOM 0 HA GLU A 23 10.977 -9.776 -1.352 1.00 1.00 H new ATOM 0 HB2 GLU A 23 12.729 -11.060 -2.728 1.00 1.00 H new ATOM 0 HB3 GLU A 23 11.677 -12.461 -2.677 1.00 1.00 H new ATOM 0 HG2 GLU A 23 9.906 -10.902 -3.789 1.00 1.00 H new ATOM 0 HG3 GLU A 23 11.267 -9.857 -4.147 1.00 1.00 H new ATOM 336 N ALA A 24 9.594 -12.774 -1.060 1.00 1.00 N ATOM 337 CA ALA A 24 8.341 -13.502 -0.978 1.00 1.00 C ATOM 338 C ALA A 24 7.589 -13.242 0.331 1.00 1.00 C ATOM 339 O ALA A 24 6.367 -13.109 0.308 1.00 1.00 O ATOM 340 CB ALA A 24 8.609 -14.993 -1.209 1.00 1.00 C ATOM 0 H ALA A 24 10.417 -13.374 -1.000 1.00 1.00 H new ATOM 0 HA ALA A 24 7.678 -13.137 -1.762 1.00 1.00 H new ATOM 0 HB1 ALA A 24 7.671 -15.545 -1.148 1.00 1.00 H new ATOM 0 HB2 ALA A 24 9.050 -15.135 -2.195 1.00 1.00 H new ATOM 0 HB3 ALA A 24 9.296 -15.361 -0.448 1.00 1.00 H new ATOM 346 N ILE A 25 8.282 -13.071 1.460 1.00 1.00 N ATOM 347 CA ILE A 25 7.675 -12.745 2.731 1.00 1.00 C ATOM 348 C ILE A 25 7.160 -11.326 2.690 1.00 1.00 C ATOM 349 O ILE A 25 6.031 -11.081 3.104 1.00 1.00 O ATOM 350 CB ILE A 25 8.671 -12.954 3.867 1.00 1.00 C ATOM 351 CG1 ILE A 25 8.824 -14.461 4.155 1.00 1.00 C ATOM 352 CG2 ILE A 25 8.156 -12.254 5.126 1.00 1.00 C ATOM 353 CD1 ILE A 25 10.265 -14.770 4.519 1.00 1.00 C ATOM 0 H ILE A 25 9.297 -13.159 1.506 1.00 1.00 H new ATOM 0 HA ILE A 25 6.832 -13.410 2.917 1.00 1.00 H new ATOM 0 HB ILE A 25 9.637 -12.539 3.580 1.00 1.00 H new ATOM 0 HG12 ILE A 25 8.162 -14.754 4.970 1.00 1.00 H new ATOM 0 HG13 ILE A 25 8.528 -15.040 3.280 1.00 1.00 H new ATOM 0 HG21 ILE A 25 8.866 -12.401 5.940 1.00 1.00 H new ATOM 0 HG22 ILE A 25 8.045 -11.188 4.930 1.00 1.00 H new ATOM 0 HG23 ILE A 25 7.190 -12.674 5.406 1.00 1.00 H new ATOM 0 HD11 ILE A 25 10.369 -15.836 4.722 1.00 1.00 H new ATOM 0 HD12 ILE A 25 10.917 -14.493 3.690 1.00 1.00 H new ATOM 0 HD13 ILE A 25 10.546 -14.203 5.407 1.00 1.00 H new ATOM 365 N LEU A 26 7.950 -10.379 2.178 1.00 1.00 N ATOM 366 CA LEU A 26 7.506 -9.004 2.150 1.00 1.00 C ATOM 367 C LEU A 26 6.301 -8.854 1.207 1.00 1.00 C ATOM 368 O LEU A 26 5.351 -8.129 1.490 1.00 1.00 O ATOM 369 CB LEU A 26 8.685 -8.087 1.792 1.00 1.00 C ATOM 370 CG LEU A 26 9.539 -7.603 2.989 1.00 1.00 C ATOM 371 CD1 LEU A 26 9.539 -6.088 3.122 1.00 1.00 C ATOM 372 CD2 LEU A 26 9.112 -8.089 4.373 1.00 1.00 C ATOM 0 H LEU A 26 8.878 -10.543 1.788 1.00 1.00 H new ATOM 0 HA LEU A 26 7.159 -8.698 3.137 1.00 1.00 H new ATOM 0 HB2 LEU A 26 9.335 -8.615 1.094 1.00 1.00 H new ATOM 0 HB3 LEU A 26 8.297 -7.214 1.268 1.00 1.00 H new ATOM 0 HG LEU A 26 10.509 -8.029 2.732 1.00 1.00 H new ATOM 0 HD11 LEU A 26 10.152 -5.798 3.976 1.00 1.00 H new ATOM 0 HD12 LEU A 26 9.947 -5.643 2.214 1.00 1.00 H new ATOM 0 HD13 LEU A 26 8.518 -5.736 3.271 1.00 1.00 H new ATOM 0 HD21 LEU A 26 9.787 -7.682 5.126 1.00 1.00 H new ATOM 0 HD22 LEU A 26 8.095 -7.754 4.579 1.00 1.00 H new ATOM 0 HD23 LEU A 26 9.148 -9.178 4.403 1.00 1.00 H new ATOM 384 N THR A 27 6.290 -9.631 0.128 1.00 1.00 N ATOM 385 CA THR A 27 5.159 -9.797 -0.766 1.00 1.00 C ATOM 386 C THR A 27 3.930 -10.393 -0.077 1.00 1.00 C ATOM 387 O THR A 27 2.830 -9.869 -0.227 1.00 1.00 O ATOM 388 CB THR A 27 5.623 -10.602 -1.965 1.00 1.00 C ATOM 389 OG1 THR A 27 6.592 -9.889 -2.706 1.00 1.00 O ATOM 390 CG2 THR A 27 4.483 -10.919 -2.896 1.00 1.00 C ATOM 0 H THR A 27 7.101 -10.181 -0.154 1.00 1.00 H new ATOM 0 HA THR A 27 4.817 -8.818 -1.101 1.00 1.00 H new ATOM 0 HB THR A 27 6.046 -11.526 -1.570 1.00 1.00 H new ATOM 0 HG1 THR A 27 7.476 -10.024 -2.304 1.00 1.00 H new ATOM 0 HG21 THR A 27 4.854 -11.496 -3.743 1.00 1.00 H new ATOM 0 HG22 THR A 27 3.729 -11.499 -2.364 1.00 1.00 H new ATOM 0 HG23 THR A 27 4.039 -9.991 -3.257 1.00 1.00 H new ATOM 398 N ALA A 28 4.113 -11.430 0.740 1.00 1.00 N ATOM 399 CA ALA A 28 3.054 -12.070 1.521 1.00 1.00 C ATOM 400 C ALA A 28 2.485 -11.155 2.627 1.00 1.00 C ATOM 401 O ALA A 28 1.289 -11.200 2.919 1.00 1.00 O ATOM 402 CB ALA A 28 3.602 -13.381 2.099 1.00 1.00 C ATOM 0 H ALA A 28 5.027 -11.860 0.881 1.00 1.00 H new ATOM 0 HA ALA A 28 2.212 -12.277 0.860 1.00 1.00 H new ATOM 0 HB1 ALA A 28 2.826 -13.873 2.685 1.00 1.00 H new ATOM 0 HB2 ALA A 28 3.912 -14.036 1.285 1.00 1.00 H new ATOM 0 HB3 ALA A 28 4.458 -13.167 2.738 1.00 1.00 H new ATOM 408 N GLN A 29 3.327 -10.288 3.201 1.00 1.00 N ATOM 409 CA GLN A 29 2.921 -9.217 4.116 1.00 1.00 C ATOM 410 C GLN A 29 2.073 -8.147 3.402 1.00 1.00 C ATOM 411 O GLN A 29 1.152 -7.589 4.002 1.00 1.00 O ATOM 412 CB GLN A 29 4.156 -8.584 4.781 1.00 1.00 C ATOM 413 CG GLN A 29 4.879 -9.501 5.784 1.00 1.00 C ATOM 414 CD GLN A 29 4.149 -9.694 7.115 1.00 1.00 C ATOM 415 OE1 GLN A 29 2.931 -9.691 7.224 1.00 1.00 O ATOM 416 NE2 GLN A 29 4.867 -9.896 8.195 1.00 1.00 N ATOM 0 H GLN A 29 4.334 -10.313 3.038 1.00 1.00 H new ATOM 0 HA GLN A 29 2.296 -9.661 4.891 1.00 1.00 H new ATOM 0 HB2 GLN A 29 4.861 -8.289 4.004 1.00 1.00 H new ATOM 0 HB3 GLN A 29 3.850 -7.673 5.296 1.00 1.00 H new ATOM 0 HG2 GLN A 29 5.027 -10.477 5.322 1.00 1.00 H new ATOM 0 HG3 GLN A 29 5.868 -9.089 5.984 1.00 1.00 H new ATOM 0 HE21 GLN A 29 5.885 -9.904 8.136 1.00 1.00 H new ATOM 0 HE22 GLN A 29 4.407 -10.045 9.093 1.00 1.00 H new ATOM 425 N GLY A 30 2.352 -7.906 2.116 1.00 1.00 N ATOM 426 CA GLY A 30 1.514 -7.091 1.222 1.00 1.00 C ATOM 427 C GLY A 30 2.250 -6.051 0.371 1.00 1.00 C ATOM 428 O GLY A 30 1.605 -5.165 -0.192 1.00 1.00 O ATOM 0 H GLY A 30 3.183 -8.278 1.656 1.00 1.00 H new ATOM 0 HA2 GLY A 30 0.973 -7.761 0.553 1.00 1.00 H new ATOM 0 HA3 GLY A 30 0.769 -6.574 1.827 1.00 1.00 H new ATOM 432 N HIS A 31 3.583 -6.125 0.290 1.00 1.00 N ATOM 433 CA HIS A 31 4.442 -5.104 -0.308 1.00 1.00 C ATOM 434 C HIS A 31 4.985 -5.535 -1.674 1.00 1.00 C ATOM 435 O HIS A 31 4.929 -6.708 -2.042 1.00 1.00 O ATOM 436 CB HIS A 31 5.578 -4.779 0.679 1.00 1.00 C ATOM 437 CG HIS A 31 5.106 -4.572 2.098 1.00 1.00 C ATOM 438 ND1 HIS A 31 4.321 -3.539 2.553 1.00 1.00 N ATOM 439 CD2 HIS A 31 5.282 -5.430 3.149 1.00 1.00 C ATOM 440 CE1 HIS A 31 4.040 -3.757 3.847 1.00 1.00 C ATOM 441 NE2 HIS A 31 4.604 -4.909 4.257 1.00 1.00 N ATOM 0 H HIS A 31 4.107 -6.922 0.651 1.00 1.00 H new ATOM 0 HA HIS A 31 3.852 -4.206 -0.493 1.00 1.00 H new ATOM 0 HB2 HIS A 31 6.306 -5.590 0.662 1.00 1.00 H new ATOM 0 HB3 HIS A 31 6.094 -3.880 0.342 1.00 1.00 H new ATOM 0 HD1 HIS A 31 4.006 -2.742 2.000 1.00 1.00 H new ATOM 0 HD2 HIS A 31 5.847 -6.350 3.127 1.00 1.00 H new ATOM 0 HE1 HIS A 31 3.447 -3.103 4.469 1.00 1.00 H new ATOM 449 N LYS A 32 5.580 -4.603 -2.420 1.00 1.00 N ATOM 450 CA LYS A 32 6.314 -4.863 -3.644 1.00 1.00 C ATOM 451 C LYS A 32 7.761 -5.094 -3.276 1.00 1.00 C ATOM 452 O LYS A 32 8.506 -4.139 -3.093 1.00 1.00 O ATOM 453 CB LYS A 32 6.097 -3.666 -4.592 1.00 1.00 C ATOM 454 CG LYS A 32 6.661 -3.840 -6.005 1.00 1.00 C ATOM 455 CD LYS A 32 8.202 -3.838 -6.140 1.00 1.00 C ATOM 456 CE LYS A 32 8.685 -3.625 -7.586 1.00 1.00 C ATOM 457 NZ LYS A 32 8.676 -4.884 -8.389 1.00 1.00 N1+ ATOM 0 H LYS A 32 5.559 -3.613 -2.174 1.00 1.00 H new ATOM 0 HA LYS A 32 5.969 -5.754 -4.169 1.00 1.00 H new ATOM 0 HB2 LYS A 32 5.027 -3.472 -4.667 1.00 1.00 H new ATOM 0 HB3 LYS A 32 6.550 -2.782 -4.144 1.00 1.00 H new ATOM 0 HG2 LYS A 32 6.285 -4.780 -6.409 1.00 1.00 H new ATOM 0 HG3 LYS A 32 6.263 -3.042 -6.632 1.00 1.00 H new ATOM 0 HD2 LYS A 32 8.614 -3.052 -5.507 1.00 1.00 H new ATOM 0 HD3 LYS A 32 8.594 -4.785 -5.769 1.00 1.00 H new ATOM 0 HE2 LYS A 32 8.049 -2.885 -8.072 1.00 1.00 H new ATOM 0 HE3 LYS A 32 9.695 -3.216 -7.571 1.00 1.00 H new ATOM 0 HZ1 LYS A 32 8.978 -4.677 -9.363 1.00 1.00 H new ATOM 0 HZ2 LYS A 32 9.329 -5.572 -7.963 1.00 1.00 H new ATOM 0 HZ3 LYS A 32 7.715 -5.281 -8.401 1.00 1.00 H new ATOM 471 N ALA A 33 8.160 -6.350 -3.157 1.00 1.00 N ATOM 472 CA ALA A 33 9.552 -6.702 -2.926 1.00 1.00 C ATOM 473 C ALA A 33 10.126 -7.454 -4.128 1.00 1.00 C ATOM 474 O ALA A 33 9.424 -8.233 -4.775 1.00 1.00 O ATOM 475 CB ALA A 33 9.656 -7.452 -1.604 1.00 1.00 C ATOM 0 H ALA A 33 7.531 -7.151 -3.217 1.00 1.00 H new ATOM 0 HA ALA A 33 10.170 -5.809 -2.833 1.00 1.00 H new ATOM 0 HB1 ALA A 33 10.696 -7.722 -1.419 1.00 1.00 H new ATOM 0 HB2 ALA A 33 9.297 -6.815 -0.795 1.00 1.00 H new ATOM 0 HB3 ALA A 33 9.049 -8.356 -1.650 1.00 1.00 H new ATOM 481 N THR A 34 11.405 -7.225 -4.422 1.00 1.00 N ATOM 482 CA THR A 34 12.101 -7.834 -5.563 1.00 1.00 C ATOM 483 C THR A 34 13.569 -8.076 -5.267 1.00 1.00 C ATOM 484 O THR A 34 14.230 -7.208 -4.714 1.00 1.00 O ATOM 485 CB THR A 34 11.987 -6.971 -6.818 1.00 1.00 C ATOM 486 OG1 THR A 34 10.635 -6.754 -7.189 1.00 1.00 O ATOM 487 CG2 THR A 34 12.660 -7.725 -7.952 1.00 1.00 C ATOM 0 H THR A 34 11.997 -6.604 -3.870 1.00 1.00 H new ATOM 0 HA THR A 34 11.611 -8.792 -5.739 1.00 1.00 H new ATOM 0 HB THR A 34 12.450 -6.004 -6.620 1.00 1.00 H new ATOM 0 HG1 THR A 34 10.482 -7.108 -8.090 1.00 1.00 H new ATOM 0 HG21 THR A 34 12.598 -7.137 -8.868 1.00 1.00 H new ATOM 0 HG22 THR A 34 13.707 -7.899 -7.703 1.00 1.00 H new ATOM 0 HG23 THR A 34 12.159 -8.682 -8.101 1.00 1.00 H new ATOM 495 N VAL A 35 14.094 -9.224 -5.689 1.00 1.00 N ATOM 496 CA VAL A 35 15.515 -9.549 -5.646 1.00 1.00 C ATOM 497 C VAL A 35 16.309 -9.083 -6.866 1.00 1.00 C ATOM 498 O VAL A 35 15.910 -9.298 -8.011 1.00 1.00 O ATOM 499 CB VAL A 35 15.732 -11.056 -5.428 1.00 1.00 C ATOM 500 CG1 VAL A 35 17.216 -11.423 -5.270 1.00 1.00 C ATOM 501 CG2 VAL A 35 14.996 -11.525 -4.179 1.00 1.00 C ATOM 0 H VAL A 35 13.525 -9.974 -6.081 1.00 1.00 H new ATOM 0 HA VAL A 35 15.904 -8.989 -4.796 1.00 1.00 H new ATOM 0 HB VAL A 35 15.343 -11.550 -6.318 1.00 1.00 H new ATOM 0 HG11 VAL A 35 17.311 -12.498 -5.119 1.00 1.00 H new ATOM 0 HG12 VAL A 35 17.760 -11.134 -6.169 1.00 1.00 H new ATOM 0 HG13 VAL A 35 17.631 -10.898 -4.410 1.00 1.00 H new ATOM 0 HG21 VAL A 35 15.160 -12.594 -4.040 1.00 1.00 H new ATOM 0 HG22 VAL A 35 15.372 -10.984 -3.311 1.00 1.00 H new ATOM 0 HG23 VAL A 35 13.929 -11.334 -4.292 1.00 1.00 H new ATOM 511 N PHE A 36 17.488 -8.526 -6.584 1.00 1.00 N ATOM 512 CA PHE A 36 18.533 -8.187 -7.547 1.00 1.00 C ATOM 513 C PHE A 36 19.760 -9.096 -7.352 1.00 1.00 C ATOM 514 O PHE A 36 20.418 -9.050 -6.312 1.00 1.00 O ATOM 515 CB PHE A 36 18.878 -6.695 -7.408 1.00 1.00 C ATOM 516 CG PHE A 36 17.731 -5.773 -7.776 1.00 1.00 C ATOM 517 CD1 PHE A 36 17.535 -5.410 -9.123 1.00 1.00 C ATOM 518 CD2 PHE A 36 16.843 -5.299 -6.788 1.00 1.00 C ATOM 519 CE1 PHE A 36 16.464 -4.573 -9.482 1.00 1.00 C ATOM 520 CE2 PHE A 36 15.769 -4.460 -7.150 1.00 1.00 C ATOM 521 CZ PHE A 36 15.582 -4.098 -8.498 1.00 1.00 C ATOM 0 H PHE A 36 17.752 -8.288 -5.628 1.00 1.00 H new ATOM 0 HA PHE A 36 18.178 -8.358 -8.563 1.00 1.00 H new ATOM 0 HB2 PHE A 36 19.180 -6.494 -6.380 1.00 1.00 H new ATOM 0 HB3 PHE A 36 19.735 -6.467 -8.042 1.00 1.00 H new ATOM 0 HD1 PHE A 36 18.210 -5.776 -9.883 1.00 1.00 H new ATOM 0 HD2 PHE A 36 16.986 -5.579 -5.755 1.00 1.00 H new ATOM 0 HE1 PHE A 36 16.319 -4.295 -10.516 1.00 1.00 H new ATOM 0 HE2 PHE A 36 15.090 -4.095 -6.394 1.00 1.00 H new ATOM 0 HZ PHE A 36 14.760 -3.455 -8.775 1.00 1.00 H new ATOM 531 N GLU A 37 20.057 -9.934 -8.353 1.00 1.00 N ATOM 532 CA GLU A 37 21.204 -10.844 -8.412 1.00 1.00 C ATOM 533 C GLU A 37 22.379 -10.186 -9.152 1.00 1.00 C ATOM 534 O GLU A 37 22.168 -9.520 -10.166 1.00 1.00 O ATOM 535 CB GLU A 37 20.814 -12.165 -9.100 1.00 1.00 C ATOM 536 CG GLU A 37 19.778 -12.967 -8.303 1.00 1.00 C ATOM 537 CD GLU A 37 19.407 -14.267 -9.045 1.00 1.00 C ATOM 538 OE1 GLU A 37 20.261 -15.178 -9.163 1.00 1.00 O ATOM 539 OE2 GLU A 37 18.252 -14.386 -9.523 1.00 1.00 O1- ATOM 0 H GLU A 37 19.472 -9.998 -9.186 1.00 1.00 H new ATOM 0 HA GLU A 37 21.516 -11.064 -7.391 1.00 1.00 H new ATOM 0 HB2 GLU A 37 20.415 -11.949 -10.091 1.00 1.00 H new ATOM 0 HB3 GLU A 37 21.707 -12.773 -9.241 1.00 1.00 H new ATOM 0 HG2 GLU A 37 20.176 -13.206 -7.317 1.00 1.00 H new ATOM 0 HG3 GLU A 37 18.884 -12.363 -8.148 1.00 1.00 H new ATOM 546 N ASP A 38 23.608 -10.381 -8.647 1.00 1.00 N ATOM 547 CA ASP A 38 24.817 -9.649 -9.089 1.00 1.00 C ATOM 548 C ASP A 38 24.508 -8.134 -9.265 1.00 1.00 C ATOM 549 O ASP A 38 24.689 -7.570 -10.353 1.00 1.00 O ATOM 550 CB ASP A 38 25.410 -10.335 -10.334 1.00 1.00 C ATOM 551 CG ASP A 38 26.759 -9.731 -10.768 1.00 1.00 C ATOM 552 OD1 ASP A 38 27.607 -9.432 -9.891 1.00 1.00 O ATOM 553 OD2 ASP A 38 27.003 -9.606 -11.993 1.00 1.00 O1- ATOM 0 H ASP A 38 23.798 -11.060 -7.910 1.00 1.00 H new ATOM 0 HA ASP A 38 25.592 -9.691 -8.323 1.00 1.00 H new ATOM 0 HB2 ASP A 38 25.543 -11.397 -10.128 1.00 1.00 H new ATOM 0 HB3 ASP A 38 24.701 -10.256 -11.158 1.00 1.00 H new ATOM 558 N PRO A 39 23.975 -7.474 -8.212 1.00 1.00 N ATOM 559 CA PRO A 39 23.400 -6.135 -8.298 1.00 1.00 C ATOM 560 C PRO A 39 24.346 -4.987 -8.670 1.00 1.00 C ATOM 561 O PRO A 39 25.461 -4.853 -8.158 1.00 1.00 O ATOM 562 CB PRO A 39 22.790 -5.867 -6.929 1.00 1.00 C ATOM 563 CG PRO A 39 23.644 -6.704 -5.978 1.00 1.00 C ATOM 564 CD PRO A 39 23.925 -7.941 -6.829 1.00 1.00 C ATOM 0 HA PRO A 39 22.693 -6.144 -9.127 1.00 1.00 H new ATOM 0 HB2 PRO A 39 22.829 -4.808 -6.674 1.00 1.00 H new ATOM 0 HB3 PRO A 39 21.742 -6.165 -6.893 1.00 1.00 H new ATOM 0 HG2 PRO A 39 24.560 -6.189 -5.688 1.00 1.00 H new ATOM 0 HG3 PRO A 39 23.113 -6.951 -5.059 1.00 1.00 H new ATOM 0 HD2 PRO A 39 24.867 -8.408 -6.540 1.00 1.00 H new ATOM 0 HD3 PRO A 39 23.144 -8.690 -6.698 1.00 1.00 H new ATOM 572 N GLU A 40 23.823 -4.085 -9.501 1.00 1.00 N ATOM 573 CA GLU A 40 24.409 -2.790 -9.832 1.00 1.00 C ATOM 574 C GLU A 40 23.954 -1.692 -8.871 1.00 1.00 C ATOM 575 O GLU A 40 22.834 -1.688 -8.362 1.00 1.00 O ATOM 576 CB GLU A 40 23.948 -2.366 -11.237 1.00 1.00 C ATOM 577 CG GLU A 40 24.853 -2.953 -12.301 1.00 1.00 C ATOM 578 CD GLU A 40 24.280 -2.758 -13.719 1.00 1.00 C ATOM 579 OE1 GLU A 40 24.330 -1.622 -14.251 1.00 1.00 O1- ATOM 580 OE2 GLU A 40 23.791 -3.743 -14.327 1.00 1.00 O ATOM 0 H GLU A 40 22.939 -4.247 -9.983 1.00 1.00 H new ATOM 0 HA GLU A 40 25.491 -2.906 -9.769 1.00 1.00 H new ATOM 0 HB2 GLU A 40 22.923 -2.696 -11.403 1.00 1.00 H new ATOM 0 HB3 GLU A 40 23.949 -1.279 -11.312 1.00 1.00 H new ATOM 0 HG2 GLU A 40 25.836 -2.485 -12.240 1.00 1.00 H new ATOM 0 HG3 GLU A 40 24.994 -4.017 -12.110 1.00 1.00 H new ATOM 587 N LEU A 41 24.772 -0.651 -8.722 1.00 1.00 N ATOM 588 CA LEU A 41 24.367 0.562 -8.050 1.00 1.00 C ATOM 589 C LEU A 41 23.328 1.307 -8.908 1.00 1.00 C ATOM 590 O LEU A 41 22.479 2.008 -8.363 1.00 1.00 O ATOM 591 CB LEU A 41 25.667 1.306 -7.725 1.00 1.00 C ATOM 592 CG LEU A 41 25.526 2.587 -6.909 1.00 1.00 C ATOM 593 CD1 LEU A 41 25.306 3.774 -7.840 1.00 1.00 C ATOM 594 CD2 LEU A 41 24.507 2.468 -5.781 1.00 1.00 C ATOM 0 H LEU A 41 25.732 -0.634 -9.067 1.00 1.00 H new ATOM 0 HA LEU A 41 23.840 0.411 -7.108 1.00 1.00 H new ATOM 0 HB2 LEU A 41 26.324 0.626 -7.183 1.00 1.00 H new ATOM 0 HB3 LEU A 41 26.165 1.551 -8.663 1.00 1.00 H new ATOM 0 HG LEU A 41 26.462 2.768 -6.381 1.00 1.00 H new ATOM 0 HD11 LEU A 41 25.206 4.685 -7.250 1.00 1.00 H new ATOM 0 HD12 LEU A 41 26.157 3.870 -8.515 1.00 1.00 H new ATOM 0 HD13 LEU A 41 24.398 3.617 -8.422 1.00 1.00 H new ATOM 0 HD21 LEU A 41 24.453 3.412 -5.238 1.00 1.00 H new ATOM 0 HD22 LEU A 41 23.528 2.233 -6.198 1.00 1.00 H new ATOM 0 HD23 LEU A 41 24.810 1.674 -5.099 1.00 1.00 H new ATOM 606 N SER A 42 23.277 1.047 -10.221 1.00 1.00 N ATOM 607 CA SER A 42 22.195 1.531 -11.081 1.00 1.00 C ATOM 608 C SER A 42 20.844 0.885 -10.743 1.00 1.00 C ATOM 609 O SER A 42 19.800 1.474 -11.027 1.00 1.00 O ATOM 610 CB SER A 42 22.526 1.318 -12.562 1.00 1.00 C ATOM 611 OG SER A 42 23.767 1.934 -12.880 1.00 1.00 O ATOM 0 H SER A 42 23.982 0.498 -10.713 1.00 1.00 H new ATOM 0 HA SER A 42 22.105 2.600 -10.890 1.00 1.00 H new ATOM 0 HB2 SER A 42 22.574 0.251 -12.782 1.00 1.00 H new ATOM 0 HB3 SER A 42 21.734 1.736 -13.183 1.00 1.00 H new ATOM 0 HG SER A 42 23.970 1.791 -13.828 1.00 1.00 H new ATOM 617 N ASP A 43 20.850 -0.285 -10.095 1.00 1.00 N ATOM 618 CA ASP A 43 19.658 -0.901 -9.521 1.00 1.00 C ATOM 619 C ASP A 43 19.309 -0.334 -8.135 1.00 1.00 C ATOM 620 O ASP A 43 18.127 -0.279 -7.799 1.00 1.00 O ATOM 621 CB ASP A 43 19.805 -2.430 -9.467 1.00 1.00 C ATOM 622 CG ASP A 43 19.771 -3.104 -10.850 1.00 1.00 C ATOM 623 OD1 ASP A 43 18.935 -2.723 -11.708 1.00 1.00 O1- ATOM 624 OD2 ASP A 43 20.567 -4.050 -11.072 1.00 1.00 O ATOM 0 H ASP A 43 21.697 -0.835 -9.955 1.00 1.00 H new ATOM 0 HA ASP A 43 18.826 -0.653 -10.180 1.00 1.00 H new ATOM 0 HB2 ASP A 43 20.745 -2.679 -8.975 1.00 1.00 H new ATOM 0 HB3 ASP A 43 19.005 -2.842 -8.852 1.00 1.00 H new ATOM 629 N TRP A 44 20.289 0.146 -7.348 1.00 1.00 N ATOM 630 CA TRP A 44 20.029 0.741 -6.029 1.00 1.00 C ATOM 631 C TRP A 44 19.548 2.197 -6.098 1.00 1.00 C ATOM 632 O TRP A 44 18.659 2.584 -5.340 1.00 1.00 O ATOM 633 CB TRP A 44 21.297 0.623 -5.186 1.00 1.00 C ATOM 634 CG TRP A 44 21.219 1.159 -3.792 1.00 1.00 C ATOM 635 CD1 TRP A 44 21.160 2.464 -3.425 1.00 1.00 C ATOM 636 CD2 TRP A 44 21.182 0.388 -2.558 1.00 1.00 C ATOM 637 NE1 TRP A 44 21.108 2.541 -2.043 1.00 1.00 N ATOM 638 CE2 TRP A 44 21.123 1.291 -1.461 1.00 1.00 C ATOM 639 CE3 TRP A 44 21.188 -0.991 -2.261 1.00 1.00 C ATOM 640 CZ2 TRP A 44 21.109 0.853 -0.133 1.00 1.00 C ATOM 641 CZ3 TRP A 44 21.173 -1.448 -0.931 1.00 1.00 C ATOM 642 CH2 TRP A 44 21.144 -0.529 0.132 1.00 1.00 C ATOM 0 H TRP A 44 21.275 0.132 -7.608 1.00 1.00 H new ATOM 0 HA TRP A 44 19.209 0.190 -5.568 1.00 1.00 H new ATOM 0 HB2 TRP A 44 21.575 -0.429 -5.133 1.00 1.00 H new ATOM 0 HB3 TRP A 44 22.103 1.140 -5.707 1.00 1.00 H new ATOM 0 HD1 TRP A 44 21.154 3.306 -4.101 1.00 1.00 H new ATOM 0 HE1 TRP A 44 21.064 3.415 -1.520 1.00 1.00 H new ATOM 0 HE3 TRP A 44 21.204 -1.708 -3.069 1.00 1.00 H new ATOM 0 HZ2 TRP A 44 21.072 1.565 0.678 1.00 1.00 H new ATOM 0 HZ3 TRP A 44 21.184 -2.508 -0.726 1.00 1.00 H new ATOM 0 HH2 TRP A 44 21.149 -0.883 1.152 1.00 1.00 H new ATOM 653 N LEU A 45 20.100 3.009 -7.012 1.00 1.00 N ATOM 654 CA LEU A 45 19.719 4.419 -7.203 1.00 1.00 C ATOM 655 C LEU A 45 18.193 4.676 -7.194 1.00 1.00 C ATOM 656 O LEU A 45 17.772 5.573 -6.460 1.00 1.00 O ATOM 657 CB LEU A 45 20.313 4.941 -8.534 1.00 1.00 C ATOM 658 CG LEU A 45 21.783 5.383 -8.481 1.00 1.00 C ATOM 659 CD1 LEU A 45 22.313 5.629 -9.891 1.00 1.00 C ATOM 660 CD2 LEU A 45 21.943 6.688 -7.703 1.00 1.00 C ATOM 0 H LEU A 45 20.835 2.701 -7.649 1.00 1.00 H new ATOM 0 HA LEU A 45 20.126 4.956 -6.346 1.00 1.00 H new ATOM 0 HB2 LEU A 45 20.215 4.158 -9.286 1.00 1.00 H new ATOM 0 HB3 LEU A 45 19.711 5.784 -8.873 1.00 1.00 H new ATOM 0 HG LEU A 45 22.337 4.584 -7.988 1.00 1.00 H new ATOM 0 HD11 LEU A 45 23.356 5.942 -9.838 1.00 1.00 H new ATOM 0 HD12 LEU A 45 22.239 4.710 -10.473 1.00 1.00 H new ATOM 0 HD13 LEU A 45 21.724 6.411 -10.370 1.00 1.00 H new ATOM 0 HD21 LEU A 45 22.995 6.974 -7.684 1.00 1.00 H new ATOM 0 HD22 LEU A 45 21.362 7.474 -8.187 1.00 1.00 H new ATOM 0 HD23 LEU A 45 21.586 6.549 -6.682 1.00 1.00 H new ATOM 672 N PRO A 46 17.345 3.911 -7.914 1.00 1.00 N ATOM 673 CA PRO A 46 15.891 4.128 -7.925 1.00 1.00 C ATOM 674 C PRO A 46 15.152 3.801 -6.608 1.00 1.00 C ATOM 675 O PRO A 46 13.923 3.902 -6.577 1.00 1.00 O ATOM 676 CB PRO A 46 15.363 3.323 -9.123 1.00 1.00 C ATOM 677 CG PRO A 46 16.391 2.209 -9.283 1.00 1.00 C ATOM 678 CD PRO A 46 17.698 2.909 -8.919 1.00 1.00 C ATOM 0 HA PRO A 46 15.689 5.195 -8.022 1.00 1.00 H new ATOM 0 HB2 PRO A 46 14.366 2.925 -8.932 1.00 1.00 H new ATOM 0 HB3 PRO A 46 15.294 3.938 -10.021 1.00 1.00 H new ATOM 0 HG2 PRO A 46 16.184 1.368 -8.622 1.00 1.00 H new ATOM 0 HG3 PRO A 46 16.410 1.818 -10.300 1.00 1.00 H new ATOM 0 HD2 PRO A 46 18.426 2.199 -8.525 1.00 1.00 H new ATOM 0 HD3 PRO A 46 18.149 3.375 -9.795 1.00 1.00 H new ATOM 686 N TYR A 47 15.857 3.446 -5.521 1.00 1.00 N ATOM 687 CA TYR A 47 15.306 3.212 -4.182 1.00 1.00 C ATOM 688 C TYR A 47 15.723 4.214 -3.097 1.00 1.00 C ATOM 689 O TYR A 47 15.295 4.091 -1.953 1.00 1.00 O ATOM 690 CB TYR A 47 15.537 1.752 -3.755 1.00 1.00 C ATOM 691 CG TYR A 47 14.797 0.717 -4.584 1.00 1.00 C ATOM 692 CD1 TYR A 47 15.359 0.244 -5.784 1.00 1.00 C ATOM 693 CD2 TYR A 47 13.544 0.230 -4.163 1.00 1.00 C ATOM 694 CE1 TYR A 47 14.663 -0.688 -6.576 1.00 1.00 C ATOM 695 CE2 TYR A 47 12.838 -0.701 -4.954 1.00 1.00 C ATOM 696 CZ TYR A 47 13.392 -1.155 -6.167 1.00 1.00 C ATOM 697 OH TYR A 47 12.685 -2.035 -6.931 1.00 1.00 O ATOM 0 H TYR A 47 16.867 3.309 -5.556 1.00 1.00 H new ATOM 0 HA TYR A 47 14.236 3.395 -4.278 1.00 1.00 H new ATOM 0 HB2 TYR A 47 16.605 1.539 -3.804 1.00 1.00 H new ATOM 0 HB3 TYR A 47 15.238 1.642 -2.713 1.00 1.00 H new ATOM 0 HD1 TYR A 47 16.330 0.598 -6.099 1.00 1.00 H new ATOM 0 HD2 TYR A 47 13.121 0.571 -3.230 1.00 1.00 H new ATOM 0 HE1 TYR A 47 15.099 -1.047 -7.496 1.00 1.00 H new ATOM 0 HE2 TYR A 47 11.874 -1.065 -4.630 1.00 1.00 H new ATOM 0 HH TYR A 47 11.835 -2.243 -6.489 1.00 1.00 H new ATOM 707 N GLN A 48 16.447 5.267 -3.476 1.00 1.00 N ATOM 708 CA GLN A 48 16.790 6.454 -2.653 1.00 1.00 C ATOM 709 C GLN A 48 15.568 7.079 -1.944 1.00 1.00 C ATOM 710 O GLN A 48 15.689 7.663 -0.870 1.00 1.00 O ATOM 711 CB GLN A 48 17.381 7.535 -3.571 1.00 1.00 C ATOM 712 CG GLN A 48 18.858 7.288 -3.893 1.00 1.00 C ATOM 713 CD GLN A 48 19.358 8.306 -4.913 1.00 1.00 C ATOM 714 OE1 GLN A 48 20.043 9.269 -4.600 1.00 1.00 O ATOM 715 NE2 GLN A 48 19.001 8.134 -6.169 1.00 1.00 N ATOM 0 H GLN A 48 16.837 5.330 -4.416 1.00 1.00 H new ATOM 0 HA GLN A 48 17.491 6.114 -1.891 1.00 1.00 H new ATOM 0 HB2 GLN A 48 16.811 7.570 -4.499 1.00 1.00 H new ATOM 0 HB3 GLN A 48 17.274 8.510 -3.095 1.00 1.00 H new ATOM 0 HG2 GLN A 48 19.452 7.356 -2.981 1.00 1.00 H new ATOM 0 HG3 GLN A 48 18.988 6.279 -4.284 1.00 1.00 H new ATOM 0 HE21 GLN A 48 18.430 7.331 -6.431 1.00 1.00 H new ATOM 0 HE22 GLN A 48 19.296 8.804 -6.879 1.00 1.00 H new ATOM 724 N ASP A 49 14.399 6.965 -2.572 1.00 1.00 N ATOM 725 CA ASP A 49 13.093 7.501 -2.166 1.00 1.00 C ATOM 726 C ASP A 49 12.141 6.425 -1.598 1.00 1.00 C ATOM 727 O ASP A 49 10.956 6.685 -1.374 1.00 1.00 O ATOM 728 CB ASP A 49 12.475 8.196 -3.398 1.00 1.00 C ATOM 729 CG ASP A 49 12.237 7.220 -4.574 1.00 1.00 C ATOM 730 OD1 ASP A 49 13.225 6.652 -5.094 1.00 1.00 O1- ATOM 731 OD2 ASP A 49 11.072 6.987 -4.977 1.00 1.00 O ATOM 0 H ASP A 49 14.331 6.453 -3.452 1.00 1.00 H new ATOM 0 HA ASP A 49 13.240 8.207 -1.349 1.00 1.00 H new ATOM 0 HB2 ASP A 49 11.528 8.655 -3.115 1.00 1.00 H new ATOM 0 HB3 ASP A 49 13.134 9.000 -3.726 1.00 1.00 H new ATOM 736 N LYS A 50 12.656 5.205 -1.394 1.00 1.00 N ATOM 737 CA LYS A 50 11.931 3.972 -1.080 1.00 1.00 C ATOM 738 C LYS A 50 12.579 3.200 0.078 1.00 1.00 C ATOM 739 O LYS A 50 13.288 3.781 0.903 1.00 1.00 O ATOM 740 CB LYS A 50 11.927 3.127 -2.367 1.00 1.00 C ATOM 741 CG LYS A 50 11.240 3.789 -3.558 1.00 1.00 C ATOM 742 CD LYS A 50 11.294 2.812 -4.729 1.00 1.00 C ATOM 743 CE LYS A 50 10.507 3.316 -5.940 1.00 1.00 C ATOM 744 NZ LYS A 50 11.117 4.558 -6.504 1.00 1.00 N1+ ATOM 0 H LYS A 50 13.662 5.045 -1.449 1.00 1.00 H new ATOM 0 HA LYS A 50 10.918 4.204 -0.752 1.00 1.00 H new ATOM 0 HB2 LYS A 50 12.957 2.898 -2.639 1.00 1.00 H new ATOM 0 HB3 LYS A 50 11.433 2.177 -2.161 1.00 1.00 H new ATOM 0 HG2 LYS A 50 10.207 4.036 -3.314 1.00 1.00 H new ATOM 0 HG3 LYS A 50 11.739 4.723 -3.816 1.00 1.00 H new ATOM 0 HD2 LYS A 50 12.333 2.648 -5.016 1.00 1.00 H new ATOM 0 HD3 LYS A 50 10.895 1.848 -4.414 1.00 1.00 H new ATOM 0 HE2 LYS A 50 10.479 2.541 -6.706 1.00 1.00 H new ATOM 0 HE3 LYS A 50 9.475 3.514 -5.649 1.00 1.00 H new ATOM 0 HZ1 LYS A 50 10.682 4.772 -7.424 1.00 1.00 H new ATOM 0 HZ2 LYS A 50 10.955 5.352 -5.852 1.00 1.00 H new ATOM 0 HZ3 LYS A 50 12.140 4.416 -6.629 1.00 1.00 H new ATOM 758 N TYR A 51 12.340 1.882 0.113 1.00 1.00 N ATOM 759 CA TYR A 51 13.029 0.950 1.000 1.00 1.00 C ATOM 760 C TYR A 51 13.891 -0.041 0.222 1.00 1.00 C ATOM 761 O TYR A 51 13.723 -0.298 -0.970 1.00 1.00 O ATOM 762 CB TYR A 51 12.060 0.222 1.953 1.00 1.00 C ATOM 763 CG TYR A 51 10.965 1.106 2.497 1.00 1.00 C ATOM 764 CD1 TYR A 51 11.298 2.147 3.371 1.00 1.00 C ATOM 765 CD2 TYR A 51 9.636 0.924 2.085 1.00 1.00 C ATOM 766 CE1 TYR A 51 10.316 3.051 3.810 1.00 1.00 C ATOM 767 CE2 TYR A 51 8.636 1.793 2.558 1.00 1.00 C ATOM 768 CZ TYR A 51 8.973 2.868 3.409 1.00 1.00 C ATOM 769 OH TYR A 51 8.004 3.730 3.826 1.00 1.00 O ATOM 0 H TYR A 51 11.649 1.431 -0.487 1.00 1.00 H new ATOM 0 HA TYR A 51 13.695 1.550 1.620 1.00 1.00 H new ATOM 0 HB2 TYR A 51 11.608 -0.618 1.425 1.00 1.00 H new ATOM 0 HB3 TYR A 51 12.627 -0.193 2.786 1.00 1.00 H new ATOM 0 HD1 TYR A 51 12.317 2.256 3.711 1.00 1.00 H new ATOM 0 HD2 TYR A 51 9.382 0.121 1.409 1.00 1.00 H new ATOM 0 HE1 TYR A 51 10.585 3.879 4.449 1.00 1.00 H new ATOM 0 HE2 TYR A 51 7.607 1.637 2.269 1.00 1.00 H new ATOM 0 HH TYR A 51 7.200 3.608 3.279 1.00 1.00 H new ATOM 779 N VAL A 52 14.831 -0.622 0.946 1.00 1.00 N ATOM 780 CA VAL A 52 15.861 -1.515 0.429 1.00 1.00 C ATOM 781 C VAL A 52 16.149 -2.545 1.501 1.00 1.00 C ATOM 782 O VAL A 52 15.996 -2.268 2.690 1.00 1.00 O ATOM 783 CB VAL A 52 17.146 -0.752 0.019 1.00 1.00 C ATOM 784 CG1 VAL A 52 17.395 -0.892 -1.483 1.00 1.00 C ATOM 785 CG2 VAL A 52 17.136 0.750 0.332 1.00 1.00 C ATOM 0 H VAL A 52 14.903 -0.480 1.954 1.00 1.00 H new ATOM 0 HA VAL A 52 15.504 -1.999 -0.480 1.00 1.00 H new ATOM 0 HB VAL A 52 17.931 -1.213 0.618 1.00 1.00 H new ATOM 0 HG11 VAL A 52 18.301 -0.350 -1.754 1.00 1.00 H new ATOM 0 HG12 VAL A 52 17.513 -1.946 -1.736 1.00 1.00 H new ATOM 0 HG13 VAL A 52 16.548 -0.480 -2.032 1.00 1.00 H new ATOM 0 HG21 VAL A 52 18.077 1.195 0.009 1.00 1.00 H new ATOM 0 HG22 VAL A 52 16.309 1.226 -0.195 1.00 1.00 H new ATOM 0 HG23 VAL A 52 17.015 0.897 1.405 1.00 1.00 H new ATOM 795 N LEU A 53 16.555 -3.733 1.088 1.00 1.00 N ATOM 796 CA LEU A 53 16.957 -4.820 1.962 1.00 1.00 C ATOM 797 C LEU A 53 18.309 -5.347 1.495 1.00 1.00 C ATOM 798 O LEU A 53 18.478 -5.721 0.340 1.00 1.00 O ATOM 799 CB LEU A 53 15.864 -5.889 1.942 1.00 1.00 C ATOM 800 CG LEU A 53 16.146 -7.155 2.748 1.00 1.00 C ATOM 801 CD1 LEU A 53 16.652 -6.868 4.161 1.00 1.00 C ATOM 802 CD2 LEU A 53 14.904 -8.021 2.924 1.00 1.00 C ATOM 0 H LEU A 53 16.616 -3.975 0.099 1.00 1.00 H new ATOM 0 HA LEU A 53 17.074 -4.489 2.994 1.00 1.00 H new ATOM 0 HB2 LEU A 53 14.942 -5.443 2.315 1.00 1.00 H new ATOM 0 HB3 LEU A 53 15.683 -6.175 0.906 1.00 1.00 H new ATOM 0 HG LEU A 53 16.909 -7.668 2.163 1.00 1.00 H new ATOM 0 HD11 LEU A 53 16.833 -7.809 4.681 1.00 1.00 H new ATOM 0 HD12 LEU A 53 17.580 -6.299 4.107 1.00 1.00 H new ATOM 0 HD13 LEU A 53 15.904 -6.291 4.705 1.00 1.00 H new ATOM 0 HD21 LEU A 53 15.158 -8.908 3.504 1.00 1.00 H new ATOM 0 HD22 LEU A 53 14.136 -7.453 3.448 1.00 1.00 H new ATOM 0 HD23 LEU A 53 14.529 -8.322 1.946 1.00 1.00 H new ATOM 814 N VAL A 54 19.265 -5.421 2.406 1.00 1.00 N ATOM 815 CA VAL A 54 20.571 -6.015 2.138 1.00 1.00 C ATOM 816 C VAL A 54 20.587 -7.423 2.688 1.00 1.00 C ATOM 817 O VAL A 54 20.285 -7.630 3.858 1.00 1.00 O ATOM 818 CB VAL A 54 21.702 -5.136 2.660 1.00 1.00 C ATOM 819 CG1 VAL A 54 23.047 -5.854 2.695 1.00 1.00 C ATOM 820 CG2 VAL A 54 21.815 -3.867 1.816 1.00 1.00 C ATOM 0 H VAL A 54 19.160 -5.070 3.358 1.00 1.00 H new ATOM 0 HA VAL A 54 20.743 -6.078 1.063 1.00 1.00 H new ATOM 0 HB VAL A 54 21.449 -4.880 3.689 1.00 1.00 H new ATOM 0 HG11 VAL A 54 23.811 -5.176 3.075 1.00 1.00 H new ATOM 0 HG12 VAL A 54 22.978 -6.725 3.346 1.00 1.00 H new ATOM 0 HG13 VAL A 54 23.315 -6.174 1.688 1.00 1.00 H new ATOM 0 HG21 VAL A 54 22.626 -3.247 2.198 1.00 1.00 H new ATOM 0 HG22 VAL A 54 22.021 -4.136 0.780 1.00 1.00 H new ATOM 0 HG23 VAL A 54 20.879 -3.311 1.867 1.00 1.00 H new ATOM 830 N VAL A 55 20.956 -8.399 1.868 1.00 1.00 N ATOM 831 CA VAL A 55 21.094 -9.783 2.326 1.00 1.00 C ATOM 832 C VAL A 55 22.484 -10.236 1.918 1.00 1.00 C ATOM 833 O VAL A 55 22.745 -10.502 0.753 1.00 1.00 O ATOM 834 CB VAL A 55 19.956 -10.660 1.789 1.00 1.00 C ATOM 835 CG1 VAL A 55 20.006 -11.994 2.529 1.00 1.00 C ATOM 836 CG2 VAL A 55 18.564 -10.032 2.017 1.00 1.00 C ATOM 0 H VAL A 55 21.166 -8.261 0.880 1.00 1.00 H new ATOM 0 HA VAL A 55 21.002 -9.870 3.409 1.00 1.00 H new ATOM 0 HB VAL A 55 20.095 -10.774 0.714 1.00 1.00 H new ATOM 0 HG11 VAL A 55 19.206 -12.641 2.168 1.00 1.00 H new ATOM 0 HG12 VAL A 55 20.969 -12.473 2.351 1.00 1.00 H new ATOM 0 HG13 VAL A 55 19.879 -11.822 3.598 1.00 1.00 H new ATOM 0 HG21 VAL A 55 17.796 -10.695 1.618 1.00 1.00 H new ATOM 0 HG22 VAL A 55 18.400 -9.889 3.085 1.00 1.00 H new ATOM 0 HG23 VAL A 55 18.512 -9.069 1.509 1.00 1.00 H new ATOM 846 N THR A 56 23.396 -10.300 2.877 1.00 1.00 N ATOM 847 CA THR A 56 24.838 -10.465 2.602 1.00 1.00 C ATOM 848 C THR A 56 25.522 -11.469 3.524 1.00 1.00 C ATOM 849 O THR A 56 25.378 -11.400 4.742 1.00 1.00 O ATOM 850 CB THR A 56 25.522 -9.092 2.558 1.00 1.00 C ATOM 851 OG1 THR A 56 26.877 -9.260 2.231 1.00 1.00 O ATOM 852 CG2 THR A 56 25.413 -8.280 3.846 1.00 1.00 C ATOM 0 H THR A 56 23.170 -10.240 3.870 1.00 1.00 H new ATOM 0 HA THR A 56 24.944 -10.916 1.615 1.00 1.00 H new ATOM 0 HB THR A 56 24.990 -8.519 1.799 1.00 1.00 H new ATOM 0 HG1 THR A 56 27.317 -8.385 2.200 1.00 1.00 H new ATOM 0 HG21 THR A 56 25.926 -7.326 3.719 1.00 1.00 H new ATOM 0 HG22 THR A 56 24.363 -8.100 4.075 1.00 1.00 H new ATOM 0 HG23 THR A 56 25.873 -8.833 4.665 1.00 1.00 H new ATOM 860 N SER A 57 26.244 -12.424 2.926 1.00 1.00 N ATOM 861 CA SER A 57 26.784 -13.610 3.604 1.00 1.00 C ATOM 862 C SER A 57 28.311 -13.662 3.740 1.00 1.00 C ATOM 863 O SER A 57 29.045 -12.792 3.271 1.00 1.00 O ATOM 864 CB SER A 57 26.284 -14.859 2.867 1.00 1.00 C ATOM 865 OG SER A 57 26.252 -15.941 3.778 1.00 1.00 O ATOM 0 H SER A 57 26.475 -12.393 1.933 1.00 1.00 H new ATOM 0 HA SER A 57 26.421 -13.561 4.631 1.00 1.00 H new ATOM 0 HB2 SER A 57 25.290 -14.682 2.455 1.00 1.00 H new ATOM 0 HB3 SER A 57 26.940 -15.091 2.028 1.00 1.00 H new ATOM 0 HG SER A 57 25.932 -16.746 3.319 1.00 1.00 H new ATOM 871 N THR A 58 28.766 -14.758 4.351 1.00 1.00 N ATOM 872 CA THR A 58 30.141 -15.252 4.480 1.00 1.00 C ATOM 873 C THR A 58 30.944 -14.468 5.496 1.00 1.00 C ATOM 874 O THR A 58 31.372 -15.065 6.481 1.00 1.00 O ATOM 875 CB THR A 58 30.856 -15.406 3.120 1.00 1.00 C ATOM 876 OG1 THR A 58 29.983 -15.962 2.153 1.00 1.00 O ATOM 877 CG2 THR A 58 32.088 -16.310 3.230 1.00 1.00 C ATOM 0 H THR A 58 28.113 -15.388 4.817 1.00 1.00 H new ATOM 0 HA THR A 58 30.066 -16.264 4.879 1.00 1.00 H new ATOM 0 HB THR A 58 31.167 -14.407 2.815 1.00 1.00 H new ATOM 0 HG1 THR A 58 30.474 -16.605 1.600 1.00 1.00 H new ATOM 0 HG21 THR A 58 32.565 -16.395 2.254 1.00 1.00 H new ATOM 0 HG22 THR A 58 32.792 -15.880 3.942 1.00 1.00 H new ATOM 0 HG23 THR A 58 31.784 -17.299 3.573 1.00 1.00 H new ATOM 885 N THR A 59 31.102 -13.149 5.328 1.00 1.00 N ATOM 886 CA THR A 59 31.833 -12.231 6.190 1.00 1.00 C ATOM 887 C THR A 59 33.335 -12.530 6.420 1.00 1.00 C ATOM 888 O THR A 59 34.130 -11.593 6.486 1.00 1.00 O ATOM 889 CB THR A 59 31.002 -12.051 7.462 1.00 1.00 C ATOM 890 OG1 THR A 59 29.772 -11.417 7.178 1.00 1.00 O ATOM 891 CG2 THR A 59 31.701 -11.087 8.388 1.00 1.00 C ATOM 0 H THR A 59 30.691 -12.668 4.528 1.00 1.00 H new ATOM 0 HA THR A 59 31.934 -11.280 5.667 1.00 1.00 H new ATOM 0 HB THR A 59 30.863 -13.044 7.890 1.00 1.00 H new ATOM 0 HG1 THR A 59 29.062 -12.090 7.122 1.00 1.00 H new ATOM 0 HG21 THR A 59 31.109 -10.959 9.294 1.00 1.00 H new ATOM 0 HG22 THR A 59 32.683 -11.481 8.649 1.00 1.00 H new ATOM 0 HG23 THR A 59 31.817 -10.124 7.891 1.00 1.00 H new ATOM 899 N GLY A 60 33.777 -13.789 6.508 1.00 1.00 N ATOM 900 CA GLY A 60 35.174 -14.150 6.778 1.00 1.00 C ATOM 901 C GLY A 60 35.685 -13.490 8.063 1.00 1.00 C ATOM 902 O GLY A 60 34.963 -13.410 9.057 1.00 1.00 O ATOM 0 H GLY A 60 33.166 -14.598 6.392 1.00 1.00 H new ATOM 0 HA2 GLY A 60 35.261 -15.233 6.864 1.00 1.00 H new ATOM 0 HA3 GLY A 60 35.799 -13.846 5.938 1.00 1.00 H new ATOM 906 N GLN A 61 36.895 -12.927 8.009 1.00 1.00 N ATOM 907 CA GLN A 61 37.487 -12.146 9.108 1.00 1.00 C ATOM 908 C GLN A 61 36.813 -10.775 9.346 1.00 1.00 C ATOM 909 O GLN A 61 37.223 -10.070 10.267 1.00 1.00 O ATOM 910 CB GLN A 61 39.005 -11.999 8.877 1.00 1.00 C ATOM 911 CG GLN A 61 39.779 -13.331 8.930 1.00 1.00 C ATOM 912 CD GLN A 61 39.980 -13.911 10.334 1.00 1.00 C ATOM 913 OE1 GLN A 61 39.301 -13.590 11.300 1.00 1.00 O ATOM 914 NE2 GLN A 61 40.925 -14.813 10.504 1.00 1.00 N ATOM 0 H GLN A 61 37.502 -12.999 7.192 1.00 1.00 H new ATOM 0 HA GLN A 61 37.306 -12.705 10.026 1.00 1.00 H new ATOM 0 HB2 GLN A 61 39.171 -11.533 7.906 1.00 1.00 H new ATOM 0 HB3 GLN A 61 39.413 -11.323 9.629 1.00 1.00 H new ATOM 0 HG2 GLN A 61 39.250 -14.065 8.323 1.00 1.00 H new ATOM 0 HG3 GLN A 61 40.757 -13.184 8.471 1.00 1.00 H new ATOM 0 HE21 GLN A 61 41.505 -15.098 9.715 1.00 1.00 H new ATOM 0 HE22 GLN A 61 41.076 -15.226 11.424 1.00 1.00 H new ATOM 923 N GLY A 62 35.804 -10.376 8.555 1.00 1.00 N ATOM 924 CA GLY A 62 34.977 -9.177 8.792 1.00 1.00 C ATOM 925 C GLY A 62 34.570 -8.371 7.549 1.00 1.00 C ATOM 926 O GLY A 62 33.722 -7.483 7.662 1.00 1.00 O ATOM 0 H GLY A 62 35.533 -10.887 7.715 1.00 1.00 H new ATOM 0 HA2 GLY A 62 34.070 -9.485 9.312 1.00 1.00 H new ATOM 0 HA3 GLY A 62 35.521 -8.515 9.466 1.00 1.00 H new ATOM 930 N ASP A 63 35.162 -8.644 6.383 1.00 1.00 N ATOM 931 CA ASP A 63 34.958 -7.883 5.139 1.00 1.00 C ATOM 932 C ASP A 63 33.697 -8.315 4.356 1.00 1.00 C ATOM 933 O ASP A 63 32.957 -9.220 4.749 1.00 1.00 O ATOM 934 CB ASP A 63 36.236 -8.006 4.284 1.00 1.00 C ATOM 935 CG ASP A 63 36.483 -6.857 3.282 1.00 1.00 C ATOM 936 OD1 ASP A 63 35.659 -5.918 3.181 1.00 1.00 O ATOM 937 OD2 ASP A 63 37.525 -6.900 2.585 1.00 1.00 O1- ATOM 0 H ASP A 63 35.814 -9.420 6.271 1.00 1.00 H new ATOM 0 HA ASP A 63 34.778 -6.839 5.396 1.00 1.00 H new ATOM 0 HB2 ASP A 63 37.094 -8.071 4.953 1.00 1.00 H new ATOM 0 HB3 ASP A 63 36.192 -8.944 3.730 1.00 1.00 H new ATOM 942 N LEU A 64 33.448 -7.657 3.223 1.00 1.00 N ATOM 943 CA LEU A 64 32.350 -7.932 2.295 1.00 1.00 C ATOM 944 C LEU A 64 32.757 -8.837 1.114 1.00 1.00 C ATOM 945 O LEU A 64 33.890 -8.736 0.631 1.00 1.00 O ATOM 946 CB LEU A 64 31.793 -6.598 1.770 1.00 1.00 C ATOM 947 CG LEU A 64 30.762 -5.971 2.720 1.00 1.00 C ATOM 948 CD1 LEU A 64 30.516 -4.528 2.305 1.00 1.00 C ATOM 949 CD2 LEU A 64 29.430 -6.732 2.655 1.00 1.00 C ATOM 0 H LEU A 64 34.034 -6.882 2.913 1.00 1.00 H new ATOM 0 HA LEU A 64 31.587 -8.480 2.848 1.00 1.00 H new ATOM 0 HB2 LEU A 64 32.616 -5.899 1.621 1.00 1.00 H new ATOM 0 HB3 LEU A 64 31.332 -6.760 0.796 1.00 1.00 H new ATOM 0 HG LEU A 64 31.152 -6.019 3.737 1.00 1.00 H new ATOM 0 HD11 LEU A 64 29.785 -4.076 2.975 1.00 1.00 H new ATOM 0 HD12 LEU A 64 31.451 -3.970 2.358 1.00 1.00 H new ATOM 0 HD13 LEU A 64 30.136 -4.503 1.284 1.00 1.00 H new ATOM 0 HD21 LEU A 64 28.714 -6.271 3.336 1.00 1.00 H new ATOM 0 HD22 LEU A 64 29.039 -6.695 1.638 1.00 1.00 H new ATOM 0 HD23 LEU A 64 29.590 -7.770 2.945 1.00 1.00 H new ATOM 961 N PRO A 65 31.825 -9.666 0.595 1.00 1.00 N ATOM 962 CA PRO A 65 32.026 -10.408 -0.647 1.00 1.00 C ATOM 963 C PRO A 65 32.243 -9.506 -1.869 1.00 1.00 C ATOM 964 O PRO A 65 31.595 -8.469 -2.023 1.00 1.00 O ATOM 965 CB PRO A 65 30.779 -11.280 -0.825 1.00 1.00 C ATOM 966 CG PRO A 65 30.216 -11.417 0.589 1.00 1.00 C ATOM 967 CD PRO A 65 30.591 -10.094 1.242 1.00 1.00 C ATOM 0 HA PRO A 65 32.938 -11.001 -0.577 1.00 1.00 H new ATOM 0 HB2 PRO A 65 30.059 -10.814 -1.497 1.00 1.00 H new ATOM 0 HB3 PRO A 65 31.029 -12.252 -1.250 1.00 1.00 H new ATOM 0 HG2 PRO A 65 29.137 -11.570 0.580 1.00 1.00 H new ATOM 0 HG3 PRO A 65 30.654 -12.265 1.116 1.00 1.00 H new ATOM 0 HD2 PRO A 65 29.802 -9.354 1.107 1.00 1.00 H new ATOM 0 HD3 PRO A 65 30.734 -10.215 2.316 1.00 1.00 H new ATOM 975 N ASP A 66 33.083 -9.951 -2.804 1.00 1.00 N ATOM 976 CA ASP A 66 33.430 -9.204 -4.025 1.00 1.00 C ATOM 977 C ASP A 66 32.221 -8.934 -4.948 1.00 1.00 C ATOM 978 O ASP A 66 32.224 -7.973 -5.714 1.00 1.00 O ATOM 979 CB ASP A 66 34.521 -9.978 -4.769 1.00 1.00 C ATOM 980 CG ASP A 66 35.082 -9.188 -5.965 1.00 1.00 C ATOM 981 OD1 ASP A 66 35.747 -8.147 -5.744 1.00 1.00 O ATOM 982 OD2 ASP A 66 34.886 -9.624 -7.125 1.00 1.00 O1- ATOM 0 H ASP A 66 33.552 -10.855 -2.738 1.00 1.00 H new ATOM 0 HA ASP A 66 33.789 -8.219 -3.726 1.00 1.00 H new ATOM 0 HB2 ASP A 66 35.331 -10.214 -4.079 1.00 1.00 H new ATOM 0 HB3 ASP A 66 34.116 -10.927 -5.121 1.00 1.00 H new ATOM 987 N SER A 67 31.156 -9.734 -4.838 1.00 1.00 N ATOM 988 CA SER A 67 29.881 -9.541 -5.551 1.00 1.00 C ATOM 989 C SER A 67 29.088 -8.314 -5.084 1.00 1.00 C ATOM 990 O SER A 67 28.329 -7.740 -5.866 1.00 1.00 O ATOM 991 CB SER A 67 29.023 -10.801 -5.386 1.00 1.00 C ATOM 992 OG SER A 67 28.936 -11.147 -4.008 1.00 1.00 O ATOM 0 H SER A 67 31.153 -10.557 -4.235 1.00 1.00 H new ATOM 0 HA SER A 67 30.128 -9.363 -6.598 1.00 1.00 H new ATOM 0 HB2 SER A 67 28.026 -10.629 -5.791 1.00 1.00 H new ATOM 0 HB3 SER A 67 29.458 -11.625 -5.951 1.00 1.00 H new ATOM 0 HG SER A 67 29.212 -12.079 -3.887 1.00 1.00 H new ATOM 998 N ILE A 68 29.267 -7.892 -3.824 1.00 1.00 N ATOM 999 CA ILE A 68 28.564 -6.762 -3.201 1.00 1.00 C ATOM 1000 C ILE A 68 29.473 -5.573 -2.858 1.00 1.00 C ATOM 1001 O ILE A 68 28.981 -4.463 -2.665 1.00 1.00 O ATOM 1002 CB ILE A 68 27.733 -7.293 -2.033 1.00 1.00 C ATOM 1003 CG1 ILE A 68 26.785 -6.209 -1.517 1.00 1.00 C ATOM 1004 CG2 ILE A 68 28.616 -7.867 -0.913 1.00 1.00 C ATOM 1005 CD1 ILE A 68 25.551 -6.770 -0.817 1.00 1.00 C ATOM 0 H ILE A 68 29.927 -8.343 -3.190 1.00 1.00 H new ATOM 0 HA ILE A 68 27.883 -6.320 -3.929 1.00 1.00 H new ATOM 0 HB ILE A 68 27.128 -8.122 -2.400 1.00 1.00 H new ATOM 0 HG12 ILE A 68 27.325 -5.563 -0.824 1.00 1.00 H new ATOM 0 HG13 ILE A 68 26.468 -5.585 -2.353 1.00 1.00 H new ATOM 0 HG21 ILE A 68 27.985 -8.233 -0.103 1.00 1.00 H new ATOM 0 HG22 ILE A 68 29.214 -8.689 -1.306 1.00 1.00 H new ATOM 0 HG23 ILE A 68 29.276 -7.087 -0.534 1.00 1.00 H new ATOM 0 HD11 ILE A 68 24.921 -5.948 -0.476 1.00 1.00 H new ATOM 0 HD12 ILE A 68 24.989 -7.393 -1.513 1.00 1.00 H new ATOM 0 HD13 ILE A 68 25.860 -7.370 0.039 1.00 1.00 H new ATOM 1017 N VAL A 69 30.794 -5.765 -2.849 1.00 1.00 N ATOM 1018 CA VAL A 69 31.800 -4.689 -2.787 1.00 1.00 C ATOM 1019 C VAL A 69 31.453 -3.501 -3.702 1.00 1.00 C ATOM 1020 O VAL A 69 31.443 -2.370 -3.212 1.00 1.00 O ATOM 1021 CB VAL A 69 33.181 -5.271 -3.176 1.00 1.00 C ATOM 1022 CG1 VAL A 69 34.114 -4.302 -3.924 1.00 1.00 C ATOM 1023 CG2 VAL A 69 33.873 -5.805 -1.921 1.00 1.00 C ATOM 0 H VAL A 69 31.210 -6.696 -2.885 1.00 1.00 H new ATOM 0 HA VAL A 69 31.818 -4.305 -1.767 1.00 1.00 H new ATOM 0 HB VAL A 69 32.978 -6.070 -3.889 1.00 1.00 H new ATOM 0 HG11 VAL A 69 35.054 -4.805 -4.151 1.00 1.00 H new ATOM 0 HG12 VAL A 69 33.639 -3.984 -4.852 1.00 1.00 H new ATOM 0 HG13 VAL A 69 34.310 -3.431 -3.299 1.00 1.00 H new ATOM 0 HG21 VAL A 69 34.846 -6.216 -2.189 1.00 1.00 H new ATOM 0 HG22 VAL A 69 34.007 -4.993 -1.206 1.00 1.00 H new ATOM 0 HG23 VAL A 69 33.260 -6.587 -1.472 1.00 1.00 H new ATOM 1033 N PRO A 70 31.150 -3.700 -5.003 1.00 1.00 N ATOM 1034 CA PRO A 70 30.956 -2.580 -5.918 1.00 1.00 C ATOM 1035 C PRO A 70 29.666 -1.812 -5.611 1.00 1.00 C ATOM 1036 O PRO A 70 29.633 -0.594 -5.759 1.00 1.00 O ATOM 1037 CB PRO A 70 30.985 -3.162 -7.331 1.00 1.00 C ATOM 1038 CG PRO A 70 30.573 -4.611 -7.104 1.00 1.00 C ATOM 1039 CD PRO A 70 31.161 -4.948 -5.751 1.00 1.00 C ATOM 0 HA PRO A 70 31.747 -1.838 -5.807 1.00 1.00 H new ATOM 0 HB2 PRO A 70 30.294 -2.644 -7.997 1.00 1.00 H new ATOM 0 HB3 PRO A 70 31.976 -3.088 -7.779 1.00 1.00 H new ATOM 0 HG2 PRO A 70 29.489 -4.724 -7.108 1.00 1.00 H new ATOM 0 HG3 PRO A 70 30.964 -5.265 -7.884 1.00 1.00 H new ATOM 0 HD2 PRO A 70 30.572 -5.714 -5.246 1.00 1.00 H new ATOM 0 HD3 PRO A 70 32.174 -5.338 -5.849 1.00 1.00 H new ATOM 1047 N LEU A 71 28.623 -2.492 -5.112 1.00 1.00 N ATOM 1048 CA LEU A 71 27.420 -1.869 -4.574 1.00 1.00 C ATOM 1049 C LEU A 71 27.743 -1.040 -3.327 1.00 1.00 C ATOM 1050 O LEU A 71 27.410 0.133 -3.280 1.00 1.00 O ATOM 1051 CB LEU A 71 26.441 -3.011 -4.248 1.00 1.00 C ATOM 1052 CG LEU A 71 25.048 -2.550 -3.821 1.00 1.00 C ATOM 1053 CD1 LEU A 71 24.263 -2.133 -5.058 1.00 1.00 C ATOM 1054 CD2 LEU A 71 24.337 -3.700 -3.112 1.00 1.00 C ATOM 0 H LEU A 71 28.599 -3.511 -5.074 1.00 1.00 H new ATOM 0 HA LEU A 71 26.981 -1.179 -5.295 1.00 1.00 H new ATOM 0 HB2 LEU A 71 26.345 -3.651 -5.125 1.00 1.00 H new ATOM 0 HB3 LEU A 71 26.867 -3.622 -3.452 1.00 1.00 H new ATOM 0 HG LEU A 71 25.123 -1.702 -3.140 1.00 1.00 H new ATOM 0 HD11 LEU A 71 23.267 -1.802 -4.763 1.00 1.00 H new ATOM 0 HD12 LEU A 71 24.782 -1.317 -5.560 1.00 1.00 H new ATOM 0 HD13 LEU A 71 24.177 -2.981 -5.737 1.00 1.00 H new ATOM 0 HD21 LEU A 71 23.342 -3.378 -2.804 1.00 1.00 H new ATOM 0 HD22 LEU A 71 24.250 -4.548 -3.791 1.00 1.00 H new ATOM 0 HD23 LEU A 71 24.910 -3.996 -2.234 1.00 1.00 H new ATOM 1066 N PHE A 72 28.444 -1.615 -2.348 1.00 1.00 N ATOM 1067 CA PHE A 72 28.832 -0.947 -1.101 1.00 1.00 C ATOM 1068 C PHE A 72 29.599 0.352 -1.348 1.00 1.00 C ATOM 1069 O PHE A 72 29.197 1.432 -0.906 1.00 1.00 O ATOM 1070 CB PHE A 72 29.666 -1.941 -0.289 1.00 1.00 C ATOM 1071 CG PHE A 72 30.235 -1.395 0.996 1.00 1.00 C ATOM 1072 CD1 PHE A 72 29.419 -1.324 2.135 1.00 1.00 C ATOM 1073 CD2 PHE A 72 31.586 -0.998 1.067 1.00 1.00 C ATOM 1074 CE1 PHE A 72 29.968 -0.908 3.355 1.00 1.00 C ATOM 1075 CE2 PHE A 72 32.126 -0.566 2.291 1.00 1.00 C ATOM 1076 CZ PHE A 72 31.318 -0.531 3.440 1.00 1.00 C ATOM 0 H PHE A 72 28.766 -2.581 -2.400 1.00 1.00 H new ATOM 0 HA PHE A 72 27.937 -0.655 -0.551 1.00 1.00 H new ATOM 0 HB2 PHE A 72 29.046 -2.807 -0.055 1.00 1.00 H new ATOM 0 HB3 PHE A 72 30.488 -2.296 -0.911 1.00 1.00 H new ATOM 0 HD1 PHE A 72 28.374 -1.588 2.072 1.00 1.00 H new ATOM 0 HD2 PHE A 72 32.205 -1.026 0.182 1.00 1.00 H new ATOM 0 HE1 PHE A 72 29.347 -0.877 4.238 1.00 1.00 H new ATOM 0 HE2 PHE A 72 33.161 -0.261 2.348 1.00 1.00 H new ATOM 0 HZ PHE A 72 31.734 -0.215 4.385 1.00 1.00 H new ATOM 1086 N GLN A 73 30.666 0.257 -2.139 1.00 1.00 N ATOM 1087 CA GLN A 73 31.467 1.412 -2.537 1.00 1.00 C ATOM 1088 C GLN A 73 30.686 2.364 -3.453 1.00 1.00 C ATOM 1089 O GLN A 73 30.802 3.578 -3.325 1.00 1.00 O ATOM 1090 CB GLN A 73 32.782 0.960 -3.187 1.00 1.00 C ATOM 1091 CG GLN A 73 33.678 0.195 -2.198 1.00 1.00 C ATOM 1092 CD GLN A 73 35.140 0.208 -2.634 1.00 1.00 C ATOM 1093 OE1 GLN A 73 35.650 -0.717 -3.254 1.00 1.00 O ATOM 1094 NE2 GLN A 73 35.865 1.268 -2.338 1.00 1.00 N ATOM 0 H GLN A 73 31.000 -0.627 -2.523 1.00 1.00 H new ATOM 0 HA GLN A 73 31.709 1.973 -1.634 1.00 1.00 H new ATOM 0 HB2 GLN A 73 32.563 0.324 -4.045 1.00 1.00 H new ATOM 0 HB3 GLN A 73 33.319 1.831 -3.564 1.00 1.00 H new ATOM 0 HG2 GLN A 73 33.590 0.641 -1.207 1.00 1.00 H new ATOM 0 HG3 GLN A 73 33.332 -0.835 -2.116 1.00 1.00 H new ATOM 0 HE21 GLN A 73 35.448 2.043 -1.822 1.00 1.00 H new ATOM 0 HE22 GLN A 73 36.843 1.313 -2.625 1.00 1.00 H new ATOM 1103 N GLY A 74 29.816 1.831 -4.308 1.00 1.00 N ATOM 1104 CA GLY A 74 28.929 2.619 -5.157 1.00 1.00 C ATOM 1105 C GLY A 74 27.914 3.431 -4.350 1.00 1.00 C ATOM 1106 O GLY A 74 27.666 4.586 -4.671 1.00 1.00 O ATOM 0 H GLY A 74 29.707 0.824 -4.431 1.00 1.00 H new ATOM 0 HA2 GLY A 74 29.525 3.295 -5.771 1.00 1.00 H new ATOM 0 HA3 GLY A 74 28.398 1.954 -5.838 1.00 1.00 H new ATOM 1110 N ILE A 75 27.377 2.915 -3.243 1.00 1.00 N ATOM 1111 CA ILE A 75 26.544 3.708 -2.348 1.00 1.00 C ATOM 1112 C ILE A 75 27.416 4.805 -1.726 1.00 1.00 C ATOM 1113 O ILE A 75 27.073 5.979 -1.784 1.00 1.00 O ATOM 1114 CB ILE A 75 25.838 2.785 -1.332 1.00 1.00 C ATOM 1115 CG1 ILE A 75 24.891 1.762 -2.001 1.00 1.00 C ATOM 1116 CG2 ILE A 75 25.043 3.562 -0.274 1.00 1.00 C ATOM 1117 CD1 ILE A 75 24.499 0.634 -1.043 1.00 1.00 C ATOM 0 H ILE A 75 27.507 1.948 -2.947 1.00 1.00 H new ATOM 0 HA ILE A 75 25.737 4.212 -2.880 1.00 1.00 H new ATOM 0 HB ILE A 75 26.653 2.249 -0.846 1.00 1.00 H new ATOM 0 HG12 ILE A 75 23.992 2.272 -2.348 1.00 1.00 H new ATOM 0 HG13 ILE A 75 25.377 1.339 -2.880 1.00 1.00 H new ATOM 0 HG21 ILE A 75 24.569 2.861 0.412 1.00 1.00 H new ATOM 0 HG22 ILE A 75 25.717 4.214 0.282 1.00 1.00 H new ATOM 0 HG23 ILE A 75 24.278 4.164 -0.764 1.00 1.00 H new ATOM 0 HD11 ILE A 75 23.833 -0.062 -1.553 1.00 1.00 H new ATOM 0 HD12 ILE A 75 25.395 0.106 -0.717 1.00 1.00 H new ATOM 0 HD13 ILE A 75 23.989 1.054 -0.176 1.00 1.00 H new ATOM 1129 N LYS A 76 28.586 4.474 -1.182 1.00 1.00 N ATOM 1130 CA LYS A 76 29.355 5.470 -0.405 1.00 1.00 C ATOM 1131 C LYS A 76 29.938 6.602 -1.271 1.00 1.00 C ATOM 1132 O LYS A 76 30.056 7.729 -0.799 1.00 1.00 O ATOM 1133 CB LYS A 76 30.407 4.759 0.465 1.00 1.00 C ATOM 1134 CG LYS A 76 31.826 4.587 -0.089 1.00 1.00 C ATOM 1135 CD LYS A 76 32.602 3.535 0.732 1.00 1.00 C ATOM 1136 CE LYS A 76 32.827 3.877 2.219 1.00 1.00 C ATOM 1137 NZ LYS A 76 33.734 5.046 2.431 1.00 1.00 N1+ ATOM 0 H LYS A 76 29.020 3.554 -1.255 1.00 1.00 H new ATOM 0 HA LYS A 76 28.662 5.982 0.263 1.00 1.00 H new ATOM 0 HB2 LYS A 76 30.483 5.306 1.405 1.00 1.00 H new ATOM 0 HB3 LYS A 76 30.023 3.767 0.704 1.00 1.00 H new ATOM 0 HG2 LYS A 76 31.780 4.280 -1.134 1.00 1.00 H new ATOM 0 HG3 LYS A 76 32.353 5.541 -0.060 1.00 1.00 H new ATOM 0 HD2 LYS A 76 32.065 2.588 0.674 1.00 1.00 H new ATOM 0 HD3 LYS A 76 33.574 3.380 0.263 1.00 1.00 H new ATOM 0 HE2 LYS A 76 31.864 4.085 2.686 1.00 1.00 H new ATOM 0 HE3 LYS A 76 33.245 3.007 2.725 1.00 1.00 H new ATOM 0 HZ1 LYS A 76 33.842 5.221 3.450 1.00 1.00 H new ATOM 0 HZ2 LYS A 76 34.665 4.843 2.014 1.00 1.00 H new ATOM 0 HZ3 LYS A 76 33.327 5.888 1.976 1.00 1.00 H new ATOM 1151 N ASP A 77 30.270 6.294 -2.527 1.00 1.00 N ATOM 1152 CA ASP A 77 30.937 7.187 -3.477 1.00 1.00 C ATOM 1153 C ASP A 77 30.037 7.760 -4.590 1.00 1.00 C ATOM 1154 O ASP A 77 30.177 8.934 -4.942 1.00 1.00 O ATOM 1155 CB ASP A 77 32.162 6.478 -4.067 1.00 1.00 C ATOM 1156 CG ASP A 77 33.051 7.450 -4.864 1.00 1.00 C ATOM 1157 OD1 ASP A 77 33.694 8.331 -4.242 1.00 1.00 O ATOM 1158 OD2 ASP A 77 33.138 7.320 -6.109 1.00 1.00 O1- ATOM 0 H ASP A 77 30.073 5.376 -2.927 1.00 1.00 H new ATOM 0 HA ASP A 77 31.238 8.064 -2.904 1.00 1.00 H new ATOM 0 HB2 ASP A 77 32.744 6.027 -3.263 1.00 1.00 H new ATOM 0 HB3 ASP A 77 31.835 5.667 -4.717 1.00 1.00 H new ATOM 1163 N SER A 78 29.102 6.967 -5.122 1.00 1.00 N ATOM 1164 CA SER A 78 28.211 7.364 -6.235 1.00 1.00 C ATOM 1165 C SER A 78 26.868 7.927 -5.752 1.00 1.00 C ATOM 1166 O SER A 78 26.238 8.691 -6.487 1.00 1.00 O ATOM 1167 CB SER A 78 27.993 6.236 -7.262 1.00 1.00 C ATOM 1168 OG SER A 78 29.236 5.736 -7.740 1.00 1.00 O ATOM 0 H SER A 78 28.934 6.016 -4.792 1.00 1.00 H new ATOM 0 HA SER A 78 28.739 8.170 -6.745 1.00 1.00 H new ATOM 0 HB2 SER A 78 27.423 5.427 -6.804 1.00 1.00 H new ATOM 0 HB3 SER A 78 27.401 6.609 -8.098 1.00 1.00 H new ATOM 0 HG SER A 78 29.073 5.020 -8.389 1.00 1.00 H new ATOM 1174 N LEU A 79 26.432 7.591 -4.526 1.00 1.00 N ATOM 1175 CA LEU A 79 25.289 8.246 -3.870 1.00 1.00 C ATOM 1176 C LEU A 79 25.872 9.398 -3.039 1.00 1.00 C ATOM 1177 O LEU A 79 25.738 10.565 -3.406 1.00 1.00 O ATOM 1178 CB LEU A 79 24.422 7.277 -3.030 1.00 1.00 C ATOM 1179 CG LEU A 79 23.618 6.143 -3.704 1.00 1.00 C ATOM 1180 CD1 LEU A 79 22.160 6.569 -3.850 1.00 1.00 C ATOM 1181 CD2 LEU A 79 24.092 5.775 -5.097 1.00 1.00 C ATOM 0 H LEU A 79 26.862 6.858 -3.963 1.00 1.00 H new ATOM 0 HA LEU A 79 24.590 8.622 -4.618 1.00 1.00 H new ATOM 0 HB2 LEU A 79 25.082 6.810 -2.299 1.00 1.00 H new ATOM 0 HB3 LEU A 79 23.710 7.886 -2.473 1.00 1.00 H new ATOM 0 HG LEU A 79 23.756 5.278 -3.055 1.00 1.00 H new ATOM 0 HD11 LEU A 79 21.593 5.769 -4.326 1.00 1.00 H new ATOM 0 HD12 LEU A 79 21.741 6.775 -2.865 1.00 1.00 H new ATOM 0 HD13 LEU A 79 22.103 7.468 -4.464 1.00 1.00 H new ATOM 0 HD21 LEU A 79 23.471 4.971 -5.492 1.00 1.00 H new ATOM 0 HD22 LEU A 79 24.017 6.646 -5.749 1.00 1.00 H new ATOM 0 HD23 LEU A 79 25.129 5.443 -5.053 1.00 1.00 H new ATOM 1193 N GLY A 80 26.567 9.061 -1.945 1.00 1.00 N ATOM 1194 CA GLY A 80 27.393 9.945 -1.101 1.00 1.00 C ATOM 1195 C GLY A 80 26.620 10.998 -0.287 1.00 1.00 C ATOM 1196 O GLY A 80 27.156 11.609 0.638 1.00 1.00 O ATOM 0 H GLY A 80 26.570 8.101 -1.600 1.00 1.00 H new ATOM 0 HA2 GLY A 80 27.966 9.327 -0.410 1.00 1.00 H new ATOM 0 HA3 GLY A 80 28.111 10.460 -1.739 1.00 1.00 H new ATOM 1200 N PHE A 81 25.333 11.138 -0.587 1.00 1.00 N ATOM 1201 CA PHE A 81 24.298 11.897 0.111 1.00 1.00 C ATOM 1202 C PHE A 81 22.953 11.223 -0.199 1.00 1.00 C ATOM 1203 O PHE A 81 22.783 10.641 -1.272 1.00 1.00 O ATOM 1204 CB PHE A 81 24.287 13.365 -0.347 1.00 1.00 C ATOM 1205 CG PHE A 81 23.130 14.158 0.241 1.00 1.00 C ATOM 1206 CD1 PHE A 81 23.160 14.550 1.595 1.00 1.00 C ATOM 1207 CD2 PHE A 81 21.982 14.419 -0.535 1.00 1.00 C ATOM 1208 CE1 PHE A 81 22.053 15.203 2.164 1.00 1.00 C ATOM 1209 CE2 PHE A 81 20.875 15.071 0.037 1.00 1.00 C ATOM 1210 CZ PHE A 81 20.911 15.466 1.387 1.00 1.00 C ATOM 0 H PHE A 81 24.948 10.675 -1.410 1.00 1.00 H new ATOM 0 HA PHE A 81 24.489 11.901 1.184 1.00 1.00 H new ATOM 0 HB2 PHE A 81 25.227 13.837 -0.061 1.00 1.00 H new ATOM 0 HB3 PHE A 81 24.230 13.401 -1.435 1.00 1.00 H new ATOM 0 HD1 PHE A 81 24.035 14.348 2.196 1.00 1.00 H new ATOM 0 HD2 PHE A 81 21.953 14.117 -1.572 1.00 1.00 H new ATOM 0 HE1 PHE A 81 22.080 15.504 3.201 1.00 1.00 H new ATOM 0 HE2 PHE A 81 19.997 15.269 -0.560 1.00 1.00 H new ATOM 0 HZ PHE A 81 20.063 15.970 1.826 1.00 1.00 H new ATOM 1220 N GLN A 82 22.018 11.241 0.755 1.00 1.00 N ATOM 1221 CA GLN A 82 20.734 10.546 0.637 1.00 1.00 C ATOM 1222 C GLN A 82 19.582 11.450 1.124 1.00 1.00 C ATOM 1223 O GLN A 82 19.628 11.911 2.267 1.00 1.00 O ATOM 1224 CB GLN A 82 20.805 9.281 1.499 1.00 1.00 C ATOM 1225 CG GLN A 82 21.943 8.300 1.126 1.00 1.00 C ATOM 1226 CD GLN A 82 21.616 7.362 -0.025 1.00 1.00 C ATOM 1227 OE1 GLN A 82 20.512 7.292 -0.533 1.00 1.00 O ATOM 1228 NE2 GLN A 82 22.560 6.550 -0.438 1.00 1.00 N ATOM 0 H GLN A 82 22.132 11.742 1.636 1.00 1.00 H new ATOM 0 HA GLN A 82 20.542 10.291 -0.405 1.00 1.00 H new ATOM 0 HB2 GLN A 82 20.926 9.576 2.541 1.00 1.00 H new ATOM 0 HB3 GLN A 82 19.853 8.755 1.425 1.00 1.00 H new ATOM 0 HG2 GLN A 82 22.832 8.876 0.867 1.00 1.00 H new ATOM 0 HG3 GLN A 82 22.194 7.704 2.004 1.00 1.00 H new ATOM 0 HE21 GLN A 82 23.490 6.596 -0.022 1.00 1.00 H new ATOM 0 HE22 GLN A 82 22.364 5.872 -1.175 1.00 1.00 H new ATOM 1237 N PRO A 83 18.537 11.682 0.304 1.00 1.00 N ATOM 1238 CA PRO A 83 17.478 12.639 0.635 1.00 1.00 C ATOM 1239 C PRO A 83 16.382 12.075 1.560 1.00 1.00 C ATOM 1240 O PRO A 83 15.912 12.777 2.457 1.00 1.00 O ATOM 1241 CB PRO A 83 16.934 13.086 -0.728 1.00 1.00 C ATOM 1242 CG PRO A 83 17.132 11.849 -1.607 1.00 1.00 C ATOM 1243 CD PRO A 83 18.446 11.282 -1.098 1.00 1.00 C ATOM 0 HA PRO A 83 17.870 13.470 1.222 1.00 1.00 H new ATOM 0 HB2 PRO A 83 15.884 13.373 -0.668 1.00 1.00 H new ATOM 0 HB3 PRO A 83 17.478 13.947 -1.116 1.00 1.00 H new ATOM 0 HG2 PRO A 83 16.314 11.138 -1.495 1.00 1.00 H new ATOM 0 HG3 PRO A 83 17.186 12.108 -2.664 1.00 1.00 H new ATOM 0 HD2 PRO A 83 18.468 10.197 -1.197 1.00 1.00 H new ATOM 0 HD3 PRO A 83 19.288 11.671 -1.671 1.00 1.00 H new ATOM 1251 N ASN A 84 15.971 10.816 1.346 1.00 1.00 N ATOM 1252 CA ASN A 84 14.796 10.196 1.992 1.00 1.00 C ATOM 1253 C ASN A 84 14.958 8.676 2.259 1.00 1.00 C ATOM 1254 O ASN A 84 13.963 7.980 2.470 1.00 1.00 O ATOM 1255 CB ASN A 84 13.559 10.458 1.098 1.00 1.00 C ATOM 1256 CG ASN A 84 13.153 11.920 1.015 1.00 1.00 C ATOM 1257 OD1 ASN A 84 12.640 12.502 1.961 1.00 1.00 O ATOM 1258 ND2 ASN A 84 13.345 12.558 -0.120 1.00 1.00 N ATOM 0 H ASN A 84 16.454 10.185 0.707 1.00 1.00 H new ATOM 0 HA ASN A 84 14.678 10.652 2.975 1.00 1.00 H new ATOM 0 HB2 ASN A 84 13.766 10.092 0.093 1.00 1.00 H new ATOM 0 HB3 ASN A 84 12.718 9.880 1.481 1.00 1.00 H new ATOM 0 HD21 ASN A 84 13.066 13.535 -0.209 1.00 1.00 H new ATOM 0 HD22 ASN A 84 13.772 12.075 -0.910 1.00 1.00 H new ATOM 1265 N LEU A 85 16.185 8.130 2.251 1.00 1.00 N ATOM 1266 CA LEU A 85 16.382 6.673 2.263 1.00 1.00 C ATOM 1267 C LEU A 85 16.163 6.043 3.635 1.00 1.00 C ATOM 1268 O LEU A 85 16.613 6.569 4.651 1.00 1.00 O ATOM 1269 CB LEU A 85 17.772 6.338 1.703 1.00 1.00 C ATOM 1270 CG LEU A 85 18.074 4.836 1.543 1.00 1.00 C ATOM 1271 CD1 LEU A 85 17.048 4.187 0.621 1.00 1.00 C ATOM 1272 CD2 LEU A 85 19.459 4.630 0.937 1.00 1.00 C ATOM 0 H LEU A 85 17.049 8.672 2.236 1.00 1.00 H new ATOM 0 HA LEU A 85 15.617 6.235 1.622 1.00 1.00 H new ATOM 0 HB2 LEU A 85 17.879 6.819 0.731 1.00 1.00 H new ATOM 0 HB3 LEU A 85 18.525 6.775 2.359 1.00 1.00 H new ATOM 0 HG LEU A 85 18.031 4.380 2.532 1.00 1.00 H new ATOM 0 HD11 LEU A 85 17.273 3.126 0.516 1.00 1.00 H new ATOM 0 HD12 LEU A 85 16.051 4.307 1.045 1.00 1.00 H new ATOM 0 HD13 LEU A 85 17.086 4.664 -0.358 1.00 1.00 H new ATOM 0 HD21 LEU A 85 19.655 3.563 0.831 1.00 1.00 H new ATOM 0 HD22 LEU A 85 19.502 5.105 -0.043 1.00 1.00 H new ATOM 0 HD23 LEU A 85 20.211 5.074 1.589 1.00 1.00 H new ATOM 1284 N ARG A 86 15.533 4.870 3.621 1.00 1.00 N ATOM 1285 CA ARG A 86 15.321 3.910 4.716 1.00 1.00 C ATOM 1286 C ARG A 86 15.667 2.512 4.185 1.00 1.00 C ATOM 1287 O ARG A 86 15.433 2.244 3.016 1.00 1.00 O ATOM 1288 CB ARG A 86 13.828 3.997 5.078 1.00 1.00 C ATOM 1289 CG ARG A 86 13.425 5.246 5.866 1.00 1.00 C ATOM 1290 CD ARG A 86 13.661 5.102 7.371 1.00 1.00 C ATOM 1291 NE ARG A 86 12.689 4.152 7.947 1.00 1.00 N ATOM 1292 CZ ARG A 86 12.134 4.195 9.151 1.00 1.00 C ATOM 1293 NH1 ARG A 86 12.535 5.027 10.068 1.00 1.00 N1+ ATOM 1294 NH2 ARG A 86 11.155 3.395 9.463 1.00 1.00 N ATOM 0 H ARG A 86 15.113 4.528 2.756 1.00 1.00 H new ATOM 0 HA ARG A 86 15.936 4.117 5.592 1.00 1.00 H new ATOM 0 HB2 ARG A 86 13.244 3.962 4.158 1.00 1.00 H new ATOM 0 HB3 ARG A 86 13.559 3.116 5.660 1.00 1.00 H new ATOM 0 HG2 ARG A 86 13.990 6.101 5.495 1.00 1.00 H new ATOM 0 HG3 ARG A 86 12.371 5.458 5.687 1.00 1.00 H new ATOM 0 HD2 ARG A 86 14.677 4.752 7.556 1.00 1.00 H new ATOM 0 HD3 ARG A 86 13.564 6.073 7.857 1.00 1.00 H new ATOM 0 HE ARG A 86 12.412 3.372 7.350 1.00 1.00 H new ATOM 0 HH11 ARG A 86 13.299 5.673 9.871 1.00 1.00 H new ATOM 0 HH12 ARG A 86 12.085 5.033 10.983 1.00 1.00 H new ATOM 0 HH21 ARG A 86 10.806 2.725 8.778 1.00 1.00 H new ATOM 0 HH22 ARG A 86 10.737 3.439 10.393 1.00 1.00 H new ATOM 1308 N TYR A 87 16.180 1.601 5.006 1.00 1.00 N ATOM 1309 CA TYR A 87 16.524 0.235 4.567 1.00 1.00 C ATOM 1310 C TYR A 87 16.559 -0.763 5.734 1.00 1.00 C ATOM 1311 O TYR A 87 16.602 -0.348 6.890 1.00 1.00 O ATOM 1312 CB TYR A 87 17.858 0.245 3.795 1.00 1.00 C ATOM 1313 CG TYR A 87 19.074 -0.245 4.538 1.00 1.00 C ATOM 1314 CD1 TYR A 87 19.578 0.498 5.618 1.00 1.00 C ATOM 1315 CD2 TYR A 87 19.711 -1.428 4.125 1.00 1.00 C ATOM 1316 CE1 TYR A 87 20.759 0.070 6.259 1.00 1.00 C ATOM 1317 CE2 TYR A 87 20.865 -1.868 4.786 1.00 1.00 C ATOM 1318 CZ TYR A 87 21.363 -1.138 5.870 1.00 1.00 C ATOM 1319 OH TYR A 87 22.371 -1.664 6.593 1.00 1.00 O ATOM 0 H TYR A 87 16.372 1.779 5.992 1.00 1.00 H new ATOM 0 HA TYR A 87 15.735 -0.105 3.897 1.00 1.00 H new ATOM 0 HB2 TYR A 87 17.738 -0.365 2.900 1.00 1.00 H new ATOM 0 HB3 TYR A 87 18.051 1.265 3.462 1.00 1.00 H new ATOM 0 HD1 TYR A 87 19.066 1.388 5.954 1.00 1.00 H new ATOM 0 HD2 TYR A 87 19.311 -1.997 3.299 1.00 1.00 H new ATOM 0 HE1 TYR A 87 21.197 0.667 7.045 1.00 1.00 H new ATOM 0 HE2 TYR A 87 21.368 -2.767 4.460 1.00 1.00 H new ATOM 0 HH TYR A 87 22.647 -2.517 6.198 1.00 1.00 H new ATOM 1329 N GLY A 88 16.575 -2.062 5.440 1.00 1.00 N ATOM 1330 CA GLY A 88 16.810 -3.148 6.398 1.00 1.00 C ATOM 1331 C GLY A 88 17.870 -4.122 5.911 1.00 1.00 C ATOM 1332 O GLY A 88 18.357 -4.029 4.788 1.00 1.00 O ATOM 0 H GLY A 88 16.419 -2.403 4.492 1.00 1.00 H new ATOM 0 HA2 GLY A 88 17.118 -2.726 7.355 1.00 1.00 H new ATOM 0 HA3 GLY A 88 15.878 -3.685 6.572 1.00 1.00 H new ATOM 1336 N VAL A 89 18.264 -5.077 6.749 1.00 1.00 N ATOM 1337 CA VAL A 89 19.434 -5.910 6.466 1.00 1.00 C ATOM 1338 C VAL A 89 19.484 -7.231 7.237 1.00 1.00 C ATOM 1339 O VAL A 89 19.150 -7.314 8.414 1.00 1.00 O ATOM 1340 CB VAL A 89 20.702 -5.056 6.624 1.00 1.00 C ATOM 1341 CG1 VAL A 89 20.606 -3.967 7.704 1.00 1.00 C ATOM 1342 CG2 VAL A 89 22.017 -5.823 6.720 1.00 1.00 C ATOM 0 H VAL A 89 17.793 -5.295 7.627 1.00 1.00 H new ATOM 0 HA VAL A 89 19.358 -6.248 5.432 1.00 1.00 H new ATOM 0 HB VAL A 89 20.739 -4.548 5.661 1.00 1.00 H new ATOM 0 HG11 VAL A 89 21.544 -3.413 7.747 1.00 1.00 H new ATOM 0 HG12 VAL A 89 19.792 -3.284 7.461 1.00 1.00 H new ATOM 0 HG13 VAL A 89 20.414 -4.430 8.672 1.00 1.00 H new ATOM 0 HG21 VAL A 89 22.842 -5.119 6.829 1.00 1.00 H new ATOM 0 HG22 VAL A 89 21.989 -6.486 7.585 1.00 1.00 H new ATOM 0 HG23 VAL A 89 22.161 -6.413 5.815 1.00 1.00 H new ATOM 1352 N ILE A 90 19.976 -8.262 6.555 1.00 1.00 N ATOM 1353 CA ILE A 90 20.337 -9.573 7.092 1.00 1.00 C ATOM 1354 C ILE A 90 21.796 -9.858 6.730 1.00 1.00 C ATOM 1355 O ILE A 90 22.147 -10.027 5.561 1.00 1.00 O ATOM 1356 CB ILE A 90 19.407 -10.653 6.511 1.00 1.00 C ATOM 1357 CG1 ILE A 90 17.925 -10.450 6.891 1.00 1.00 C ATOM 1358 CG2 ILE A 90 19.842 -12.065 6.935 1.00 1.00 C ATOM 1359 CD1 ILE A 90 17.110 -10.401 5.600 1.00 1.00 C ATOM 0 H ILE A 90 20.144 -8.202 5.551 1.00 1.00 H new ATOM 0 HA ILE A 90 20.224 -9.583 8.176 1.00 1.00 H new ATOM 0 HB ILE A 90 19.495 -10.550 5.429 1.00 1.00 H new ATOM 0 HG12 ILE A 90 17.580 -11.264 7.529 1.00 1.00 H new ATOM 0 HG13 ILE A 90 17.799 -9.527 7.456 1.00 1.00 H new ATOM 0 HG21 ILE A 90 19.161 -12.800 6.505 1.00 1.00 H new ATOM 0 HG22 ILE A 90 20.854 -12.256 6.579 1.00 1.00 H new ATOM 0 HG23 ILE A 90 19.819 -12.142 8.022 1.00 1.00 H new ATOM 0 HD11 ILE A 90 16.056 -10.258 5.840 1.00 1.00 H new ATOM 0 HD12 ILE A 90 17.457 -9.573 4.982 1.00 1.00 H new ATOM 0 HD13 ILE A 90 17.234 -11.337 5.056 1.00 1.00 H new ATOM 1371 N ALA A 91 22.634 -9.918 7.747 1.00 1.00 N ATOM 1372 CA ALA A 91 24.002 -10.379 7.677 1.00 1.00 C ATOM 1373 C ALA A 91 24.080 -11.880 7.996 1.00 1.00 C ATOM 1374 O ALA A 91 23.282 -12.409 8.776 1.00 1.00 O ATOM 1375 CB ALA A 91 24.764 -9.565 8.710 1.00 1.00 C ATOM 0 H ALA A 91 22.364 -9.632 8.688 1.00 1.00 H new ATOM 0 HA ALA A 91 24.422 -10.249 6.680 1.00 1.00 H new ATOM 0 HB1 ALA A 91 25.812 -9.865 8.709 1.00 1.00 H new ATOM 0 HB2 ALA A 91 24.690 -8.505 8.465 1.00 1.00 H new ATOM 0 HB3 ALA A 91 24.337 -9.740 9.698 1.00 1.00 H new ATOM 1381 N LEU A 92 25.059 -12.573 7.416 1.00 1.00 N ATOM 1382 CA LEU A 92 25.343 -13.969 7.733 1.00 1.00 C ATOM 1383 C LEU A 92 26.848 -14.239 7.767 1.00 1.00 C ATOM 1384 O LEU A 92 27.612 -13.613 7.027 1.00 1.00 O ATOM 1385 CB LEU A 92 24.693 -14.927 6.718 1.00 1.00 C ATOM 1386 CG LEU A 92 23.265 -14.660 6.198 1.00 1.00 C ATOM 1387 CD1 LEU A 92 23.137 -13.593 5.114 1.00 1.00 C ATOM 1388 CD2 LEU A 92 22.797 -15.953 5.548 1.00 1.00 C ATOM 0 H LEU A 92 25.680 -12.178 6.709 1.00 1.00 H new ATOM 0 HA LEU A 92 24.919 -14.151 8.720 1.00 1.00 H new ATOM 0 HB2 LEU A 92 25.350 -14.970 5.849 1.00 1.00 H new ATOM 0 HB3 LEU A 92 24.692 -15.920 7.167 1.00 1.00 H new ATOM 0 HG LEU A 92 22.692 -14.312 7.057 1.00 1.00 H new ATOM 0 HD11 LEU A 92 22.091 -13.491 4.826 1.00 1.00 H new ATOM 0 HD12 LEU A 92 23.503 -12.640 5.496 1.00 1.00 H new ATOM 0 HD13 LEU A 92 23.726 -13.885 4.245 1.00 1.00 H new ATOM 0 HD21 LEU A 92 21.787 -15.821 5.161 1.00 1.00 H new ATOM 0 HD22 LEU A 92 23.468 -16.213 4.730 1.00 1.00 H new ATOM 0 HD23 LEU A 92 22.800 -16.754 6.287 1.00 1.00 H new ATOM 1400 N GLY A 93 27.264 -15.226 8.559 1.00 1.00 N ATOM 1401 CA GLY A 93 28.647 -15.709 8.490 1.00 1.00 C ATOM 1402 C GLY A 93 29.046 -16.716 9.565 1.00 1.00 C ATOM 1403 O GLY A 93 28.284 -17.018 10.477 1.00 1.00 O ATOM 0 H GLY A 93 26.677 -15.701 9.245 1.00 1.00 H new ATOM 0 HA2 GLY A 93 28.806 -16.165 7.513 1.00 1.00 H new ATOM 0 HA3 GLY A 93 29.317 -14.851 8.554 1.00 1.00 H new ATOM 1407 N ASP A 94 30.253 -17.264 9.460 1.00 1.00 N ATOM 1408 CA ASP A 94 30.799 -18.200 10.446 1.00 1.00 C ATOM 1409 C ASP A 94 31.417 -17.430 11.624 1.00 1.00 C ATOM 1410 O ASP A 94 32.440 -16.754 11.493 1.00 1.00 O ATOM 1411 CB ASP A 94 31.760 -19.152 9.730 1.00 1.00 C ATOM 1412 CG ASP A 94 32.176 -20.332 10.623 1.00 1.00 C ATOM 1413 OD1 ASP A 94 32.595 -20.092 11.776 1.00 1.00 O1- ATOM 1414 OD2 ASP A 94 32.071 -21.497 10.170 1.00 1.00 O ATOM 0 H ASP A 94 30.887 -17.072 8.684 1.00 1.00 H new ATOM 0 HA ASP A 94 30.017 -18.816 10.891 1.00 1.00 H new ATOM 0 HB2 ASP A 94 31.286 -19.532 8.825 1.00 1.00 H new ATOM 0 HB3 ASP A 94 32.648 -18.603 9.418 1.00 1.00 H new ATOM 1419 N SER A 95 30.765 -17.520 12.786 1.00 1.00 N ATOM 1420 CA SER A 95 31.159 -16.819 14.019 1.00 1.00 C ATOM 1421 C SER A 95 32.461 -17.330 14.663 1.00 1.00 C ATOM 1422 O SER A 95 32.881 -16.791 15.692 1.00 1.00 O ATOM 1423 CB SER A 95 30.013 -16.863 15.041 1.00 1.00 C ATOM 1424 OG SER A 95 29.774 -18.195 15.480 1.00 1.00 O ATOM 0 H SER A 95 29.930 -18.094 12.902 1.00 1.00 H new ATOM 0 HA SER A 95 31.365 -15.792 13.717 1.00 1.00 H new ATOM 0 HB2 SER A 95 30.259 -16.233 15.896 1.00 1.00 H new ATOM 0 HB3 SER A 95 29.106 -16.455 14.594 1.00 1.00 H new ATOM 0 HG SER A 95 29.042 -18.198 16.131 1.00 1.00 H new ATOM 1430 N SER A 96 33.137 -18.328 14.075 1.00 1.00 N ATOM 1431 CA SER A 96 34.486 -18.733 14.501 1.00 1.00 C ATOM 1432 C SER A 96 35.534 -17.633 14.244 1.00 1.00 C ATOM 1433 O SER A 96 36.501 -17.498 15.002 1.00 1.00 O ATOM 1434 CB SER A 96 34.899 -20.036 13.806 1.00 1.00 C ATOM 1435 OG SER A 96 36.073 -20.570 14.401 1.00 1.00 O ATOM 0 H SER A 96 32.768 -18.874 13.296 1.00 1.00 H new ATOM 0 HA SER A 96 34.447 -18.898 15.578 1.00 1.00 H new ATOM 0 HB2 SER A 96 34.089 -20.762 13.872 1.00 1.00 H new ATOM 0 HB3 SER A 96 35.074 -19.850 12.746 1.00 1.00 H new ATOM 0 HG SER A 96 36.321 -21.402 13.946 1.00 1.00 H new ATOM 1441 N TYR A 97 35.322 -16.797 13.219 1.00 1.00 N ATOM 1442 CA TYR A 97 36.131 -15.603 12.956 1.00 1.00 C ATOM 1443 C TYR A 97 35.753 -14.422 13.860 1.00 1.00 C ATOM 1444 O TYR A 97 34.647 -14.354 14.406 1.00 1.00 O ATOM 1445 CB TYR A 97 35.963 -15.151 11.500 1.00 1.00 C ATOM 1446 CG TYR A 97 36.328 -16.186 10.448 1.00 1.00 C ATOM 1447 CD1 TYR A 97 37.659 -16.631 10.326 1.00 1.00 C ATOM 1448 CD2 TYR A 97 35.336 -16.698 9.587 1.00 1.00 C ATOM 1449 CE1 TYR A 97 38.002 -17.576 9.338 1.00 1.00 C ATOM 1450 CE2 TYR A 97 35.674 -17.641 8.597 1.00 1.00 C ATOM 1451 CZ TYR A 97 37.010 -18.085 8.470 1.00 1.00 C ATOM 1452 OH TYR A 97 37.327 -19.000 7.512 1.00 1.00 O ATOM 0 H TYR A 97 34.573 -16.934 12.541 1.00 1.00 H new ATOM 0 HA TYR A 97 37.163 -15.887 13.162 1.00 1.00 H new ATOM 0 HB2 TYR A 97 34.926 -14.853 11.347 1.00 1.00 H new ATOM 0 HB3 TYR A 97 36.576 -14.264 11.340 1.00 1.00 H new ATOM 0 HD1 TYR A 97 38.418 -16.247 10.991 1.00 1.00 H new ATOM 0 HD2 TYR A 97 34.313 -16.366 9.687 1.00 1.00 H new ATOM 0 HE1 TYR A 97 39.024 -17.911 9.244 1.00 1.00 H new ATOM 0 HE2 TYR A 97 34.912 -18.025 7.935 1.00 1.00 H new ATOM 0 HH TYR A 97 36.521 -19.239 7.009 1.00 1.00 H new ATOM 1462 N VAL A 98 36.667 -13.452 13.976 1.00 1.00 N ATOM 1463 CA VAL A 98 36.367 -12.150 14.598 1.00 1.00 C ATOM 1464 C VAL A 98 35.396 -11.356 13.711 1.00 1.00 C ATOM 1465 O VAL A 98 35.195 -11.684 12.540 1.00 1.00 O ATOM 1466 CB VAL A 98 37.619 -11.286 14.885 1.00 1.00 C ATOM 1467 CG1 VAL A 98 37.683 -10.933 16.370 1.00 1.00 C ATOM 1468 CG2 VAL A 98 38.950 -11.856 14.395 1.00 1.00 C ATOM 0 H VAL A 98 37.628 -13.542 13.646 1.00 1.00 H new ATOM 0 HA VAL A 98 35.916 -12.377 15.564 1.00 1.00 H new ATOM 0 HB VAL A 98 37.485 -10.386 14.285 1.00 1.00 H new ATOM 0 HG11 VAL A 98 38.567 -10.325 16.562 1.00 1.00 H new ATOM 0 HG12 VAL A 98 36.790 -10.373 16.650 1.00 1.00 H new ATOM 0 HG13 VAL A 98 37.737 -11.848 16.960 1.00 1.00 H new ATOM 0 HG21 VAL A 98 39.756 -11.168 14.650 1.00 1.00 H new ATOM 0 HG22 VAL A 98 39.131 -12.820 14.872 1.00 1.00 H new ATOM 0 HG23 VAL A 98 38.914 -11.987 13.314 1.00 1.00 H new ATOM 1478 N ASN A 99 34.839 -10.267 14.253 1.00 1.00 N ATOM 1479 CA ASN A 99 33.992 -9.321 13.515 1.00 1.00 C ATOM 1480 C ASN A 99 32.721 -9.988 12.932 1.00 1.00 C ATOM 1481 O ASN A 99 32.393 -9.811 11.758 1.00 1.00 O ATOM 1482 CB ASN A 99 34.843 -8.561 12.473 1.00 1.00 C ATOM 1483 CG ASN A 99 36.145 -8.001 13.025 1.00 1.00 C ATOM 1484 OD1 ASN A 99 36.168 -7.103 13.855 1.00 1.00 O ATOM 1485 ND2 ASN A 99 37.263 -8.534 12.589 1.00 1.00 N ATOM 0 H ASN A 99 34.966 -10.014 15.233 1.00 1.00 H new ATOM 0 HA ASN A 99 33.601 -8.580 14.212 1.00 1.00 H new ATOM 0 HB2 ASN A 99 35.071 -9.233 11.646 1.00 1.00 H new ATOM 0 HB3 ASN A 99 34.252 -7.742 12.065 1.00 1.00 H new ATOM 0 HD21 ASN A 99 38.159 -8.199 12.943 1.00 1.00 H new ATOM 0 HD22 ASN A 99 37.235 -9.283 11.897 1.00 1.00 H new ATOM 1492 N PHE A 100 32.019 -10.787 13.745 1.00 1.00 N ATOM 1493 CA PHE A 100 30.827 -11.547 13.335 1.00 1.00 C ATOM 1494 C PHE A 100 29.791 -10.672 12.598 1.00 1.00 C ATOM 1495 O PHE A 100 29.367 -9.632 13.103 1.00 1.00 O ATOM 1496 CB PHE A 100 30.178 -12.193 14.568 1.00 1.00 C ATOM 1497 CG PHE A 100 28.855 -12.874 14.267 1.00 1.00 C ATOM 1498 CD1 PHE A 100 28.818 -13.979 13.394 1.00 1.00 C ATOM 1499 CD2 PHE A 100 27.657 -12.389 14.827 1.00 1.00 C ATOM 1500 CE1 PHE A 100 27.596 -14.613 13.111 1.00 1.00 C ATOM 1501 CE2 PHE A 100 26.439 -13.031 14.553 1.00 1.00 C ATOM 1502 CZ PHE A 100 26.407 -14.135 13.688 1.00 1.00 C ATOM 0 H PHE A 100 32.266 -10.927 14.725 1.00 1.00 H new ATOM 0 HA PHE A 100 31.156 -12.315 12.635 1.00 1.00 H new ATOM 0 HB2 PHE A 100 30.867 -12.925 14.990 1.00 1.00 H new ATOM 0 HB3 PHE A 100 30.020 -11.428 15.328 1.00 1.00 H new ATOM 0 HD1 PHE A 100 29.730 -14.339 12.942 1.00 1.00 H new ATOM 0 HD2 PHE A 100 27.676 -11.521 15.469 1.00 1.00 H new ATOM 0 HE1 PHE A 100 27.571 -15.467 12.450 1.00 1.00 H new ATOM 0 HE2 PHE A 100 25.527 -12.675 15.008 1.00 1.00 H new ATOM 0 HZ PHE A 100 25.467 -14.618 13.465 1.00 1.00 H new ATOM 1512 N CYS A 101 29.375 -11.103 11.398 1.00 1.00 N ATOM 1513 CA CYS A 101 28.371 -10.435 10.547 1.00 1.00 C ATOM 1514 C CYS A 101 28.691 -8.975 10.152 1.00 1.00 C ATOM 1515 O CYS A 101 27.827 -8.261 9.642 1.00 1.00 O ATOM 1516 CB CYS A 101 26.987 -10.617 11.195 1.00 1.00 C ATOM 1517 SG CYS A 101 26.337 -12.266 10.791 1.00 1.00 S ATOM 0 H CYS A 101 29.740 -11.957 10.976 1.00 1.00 H new ATOM 0 HA CYS A 101 28.387 -10.925 9.573 1.00 1.00 H new ATOM 0 HB2 CYS A 101 27.062 -10.499 12.276 1.00 1.00 H new ATOM 0 HB3 CYS A 101 26.303 -9.848 10.837 1.00 1.00 H new ATOM 0 HG CYS A 101 26.522 -13.064 11.800 1.00 1.00 H new ATOM 1523 N ASN A 102 29.936 -8.522 10.334 1.00 1.00 N ATOM 1524 CA ASN A 102 30.371 -7.140 10.095 1.00 1.00 C ATOM 1525 C ASN A 102 30.156 -6.653 8.656 1.00 1.00 C ATOM 1526 O ASN A 102 29.942 -5.462 8.475 1.00 1.00 O ATOM 1527 CB ASN A 102 31.810 -7.028 10.612 1.00 1.00 C ATOM 1528 CG ASN A 102 32.363 -5.621 10.502 1.00 1.00 C ATOM 1529 OD1 ASN A 102 32.161 -4.767 11.351 1.00 1.00 O ATOM 1530 ND2 ASN A 102 33.063 -5.347 9.435 1.00 1.00 N ATOM 0 H ASN A 102 30.692 -9.124 10.661 1.00 1.00 H new ATOM 0 HA ASN A 102 29.738 -6.446 10.647 1.00 1.00 H new ATOM 0 HB2 ASN A 102 31.843 -7.347 11.654 1.00 1.00 H new ATOM 0 HB3 ASN A 102 32.448 -7.710 10.050 1.00 1.00 H new ATOM 0 HD21 ASN A 102 33.448 -4.411 9.304 1.00 1.00 H new ATOM 0 HD22 ASN A 102 33.225 -6.068 8.732 1.00 1.00 H new ATOM 1537 N GLY A 103 30.075 -7.531 7.651 1.00 1.00 N ATOM 1538 CA GLY A 103 29.747 -7.130 6.277 1.00 1.00 C ATOM 1539 C GLY A 103 28.382 -6.437 6.164 1.00 1.00 C ATOM 1540 O GLY A 103 28.279 -5.354 5.595 1.00 1.00 O ATOM 0 H GLY A 103 30.233 -8.532 7.764 1.00 1.00 H new ATOM 0 HA2 GLY A 103 30.521 -6.458 5.906 1.00 1.00 H new ATOM 0 HA3 GLY A 103 29.755 -8.011 5.635 1.00 1.00 H new ATOM 1544 N GLY A 104 27.335 -6.990 6.790 1.00 1.00 N ATOM 1545 CA GLY A 104 26.000 -6.356 6.810 1.00 1.00 C ATOM 1546 C GLY A 104 25.918 -5.160 7.757 1.00 1.00 C ATOM 1547 O GLY A 104 25.331 -4.141 7.408 1.00 1.00 O ATOM 0 H GLY A 104 27.382 -7.877 7.292 1.00 1.00 H new ATOM 0 HA2 GLY A 104 25.744 -6.031 5.802 1.00 1.00 H new ATOM 0 HA3 GLY A 104 25.257 -7.097 7.105 1.00 1.00 H new ATOM 1551 N LYS A 105 26.606 -5.221 8.907 1.00 1.00 N ATOM 1552 CA LYS A 105 26.750 -4.078 9.837 1.00 1.00 C ATOM 1553 C LYS A 105 27.424 -2.861 9.185 1.00 1.00 C ATOM 1554 O LYS A 105 27.053 -1.716 9.430 1.00 1.00 O ATOM 1555 CB LYS A 105 27.512 -4.505 11.083 1.00 1.00 C ATOM 1556 CG LYS A 105 26.786 -5.631 11.847 1.00 1.00 C ATOM 1557 CD LYS A 105 27.375 -5.621 13.253 1.00 1.00 C ATOM 1558 CE LYS A 105 26.799 -6.716 14.166 1.00 1.00 C ATOM 1559 NZ LYS A 105 27.367 -6.623 15.547 1.00 1.00 N1+ ATOM 0 H LYS A 105 27.082 -6.065 9.224 1.00 1.00 H new ATOM 0 HA LYS A 105 25.743 -3.767 10.116 1.00 1.00 H new ATOM 0 HB2 LYS A 105 28.509 -4.843 10.800 1.00 1.00 H new ATOM 0 HB3 LYS A 105 27.642 -3.646 11.741 1.00 1.00 H new ATOM 0 HG2 LYS A 105 25.710 -5.457 11.872 1.00 1.00 H new ATOM 0 HG3 LYS A 105 26.942 -6.596 11.364 1.00 1.00 H new ATOM 0 HD2 LYS A 105 28.456 -5.745 13.187 1.00 1.00 H new ATOM 0 HD3 LYS A 105 27.194 -4.647 13.708 1.00 1.00 H new ATOM 0 HE2 LYS A 105 25.714 -6.623 14.209 1.00 1.00 H new ATOM 0 HE3 LYS A 105 27.019 -7.697 13.745 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 26.961 -7.374 16.141 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 28.400 -6.735 15.506 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 27.136 -5.695 15.956 1.00 1.00 H new ATOM 1573 N GLN A 106 28.373 -3.109 8.287 1.00 1.00 N ATOM 1574 CA GLN A 106 29.009 -2.070 7.477 1.00 1.00 C ATOM 1575 C GLN A 106 28.050 -1.422 6.475 1.00 1.00 C ATOM 1576 O GLN A 106 28.146 -0.218 6.256 1.00 1.00 O ATOM 1577 CB GLN A 106 30.279 -2.612 6.804 1.00 1.00 C ATOM 1578 CG GLN A 106 31.437 -2.698 7.810 1.00 1.00 C ATOM 1579 CD GLN A 106 32.007 -1.337 8.221 1.00 1.00 C ATOM 1580 OE1 GLN A 106 32.042 -0.374 7.468 1.00 1.00 O ATOM 1581 NE2 GLN A 106 32.482 -1.199 9.442 1.00 1.00 N ATOM 0 H GLN A 106 28.727 -4.047 8.098 1.00 1.00 H new ATOM 0 HA GLN A 106 29.303 -1.267 8.153 1.00 1.00 H new ATOM 0 HB2 GLN A 106 30.081 -3.599 6.386 1.00 1.00 H new ATOM 0 HB3 GLN A 106 30.560 -1.964 5.974 1.00 1.00 H new ATOM 0 HG2 GLN A 106 31.092 -3.220 8.702 1.00 1.00 H new ATOM 0 HG3 GLN A 106 32.236 -3.300 7.378 1.00 1.00 H new ATOM 0 HE21 GLN A 106 32.464 -1.988 10.088 1.00 1.00 H new ATOM 0 HE22 GLN A 106 32.868 -0.303 9.741 1.00 1.00 H new ATOM 1590 N PHE A 107 27.073 -2.152 5.921 1.00 1.00 N ATOM 1591 CA PHE A 107 26.019 -1.538 5.107 1.00 1.00 C ATOM 1592 C PHE A 107 25.183 -0.539 5.933 1.00 1.00 C ATOM 1593 O PHE A 107 24.846 0.531 5.428 1.00 1.00 O ATOM 1594 CB PHE A 107 25.164 -2.606 4.393 1.00 1.00 C ATOM 1595 CG PHE A 107 25.588 -2.827 2.959 1.00 1.00 C ATOM 1596 CD1 PHE A 107 26.607 -3.758 2.685 1.00 1.00 C ATOM 1597 CD2 PHE A 107 24.972 -2.129 1.897 1.00 1.00 C ATOM 1598 CE1 PHE A 107 27.007 -3.985 1.361 1.00 1.00 C ATOM 1599 CE2 PHE A 107 25.344 -2.401 0.571 1.00 1.00 C ATOM 1600 CZ PHE A 107 26.379 -3.306 0.305 1.00 1.00 C ATOM 0 H PHE A 107 26.992 -3.164 6.022 1.00 1.00 H new ATOM 0 HA PHE A 107 26.494 -0.956 4.317 1.00 1.00 H new ATOM 0 HB2 PHE A 107 25.235 -3.547 4.938 1.00 1.00 H new ATOM 0 HB3 PHE A 107 24.117 -2.303 4.416 1.00 1.00 H new ATOM 0 HD1 PHE A 107 27.080 -4.296 3.493 1.00 1.00 H new ATOM 0 HD2 PHE A 107 24.216 -1.387 2.105 1.00 1.00 H new ATOM 0 HE1 PHE A 107 27.802 -4.686 1.152 1.00 1.00 H new ATOM 0 HE2 PHE A 107 24.832 -1.912 -0.244 1.00 1.00 H new ATOM 0 HZ PHE A 107 26.694 -3.482 -0.713 1.00 1.00 H new ATOM 1610 N ASP A 108 24.940 -0.827 7.220 1.00 1.00 N ATOM 1611 CA ASP A 108 24.234 0.102 8.115 1.00 1.00 C ATOM 1612 C ASP A 108 25.051 1.368 8.358 1.00 1.00 C ATOM 1613 O ASP A 108 24.531 2.475 8.202 1.00 1.00 O ATOM 1614 CB ASP A 108 23.830 -0.605 9.421 1.00 1.00 C ATOM 1615 CG ASP A 108 23.608 0.368 10.592 1.00 1.00 C ATOM 1616 OD1 ASP A 108 22.473 0.868 10.749 1.00 1.00 O1- ATOM 1617 OD2 ASP A 108 24.555 0.607 11.375 1.00 1.00 O ATOM 0 H ASP A 108 25.223 -1.700 7.666 1.00 1.00 H new ATOM 0 HA ASP A 108 23.313 0.422 7.627 1.00 1.00 H new ATOM 0 HB2 ASP A 108 22.916 -1.174 9.251 1.00 1.00 H new ATOM 0 HB3 ASP A 108 24.605 -1.321 9.694 1.00 1.00 H new ATOM 1622 N ALA A 109 26.350 1.208 8.614 1.00 1.00 N ATOM 1623 CA ALA A 109 27.275 2.324 8.730 1.00 1.00 C ATOM 1624 C ALA A 109 27.280 3.203 7.471 1.00 1.00 C ATOM 1625 O ALA A 109 27.190 4.418 7.599 1.00 1.00 O ATOM 1626 CB ALA A 109 28.670 1.779 9.023 1.00 1.00 C ATOM 0 H ALA A 109 26.787 0.296 8.746 1.00 1.00 H new ATOM 0 HA ALA A 109 26.949 2.964 9.550 1.00 1.00 H new ATOM 0 HB1 ALA A 109 29.373 2.607 9.112 1.00 1.00 H new ATOM 0 HB2 ALA A 109 28.652 1.216 9.956 1.00 1.00 H new ATOM 0 HB3 ALA A 109 28.983 1.124 8.210 1.00 1.00 H new ATOM 1632 N LEU A 110 27.300 2.603 6.274 1.00 1.00 N ATOM 1633 CA LEU A 110 27.360 3.261 4.962 1.00 1.00 C ATOM 1634 C LEU A 110 26.291 4.336 4.828 1.00 1.00 C ATOM 1635 O LEU A 110 26.530 5.474 4.421 1.00 1.00 O ATOM 1636 CB LEU A 110 27.155 2.171 3.885 1.00 1.00 C ATOM 1637 CG LEU A 110 27.866 2.482 2.564 1.00 1.00 C ATOM 1638 CD1 LEU A 110 27.488 3.848 2.043 1.00 1.00 C ATOM 1639 CD2 LEU A 110 29.378 2.351 2.738 1.00 1.00 C ATOM 0 H LEU A 110 27.273 1.587 6.190 1.00 1.00 H new ATOM 0 HA LEU A 110 28.325 3.753 4.842 1.00 1.00 H new ATOM 0 HB2 LEU A 110 27.518 1.218 4.269 1.00 1.00 H new ATOM 0 HB3 LEU A 110 26.088 2.053 3.696 1.00 1.00 H new ATOM 0 HG LEU A 110 27.541 1.755 1.819 1.00 1.00 H new ATOM 0 HD11 LEU A 110 28.010 4.037 1.105 1.00 1.00 H new ATOM 0 HD12 LEU A 110 26.412 3.888 1.874 1.00 1.00 H new ATOM 0 HD13 LEU A 110 27.769 4.607 2.774 1.00 1.00 H new ATOM 0 HD21 LEU A 110 29.874 2.574 1.793 1.00 1.00 H new ATOM 0 HD22 LEU A 110 29.719 3.051 3.501 1.00 1.00 H new ATOM 0 HD23 LEU A 110 29.622 1.334 3.044 1.00 1.00 H new ATOM 1651 N LEU A 111 25.070 3.965 5.171 1.00 1.00 N ATOM 1652 CA LEU A 111 23.953 4.893 5.109 1.00 1.00 C ATOM 1653 C LEU A 111 24.101 6.031 6.115 1.00 1.00 C ATOM 1654 O LEU A 111 23.920 7.189 5.732 1.00 1.00 O ATOM 1655 CB LEU A 111 22.654 4.095 5.223 1.00 1.00 C ATOM 1656 CG LEU A 111 22.465 3.081 4.078 1.00 1.00 C ATOM 1657 CD1 LEU A 111 20.977 2.790 3.960 1.00 1.00 C ATOM 1658 CD2 LEU A 111 22.918 3.563 2.693 1.00 1.00 C ATOM 0 H LEU A 111 24.826 3.029 5.495 1.00 1.00 H new ATOM 0 HA LEU A 111 23.933 5.406 4.148 1.00 1.00 H new ATOM 0 HB2 LEU A 111 22.643 3.565 6.175 1.00 1.00 H new ATOM 0 HB3 LEU A 111 21.810 4.785 5.232 1.00 1.00 H new ATOM 0 HG LEU A 111 23.082 2.221 4.339 1.00 1.00 H new ATOM 0 HD11 LEU A 111 20.809 2.073 3.156 1.00 1.00 H new ATOM 0 HD12 LEU A 111 20.612 2.374 4.899 1.00 1.00 H new ATOM 0 HD13 LEU A 111 20.442 3.714 3.740 1.00 1.00 H new ATOM 0 HD21 LEU A 111 22.743 2.777 1.959 1.00 1.00 H new ATOM 0 HD22 LEU A 111 22.353 4.452 2.414 1.00 1.00 H new ATOM 0 HD23 LEU A 111 23.981 3.803 2.721 1.00 1.00 H new ATOM 1670 N GLN A 112 24.573 5.731 7.322 1.00 1.00 N ATOM 1671 CA GLN A 112 24.858 6.735 8.344 1.00 1.00 C ATOM 1672 C GLN A 112 26.039 7.669 7.994 1.00 1.00 C ATOM 1673 O GLN A 112 26.071 8.812 8.453 1.00 1.00 O ATOM 1674 CB GLN A 112 25.115 6.045 9.699 1.00 1.00 C ATOM 1675 CG GLN A 112 23.948 5.172 10.191 1.00 1.00 C ATOM 1676 CD GLN A 112 22.698 5.976 10.541 1.00 1.00 C ATOM 1677 OE1 GLN A 112 22.741 7.061 11.109 1.00 1.00 O ATOM 1678 NE2 GLN A 112 21.530 5.468 10.216 1.00 1.00 N ATOM 0 H GLN A 112 24.770 4.776 7.621 1.00 1.00 H new ATOM 0 HA GLN A 112 23.975 7.372 8.401 1.00 1.00 H new ATOM 0 HB2 GLN A 112 26.008 5.425 9.615 1.00 1.00 H new ATOM 0 HB3 GLN A 112 25.325 6.808 10.449 1.00 1.00 H new ATOM 0 HG2 GLN A 112 23.699 4.443 9.420 1.00 1.00 H new ATOM 0 HG3 GLN A 112 24.268 4.611 11.069 1.00 1.00 H new ATOM 0 HE21 GLN A 112 21.480 4.566 9.743 1.00 1.00 H new ATOM 0 HE22 GLN A 112 20.674 5.976 10.437 1.00 1.00 H new ATOM 1687 N GLU A 113 26.979 7.229 7.145 1.00 1.00 N ATOM 1688 CA GLU A 113 28.098 8.051 6.639 1.00 1.00 C ATOM 1689 C GLU A 113 27.598 9.207 5.780 1.00 1.00 C ATOM 1690 O GLU A 113 28.169 10.299 5.756 1.00 1.00 O ATOM 1691 CB GLU A 113 29.059 7.245 5.744 1.00 1.00 C ATOM 1692 CG GLU A 113 29.586 6.016 6.435 1.00 1.00 C ATOM 1693 CD GLU A 113 30.959 5.584 5.888 1.00 1.00 C ATOM 1694 OE1 GLU A 113 31.066 5.260 4.680 1.00 1.00 O ATOM 1695 OE2 GLU A 113 31.945 5.571 6.665 1.00 1.00 O1- ATOM 0 H GLU A 113 26.987 6.276 6.782 1.00 1.00 H new ATOM 0 HA GLU A 113 28.612 8.408 7.532 1.00 1.00 H new ATOM 0 HB2 GLU A 113 28.542 6.952 4.830 1.00 1.00 H new ATOM 0 HB3 GLU A 113 29.895 7.879 5.448 1.00 1.00 H new ATOM 0 HG2 GLU A 113 29.668 6.210 7.505 1.00 1.00 H new ATOM 0 HG3 GLU A 113 28.875 5.199 6.312 1.00 1.00 H new ATOM 1702 N GLN A 114 26.522 8.908 5.053 1.00 1.00 N ATOM 1703 CA GLN A 114 25.916 9.818 4.093 1.00 1.00 C ATOM 1704 C GLN A 114 24.964 10.775 4.795 1.00 1.00 C ATOM 1705 O GLN A 114 25.252 11.960 4.950 1.00 1.00 O ATOM 1706 CB GLN A 114 25.247 9.027 2.970 1.00 1.00 C ATOM 1707 CG GLN A 114 26.286 8.296 2.117 1.00 1.00 C ATOM 1708 CD GLN A 114 25.572 7.256 1.308 1.00 1.00 C ATOM 1709 OE1 GLN A 114 25.165 7.436 0.178 1.00 1.00 O ATOM 1710 NE2 GLN A 114 25.252 6.163 1.940 1.00 1.00 N ATOM 0 H GLN A 114 26.042 8.010 5.119 1.00 1.00 H new ATOM 0 HA GLN A 114 26.689 10.432 3.632 1.00 1.00 H new ATOM 0 HB2 GLN A 114 24.548 8.306 3.395 1.00 1.00 H new ATOM 0 HB3 GLN A 114 24.666 9.702 2.342 1.00 1.00 H new ATOM 0 HG2 GLN A 114 26.804 8.998 1.463 1.00 1.00 H new ATOM 0 HG3 GLN A 114 27.042 7.833 2.751 1.00 1.00 H new ATOM 0 HE21 GLN A 114 25.590 6.005 2.889 1.00 1.00 H new ATOM 0 HE22 GLN A 114 24.663 5.465 1.486 1.00 1.00 H new ATOM 1719 N SER A 115 23.821 10.215 5.193 1.00 1.00 N ATOM 1720 CA SER A 115 22.750 10.814 6.015 1.00 1.00 C ATOM 1721 C SER A 115 21.529 9.883 6.131 1.00 1.00 C ATOM 1722 O SER A 115 20.521 10.240 6.741 1.00 1.00 O ATOM 1723 CB SER A 115 22.238 12.131 5.388 1.00 1.00 C ATOM 1724 OG SER A 115 23.044 13.235 5.759 1.00 1.00 O ATOM 0 H SER A 115 23.595 9.255 4.932 1.00 1.00 H new ATOM 0 HA SER A 115 23.191 10.989 6.996 1.00 1.00 H new ATOM 0 HB2 SER A 115 22.227 12.037 4.302 1.00 1.00 H new ATOM 0 HB3 SER A 115 21.210 12.309 5.703 1.00 1.00 H new ATOM 0 HG SER A 115 23.989 13.000 5.652 1.00 1.00 H new ATOM 1730 N ALA A 116 21.575 8.709 5.489 1.00 1.00 N ATOM 1731 CA ALA A 116 20.417 7.836 5.336 1.00 1.00 C ATOM 1732 C ALA A 116 20.032 7.101 6.621 1.00 1.00 C ATOM 1733 O ALA A 116 20.822 6.938 7.549 1.00 1.00 O ATOM 1734 CB ALA A 116 20.638 6.906 4.140 1.00 1.00 C ATOM 0 H ALA A 116 22.424 8.341 5.061 1.00 1.00 H new ATOM 0 HA ALA A 116 19.546 8.457 5.128 1.00 1.00 H new ATOM 0 HB1 ALA A 116 19.774 6.252 4.023 1.00 1.00 H new ATOM 0 HB2 ALA A 116 20.768 7.501 3.236 1.00 1.00 H new ATOM 0 HB3 ALA A 116 21.530 6.302 4.308 1.00 1.00 H new ATOM 1740 N GLN A 117 18.777 6.657 6.633 1.00 1.00 N ATOM 1741 CA GLN A 117 18.079 6.120 7.804 1.00 1.00 C ATOM 1742 C GLN A 117 18.049 4.584 7.782 1.00 1.00 C ATOM 1743 O GLN A 117 18.335 3.958 6.761 1.00 1.00 O ATOM 1744 CB GLN A 117 16.649 6.694 7.845 1.00 1.00 C ATOM 1745 CG GLN A 117 16.560 8.226 7.763 1.00 1.00 C ATOM 1746 CD GLN A 117 15.158 8.697 7.394 1.00 1.00 C ATOM 1747 OE1 GLN A 117 14.373 9.143 8.220 1.00 1.00 O ATOM 1748 NE2 GLN A 117 14.790 8.595 6.133 1.00 1.00 N ATOM 0 H GLN A 117 18.194 6.661 5.796 1.00 1.00 H new ATOM 0 HA GLN A 117 18.617 6.418 8.704 1.00 1.00 H new ATOM 0 HB2 GLN A 117 16.079 6.268 7.020 1.00 1.00 H new ATOM 0 HB3 GLN A 117 16.169 6.366 8.767 1.00 1.00 H new ATOM 0 HG2 GLN A 117 16.847 8.658 8.722 1.00 1.00 H new ATOM 0 HG3 GLN A 117 17.272 8.592 7.023 1.00 1.00 H new ATOM 0 HE21 GLN A 117 15.440 8.224 5.440 1.00 1.00 H new ATOM 0 HE22 GLN A 117 13.855 8.887 5.849 1.00 1.00 H new ATOM 1757 N ARG A 118 17.596 3.972 8.881 1.00 1.00 N ATOM 1758 CA ARG A 118 17.363 2.527 8.993 1.00 1.00 C ATOM 1759 C ARG A 118 15.948 2.190 9.471 1.00 1.00 C ATOM 1760 O ARG A 118 15.296 2.974 10.154 1.00 1.00 O ATOM 1761 CB ARG A 118 18.420 1.879 9.921 1.00 1.00 C ATOM 1762 CG ARG A 118 19.208 0.738 9.245 1.00 1.00 C ATOM 1763 CD ARG A 118 19.386 -0.513 10.117 1.00 1.00 C ATOM 1764 NE ARG A 118 20.017 -0.178 11.408 1.00 1.00 N ATOM 1765 CZ ARG A 118 19.506 -0.177 12.625 1.00 1.00 C ATOM 1766 NH1 ARG A 118 18.256 -0.467 12.874 1.00 1.00 N1+ ATOM 1767 NH2 ARG A 118 20.266 0.140 13.630 1.00 1.00 N ATOM 0 H ARG A 118 17.376 4.479 9.738 1.00 1.00 H new ATOM 0 HA ARG A 118 17.463 2.112 7.990 1.00 1.00 H new ATOM 0 HB2 ARG A 118 19.119 2.646 10.255 1.00 1.00 H new ATOM 0 HB3 ARG A 118 17.924 1.491 10.810 1.00 1.00 H new ATOM 0 HG2 ARG A 118 18.697 0.455 8.325 1.00 1.00 H new ATOM 0 HG3 ARG A 118 20.192 1.111 8.961 1.00 1.00 H new ATOM 0 HD2 ARG A 118 18.416 -0.978 10.293 1.00 1.00 H new ATOM 0 HD3 ARG A 118 19.998 -1.244 9.589 1.00 1.00 H new ATOM 0 HE ARG A 118 20.998 0.095 11.351 1.00 1.00 H new ATOM 0 HH11 ARG A 118 17.626 -0.709 12.109 1.00 1.00 H new ATOM 0 HH12 ARG A 118 17.910 -0.452 13.834 1.00 1.00 H new ATOM 0 HH21 ARG A 118 21.244 0.384 13.473 1.00 1.00 H new ATOM 0 HH22 ARG A 118 19.885 0.145 14.576 1.00 1.00 H new ATOM 1781 N VAL A 119 15.510 0.996 9.086 1.00 1.00 N ATOM 1782 CA VAL A 119 14.302 0.299 9.561 1.00 1.00 C ATOM 1783 C VAL A 119 14.764 -0.605 10.741 1.00 1.00 C ATOM 1784 O VAL A 119 15.914 -0.492 11.182 1.00 1.00 O ATOM 1785 CB VAL A 119 13.644 -0.404 8.338 1.00 1.00 C ATOM 1786 CG1 VAL A 119 12.252 -0.973 8.608 1.00 1.00 C ATOM 1787 CG2 VAL A 119 13.389 0.552 7.160 1.00 1.00 C ATOM 0 H VAL A 119 16.015 0.448 8.390 1.00 1.00 H new ATOM 0 HA VAL A 119 13.512 0.936 9.959 1.00 1.00 H new ATOM 0 HB VAL A 119 14.373 -1.184 8.119 1.00 1.00 H new ATOM 0 HG11 VAL A 119 11.870 -1.444 7.703 1.00 1.00 H new ATOM 0 HG12 VAL A 119 12.310 -1.714 9.406 1.00 1.00 H new ATOM 0 HG13 VAL A 119 11.582 -0.168 8.909 1.00 1.00 H new ATOM 0 HG21 VAL A 119 12.929 0.003 6.339 1.00 1.00 H new ATOM 0 HG22 VAL A 119 12.722 1.353 7.479 1.00 1.00 H new ATOM 0 HG23 VAL A 119 14.335 0.979 6.826 1.00 1.00 H new ATOM 1797 N GLY A 120 13.909 -1.473 11.296 1.00 1.00 N ATOM 1798 CA GLY A 120 14.218 -2.307 12.479 1.00 1.00 C ATOM 1799 C GLY A 120 15.528 -3.120 12.408 1.00 1.00 C ATOM 1800 O GLY A 120 16.031 -3.417 11.323 1.00 1.00 O ATOM 0 H GLY A 120 12.967 -1.623 10.935 1.00 1.00 H new ATOM 0 HA2 GLY A 120 14.262 -1.659 13.354 1.00 1.00 H new ATOM 0 HA3 GLY A 120 13.391 -3.000 12.637 1.00 1.00 H new ATOM 1804 N GLU A 121 16.093 -3.445 13.579 1.00 1.00 N ATOM 1805 CA GLU A 121 17.406 -4.066 13.766 1.00 1.00 C ATOM 1806 C GLU A 121 17.664 -5.297 12.892 1.00 1.00 C ATOM 1807 O GLU A 121 16.790 -6.130 12.657 1.00 1.00 O ATOM 1808 CB GLU A 121 17.600 -4.443 15.247 1.00 1.00 C ATOM 1809 CG GLU A 121 18.839 -3.752 15.802 1.00 1.00 C ATOM 1810 CD GLU A 121 19.056 -4.088 17.289 1.00 1.00 C ATOM 1811 OE1 GLU A 121 19.732 -5.100 17.597 1.00 1.00 O1- ATOM 1812 OE2 GLU A 121 18.551 -3.342 18.165 1.00 1.00 O ATOM 0 H GLU A 121 15.620 -3.272 14.466 1.00 1.00 H new ATOM 0 HA GLU A 121 18.130 -3.315 13.450 1.00 1.00 H new ATOM 0 HB2 GLU A 121 16.722 -4.151 15.823 1.00 1.00 H new ATOM 0 HB3 GLU A 121 17.701 -5.524 15.346 1.00 1.00 H new ATOM 0 HG2 GLU A 121 19.714 -4.056 15.228 1.00 1.00 H new ATOM 0 HG3 GLU A 121 18.739 -2.673 15.683 1.00 1.00 H new ATOM 1819 N MET A 122 18.913 -5.414 12.450 1.00 1.00 N ATOM 1820 CA MET A 122 19.347 -6.367 11.449 1.00 1.00 C ATOM 1821 C MET A 122 19.452 -7.781 12.017 1.00 1.00 C ATOM 1822 O MET A 122 19.666 -7.986 13.216 1.00 1.00 O ATOM 1823 CB MET A 122 20.646 -5.902 10.781 1.00 1.00 C ATOM 1824 CG MET A 122 21.874 -5.872 11.664 1.00 1.00 C ATOM 1825 SD MET A 122 22.070 -4.399 12.713 1.00 1.00 S ATOM 1826 CE MET A 122 22.414 -3.116 11.470 1.00 1.00 C ATOM 0 H MET A 122 19.672 -4.825 12.794 1.00 1.00 H new ATOM 0 HA MET A 122 18.583 -6.411 10.672 1.00 1.00 H new ATOM 0 HB2 MET A 122 20.849 -6.556 9.933 1.00 1.00 H new ATOM 0 HB3 MET A 122 20.487 -4.901 10.381 1.00 1.00 H new ATOM 0 HG2 MET A 122 21.855 -6.751 12.308 1.00 1.00 H new ATOM 0 HG3 MET A 122 22.755 -5.961 11.029 1.00 1.00 H new ATOM 0 HE1 MET A 122 22.815 -2.230 11.963 1.00 1.00 H new ATOM 0 HE2 MET A 122 23.142 -3.492 10.751 1.00 1.00 H new ATOM 0 HE3 MET A 122 21.492 -2.856 10.950 1.00 1.00 H new ATOM 1836 N LEU A 123 19.362 -8.762 11.129 1.00 1.00 N ATOM 1837 CA LEU A 123 19.557 -10.163 11.458 1.00 1.00 C ATOM 1838 C LEU A 123 21.011 -10.534 11.269 1.00 1.00 C ATOM 1839 O LEU A 123 21.618 -10.150 10.274 1.00 1.00 O ATOM 1840 CB LEU A 123 18.684 -11.016 10.561 1.00 1.00 C ATOM 1841 CG LEU A 123 18.449 -12.463 10.989 1.00 1.00 C ATOM 1842 CD1 LEU A 123 19.637 -13.352 11.206 1.00 1.00 C ATOM 1843 CD2 LEU A 123 17.668 -12.624 12.296 1.00 1.00 C ATOM 0 H LEU A 123 19.148 -8.601 10.145 1.00 1.00 H new ATOM 0 HA LEU A 123 19.281 -10.335 12.498 1.00 1.00 H new ATOM 0 HB2 LEU A 123 17.713 -10.528 10.471 1.00 1.00 H new ATOM 0 HB3 LEU A 123 19.129 -11.026 9.566 1.00 1.00 H new ATOM 0 HG LEU A 123 17.907 -12.773 10.096 1.00 1.00 H new ATOM 0 HD11 LEU A 123 19.299 -14.344 11.506 1.00 1.00 H new ATOM 0 HD12 LEU A 123 20.209 -13.427 10.281 1.00 1.00 H new ATOM 0 HD13 LEU A 123 20.268 -12.932 11.989 1.00 1.00 H new ATOM 0 HD21 LEU A 123 17.549 -13.684 12.521 1.00 1.00 H new ATOM 0 HD22 LEU A 123 18.212 -12.140 13.107 1.00 1.00 H new ATOM 0 HD23 LEU A 123 16.686 -12.163 12.192 1.00 1.00 H new ATOM 1855 N LEU A 124 21.549 -11.304 12.204 1.00 1.00 N ATOM 1856 CA LEU A 124 22.889 -11.860 12.145 1.00 1.00 C ATOM 1857 C LEU A 124 22.839 -13.406 12.245 1.00 1.00 C ATOM 1858 O LEU A 124 22.506 -13.945 13.302 1.00 1.00 O ATOM 1859 CB LEU A 124 23.695 -11.252 13.298 1.00 1.00 C ATOM 1860 CG LEU A 124 23.463 -9.766 13.665 1.00 1.00 C ATOM 1861 CD1 LEU A 124 24.387 -9.405 14.823 1.00 1.00 C ATOM 1862 CD2 LEU A 124 23.693 -8.776 12.527 1.00 1.00 C ATOM 0 H LEU A 124 21.046 -11.566 13.052 1.00 1.00 H new ATOM 0 HA LEU A 124 23.365 -11.619 11.194 1.00 1.00 H new ATOM 0 HB2 LEU A 124 23.497 -11.847 14.189 1.00 1.00 H new ATOM 0 HB3 LEU A 124 24.752 -11.373 13.062 1.00 1.00 H new ATOM 0 HG LEU A 124 22.408 -9.680 13.925 1.00 1.00 H new ATOM 0 HD11 LEU A 124 24.237 -8.360 15.096 1.00 1.00 H new ATOM 0 HD12 LEU A 124 24.161 -10.040 15.680 1.00 1.00 H new ATOM 0 HD13 LEU A 124 25.424 -9.557 14.522 1.00 1.00 H new ATOM 0 HD21 LEU A 124 23.505 -7.763 12.883 1.00 1.00 H new ATOM 0 HD22 LEU A 124 24.723 -8.854 12.180 1.00 1.00 H new ATOM 0 HD23 LEU A 124 23.015 -9.003 11.705 1.00 1.00 H new ATOM 1874 N ILE A 125 23.125 -14.126 11.155 1.00 1.00 N ATOM 1875 CA ILE A 125 23.143 -15.590 11.094 1.00 1.00 C ATOM 1876 C ILE A 125 24.520 -16.172 11.391 1.00 1.00 C ATOM 1877 O ILE A 125 25.499 -15.801 10.748 1.00 1.00 O ATOM 1878 CB ILE A 125 22.573 -16.082 9.751 1.00 1.00 C ATOM 1879 CG1 ILE A 125 21.053 -16.036 9.791 1.00 1.00 C ATOM 1880 CG2 ILE A 125 22.985 -17.516 9.404 1.00 1.00 C ATOM 1881 CD1 ILE A 125 20.360 -15.414 8.577 1.00 1.00 C ATOM 0 H ILE A 125 23.358 -13.691 10.262 1.00 1.00 H new ATOM 0 HA ILE A 125 22.493 -15.961 11.887 1.00 1.00 H new ATOM 0 HB ILE A 125 22.981 -15.417 8.989 1.00 1.00 H new ATOM 0 HG12 ILE A 125 20.683 -17.054 9.911 1.00 1.00 H new ATOM 0 HG13 ILE A 125 20.751 -15.480 10.679 1.00 1.00 H new ATOM 0 HG21 ILE A 125 22.549 -17.798 8.446 1.00 1.00 H new ATOM 0 HG22 ILE A 125 24.071 -17.577 9.340 1.00 1.00 H new ATOM 0 HG23 ILE A 125 22.628 -18.195 10.179 1.00 1.00 H new ATOM 0 HD11 ILE A 125 19.280 -15.438 8.722 1.00 1.00 H new ATOM 0 HD12 ILE A 125 20.687 -14.381 8.461 1.00 1.00 H new ATOM 0 HD13 ILE A 125 20.618 -15.979 7.681 1.00 1.00 H new ATOM 1893 N ASP A 126 24.561 -17.152 12.293 1.00 1.00 N ATOM 1894 CA ASP A 126 25.770 -17.906 12.636 1.00 1.00 C ATOM 1895 C ASP A 126 25.823 -19.214 11.827 1.00 1.00 C ATOM 1896 O ASP A 126 25.201 -20.213 12.188 1.00 1.00 O ATOM 1897 CB ASP A 126 25.834 -18.218 14.146 1.00 1.00 C ATOM 1898 CG ASP A 126 25.626 -17.040 15.122 1.00 1.00 C ATOM 1899 OD1 ASP A 126 24.469 -16.581 15.285 1.00 1.00 O ATOM 1900 OD2 ASP A 126 26.588 -16.663 15.832 1.00 1.00 O1- ATOM 0 H ASP A 126 23.739 -17.451 12.817 1.00 1.00 H new ATOM 0 HA ASP A 126 26.632 -17.288 12.384 1.00 1.00 H new ATOM 0 HB2 ASP A 126 25.082 -18.975 14.366 1.00 1.00 H new ATOM 0 HB3 ASP A 126 26.806 -18.664 14.357 1.00 1.00 H new ATOM 1905 N ALA A 127 26.574 -19.255 10.724 1.00 1.00 N ATOM 1906 CA ALA A 127 26.601 -20.425 9.834 1.00 1.00 C ATOM 1907 C ALA A 127 27.313 -21.627 10.475 1.00 1.00 C ATOM 1908 O ALA A 127 27.058 -22.791 10.161 1.00 1.00 O ATOM 1909 CB ALA A 127 27.269 -20.029 8.518 1.00 1.00 C ATOM 0 H ALA A 127 27.176 -18.489 10.422 1.00 1.00 H new ATOM 0 HA ALA A 127 25.575 -20.742 9.647 1.00 1.00 H new ATOM 0 HB1 ALA A 127 27.295 -20.890 7.850 1.00 1.00 H new ATOM 0 HB2 ALA A 127 26.703 -19.223 8.051 1.00 1.00 H new ATOM 0 HB3 ALA A 127 28.287 -19.691 8.714 1.00 1.00 H new ATOM 1915 N SER A 128 28.177 -21.294 11.424 1.00 1.00 N ATOM 1916 CA SER A 128 28.878 -22.127 12.391 1.00 1.00 C ATOM 1917 C SER A 128 27.960 -23.028 13.223 1.00 1.00 C ATOM 1918 O SER A 128 28.367 -24.112 13.643 1.00 1.00 O ATOM 1919 CB SER A 128 29.555 -21.164 13.378 1.00 1.00 C ATOM 1920 OG SER A 128 28.959 -19.867 13.401 1.00 1.00 O ATOM 0 H SER A 128 28.434 -20.315 11.549 1.00 1.00 H new ATOM 0 HA SER A 128 29.557 -22.775 11.837 1.00 1.00 H new ATOM 0 HB2 SER A 128 29.514 -21.593 14.379 1.00 1.00 H new ATOM 0 HB3 SER A 128 30.609 -21.067 13.116 1.00 1.00 H new ATOM 0 HG SER A 128 29.283 -19.372 14.182 1.00 1.00 H new ATOM 1926 N GLU A 129 26.733 -22.571 13.469 1.00 1.00 N ATOM 1927 CA GLU A 129 25.764 -23.142 14.396 1.00 1.00 C ATOM 1928 C GLU A 129 24.433 -23.460 13.709 1.00 1.00 C ATOM 1929 O GLU A 129 23.704 -24.358 14.135 1.00 1.00 O ATOM 1930 CB GLU A 129 25.522 -22.150 15.546 1.00 1.00 C ATOM 1931 CG GLU A 129 26.692 -22.030 16.531 1.00 1.00 C ATOM 1932 CD GLU A 129 26.827 -23.279 17.424 1.00 1.00 C ATOM 1933 OE1 GLU A 129 26.019 -23.446 18.370 1.00 1.00 O1- ATOM 1934 OE2 GLU A 129 27.751 -24.101 17.203 1.00 1.00 O ATOM 0 H GLU A 129 26.370 -21.743 12.997 1.00 1.00 H new ATOM 0 HA GLU A 129 26.172 -24.078 14.776 1.00 1.00 H new ATOM 0 HB2 GLU A 129 25.314 -21.166 15.125 1.00 1.00 H new ATOM 0 HB3 GLU A 129 24.631 -22.457 16.094 1.00 1.00 H new ATOM 0 HG2 GLU A 129 27.618 -21.879 15.977 1.00 1.00 H new ATOM 0 HG3 GLU A 129 26.549 -21.150 17.158 1.00 1.00 H new ATOM 1941 N ASN A 130 24.130 -22.725 12.636 1.00 1.00 N ATOM 1942 CA ASN A 130 22.908 -22.833 11.854 1.00 1.00 C ATOM 1943 C ASN A 130 23.190 -22.651 10.344 1.00 1.00 C ATOM 1944 O ASN A 130 22.973 -21.562 9.805 1.00 1.00 O ATOM 1945 CB ASN A 130 21.861 -21.842 12.410 1.00 1.00 C ATOM 1946 CG ASN A 130 20.466 -22.158 11.893 1.00 1.00 C ATOM 1947 OD1 ASN A 130 19.641 -22.749 12.576 1.00 1.00 O ATOM 1948 ND2 ASN A 130 20.188 -21.819 10.654 1.00 1.00 N ATOM 0 H ASN A 130 24.761 -22.009 12.278 1.00 1.00 H new ATOM 0 HA ASN A 130 22.493 -23.836 11.949 1.00 1.00 H new ATOM 0 HB2 ASN A 130 21.864 -21.881 13.499 1.00 1.00 H new ATOM 0 HB3 ASN A 130 22.134 -20.825 12.126 1.00 1.00 H new ATOM 0 HD21 ASN A 130 19.278 -22.049 10.254 1.00 1.00 H new ATOM 0 HD22 ASN A 130 20.882 -21.326 10.092 1.00 1.00 H new ATOM 1955 N PRO A 131 23.615 -23.707 9.622 1.00 1.00 N ATOM 1956 CA PRO A 131 23.854 -23.669 8.173 1.00 1.00 C ATOM 1957 C PRO A 131 22.560 -23.688 7.323 1.00 1.00 C ATOM 1958 O PRO A 131 22.612 -23.871 6.108 1.00 1.00 O ATOM 1959 CB PRO A 131 24.780 -24.858 7.903 1.00 1.00 C ATOM 1960 CG PRO A 131 24.298 -25.883 8.924 1.00 1.00 C ATOM 1961 CD PRO A 131 23.940 -25.031 10.140 1.00 1.00 C ATOM 0 HA PRO A 131 24.310 -22.726 7.871 1.00 1.00 H new ATOM 0 HB2 PRO A 131 24.683 -25.225 6.881 1.00 1.00 H new ATOM 0 HB3 PRO A 131 25.828 -24.599 8.051 1.00 1.00 H new ATOM 0 HG2 PRO A 131 23.437 -26.441 8.557 1.00 1.00 H new ATOM 0 HG3 PRO A 131 25.074 -26.612 9.159 1.00 1.00 H new ATOM 0 HD2 PRO A 131 23.094 -25.457 10.680 1.00 1.00 H new ATOM 0 HD3 PRO A 131 24.773 -24.982 10.841 1.00 1.00 H new ATOM 1969 N GLU A 132 21.397 -23.479 7.955 1.00 1.00 N ATOM 1970 CA GLU A 132 20.064 -23.341 7.364 1.00 1.00 C ATOM 1971 C GLU A 132 19.592 -21.888 7.496 1.00 1.00 C ATOM 1972 O GLU A 132 18.653 -21.604 8.229 1.00 1.00 O ATOM 1973 CB GLU A 132 19.090 -24.344 8.025 1.00 1.00 C ATOM 1974 CG GLU A 132 19.693 -25.729 8.277 1.00 1.00 C ATOM 1975 CD GLU A 132 18.605 -26.752 8.658 1.00 1.00 C ATOM 1976 OE1 GLU A 132 18.014 -27.385 7.747 1.00 1.00 O ATOM 1977 OE2 GLU A 132 18.341 -26.952 9.869 1.00 1.00 O1- ATOM 0 H GLU A 132 21.364 -23.396 8.971 1.00 1.00 H new ATOM 0 HA GLU A 132 20.096 -23.578 6.301 1.00 1.00 H new ATOM 0 HB2 GLU A 132 18.748 -23.930 8.974 1.00 1.00 H new ATOM 0 HB3 GLU A 132 18.211 -24.453 7.390 1.00 1.00 H new ATOM 0 HG2 GLU A 132 20.217 -26.068 7.383 1.00 1.00 H new ATOM 0 HG3 GLU A 132 20.432 -25.666 9.076 1.00 1.00 H new ATOM 1984 N PRO A 133 20.234 -20.908 6.841 1.00 1.00 N ATOM 1985 CA PRO A 133 19.986 -19.492 7.107 1.00 1.00 C ATOM 1986 C PRO A 133 18.559 -18.993 6.916 1.00 1.00 C ATOM 1987 O PRO A 133 18.196 -17.956 7.471 1.00 1.00 O ATOM 1988 CB PRO A 133 20.942 -18.764 6.157 1.00 1.00 C ATOM 1989 CG PRO A 133 21.175 -19.756 5.022 1.00 1.00 C ATOM 1990 CD PRO A 133 21.265 -21.043 5.826 1.00 1.00 C ATOM 0 HA PRO A 133 20.149 -19.302 8.168 1.00 1.00 H new ATOM 0 HB2 PRO A 133 20.506 -17.835 5.790 1.00 1.00 H new ATOM 0 HB3 PRO A 133 21.876 -18.503 6.655 1.00 1.00 H new ATOM 0 HG2 PRO A 133 20.357 -19.768 4.302 1.00 1.00 H new ATOM 0 HG3 PRO A 133 22.087 -19.547 4.464 1.00 1.00 H new ATOM 0 HD2 PRO A 133 21.092 -21.917 5.198 1.00 1.00 H new ATOM 0 HD3 PRO A 133 22.251 -21.163 6.275 1.00 1.00 H new ATOM 1998 N GLU A 134 17.719 -19.713 6.177 1.00 1.00 N ATOM 1999 CA GLU A 134 16.303 -19.373 6.055 1.00 1.00 C ATOM 2000 C GLU A 134 15.568 -19.509 7.385 1.00 1.00 C ATOM 2001 O GLU A 134 14.641 -18.751 7.638 1.00 1.00 O ATOM 2002 CB GLU A 134 15.647 -20.206 4.939 1.00 1.00 C ATOM 2003 CG GLU A 134 15.656 -21.722 5.223 1.00 1.00 C ATOM 2004 CD GLU A 134 14.900 -22.547 4.159 1.00 1.00 C ATOM 2005 OE1 GLU A 134 13.747 -22.203 3.808 1.00 1.00 O1- ATOM 2006 OE2 GLU A 134 15.446 -23.579 3.699 1.00 1.00 O ATOM 0 H GLU A 134 17.996 -20.541 5.650 1.00 1.00 H new ATOM 0 HA GLU A 134 16.229 -18.322 5.775 1.00 1.00 H new ATOM 0 HB2 GLU A 134 14.617 -19.875 4.805 1.00 1.00 H new ATOM 0 HB3 GLU A 134 16.167 -20.016 4.000 1.00 1.00 H new ATOM 0 HG2 GLU A 134 16.688 -22.069 5.276 1.00 1.00 H new ATOM 0 HG3 GLU A 134 15.208 -21.904 6.200 1.00 1.00 H new ATOM 2013 N THR A 135 16.008 -20.389 8.285 1.00 1.00 N ATOM 2014 CA THR A 135 15.302 -20.659 9.542 1.00 1.00 C ATOM 2015 C THR A 135 15.398 -19.487 10.522 1.00 1.00 C ATOM 2016 O THR A 135 14.549 -19.315 11.398 1.00 1.00 O ATOM 2017 CB THR A 135 15.817 -21.950 10.193 1.00 1.00 C ATOM 2018 OG1 THR A 135 17.117 -21.782 10.711 1.00 1.00 O ATOM 2019 CG2 THR A 135 15.867 -23.108 9.196 1.00 1.00 C ATOM 0 H THR A 135 16.862 -20.935 8.166 1.00 1.00 H new ATOM 0 HA THR A 135 14.249 -20.789 9.294 1.00 1.00 H new ATOM 0 HB THR A 135 15.116 -22.180 10.995 1.00 1.00 H new ATOM 0 HG1 THR A 135 17.417 -22.620 11.120 1.00 1.00 H new ATOM 0 HG21 THR A 135 16.237 -24.003 9.696 1.00 1.00 H new ATOM 0 HG22 THR A 135 14.866 -23.297 8.807 1.00 1.00 H new ATOM 0 HG23 THR A 135 16.534 -22.851 8.373 1.00 1.00 H new ATOM 2027 N GLU A 136 16.418 -18.653 10.315 1.00 1.00 N ATOM 2028 CA GLU A 136 16.702 -17.435 11.081 1.00 1.00 C ATOM 2029 C GLU A 136 16.141 -16.200 10.389 1.00 1.00 C ATOM 2030 O GLU A 136 15.382 -15.421 10.962 1.00 1.00 O ATOM 2031 CB GLU A 136 18.212 -17.240 11.240 1.00 1.00 C ATOM 2032 CG GLU A 136 18.948 -18.431 11.832 1.00 1.00 C ATOM 2033 CD GLU A 136 18.923 -18.450 13.374 1.00 1.00 C ATOM 2034 OE1 GLU A 136 17.824 -18.449 13.980 1.00 1.00 O1- ATOM 2035 OE2 GLU A 136 20.015 -18.461 13.992 1.00 1.00 O ATOM 0 H GLU A 136 17.101 -18.814 9.575 1.00 1.00 H new ATOM 0 HA GLU A 136 16.228 -17.555 12.055 1.00 1.00 H new ATOM 0 HB2 GLU A 136 18.640 -17.015 10.263 1.00 1.00 H new ATOM 0 HB3 GLU A 136 18.388 -16.370 11.873 1.00 1.00 H new ATOM 0 HG2 GLU A 136 18.501 -19.351 11.456 1.00 1.00 H new ATOM 0 HG3 GLU A 136 19.983 -18.417 11.491 1.00 1.00 H new ATOM 2042 N SER A 137 16.529 -16.023 9.125 1.00 1.00 N ATOM 2043 CA SER A 137 16.107 -14.851 8.348 1.00 1.00 C ATOM 2044 C SER A 137 14.622 -14.817 8.004 1.00 1.00 C ATOM 2045 O SER A 137 14.054 -13.739 7.920 1.00 1.00 O ATOM 2046 CB SER A 137 16.858 -14.774 7.040 1.00 1.00 C ATOM 2047 OG SER A 137 16.555 -15.943 6.299 1.00 1.00 O ATOM 0 H SER A 137 17.131 -16.671 8.618 1.00 1.00 H new ATOM 0 HA SER A 137 16.327 -14.008 9.002 1.00 1.00 H new ATOM 0 HB2 SER A 137 16.567 -13.883 6.484 1.00 1.00 H new ATOM 0 HB3 SER A 137 17.931 -14.702 7.219 1.00 1.00 H new ATOM 0 HG SER A 137 17.173 -16.660 6.553 1.00 1.00 H new ATOM 2053 N ASN A 138 13.955 -15.947 7.781 1.00 1.00 N ATOM 2054 CA ASN A 138 12.562 -15.923 7.313 1.00 1.00 C ATOM 2055 C ASN A 138 11.586 -15.341 8.355 1.00 1.00 C ATOM 2056 O ASN A 138 10.885 -14.386 8.010 1.00 1.00 O ATOM 2057 CB ASN A 138 12.123 -17.299 6.807 1.00 1.00 C ATOM 2058 CG ASN A 138 12.722 -17.720 5.471 1.00 1.00 C ATOM 2059 OD1 ASN A 138 12.157 -18.555 4.784 1.00 1.00 O ATOM 2060 ND2 ASN A 138 13.846 -17.189 5.019 1.00 1.00 N ATOM 0 H ASN A 138 14.345 -16.880 7.913 1.00 1.00 H new ATOM 0 HA ASN A 138 12.526 -15.237 6.467 1.00 1.00 H new ATOM 0 HB2 ASN A 138 12.387 -18.045 7.557 1.00 1.00 H new ATOM 0 HB3 ASN A 138 11.037 -17.306 6.718 1.00 1.00 H new ATOM 0 HD21 ASN A 138 14.220 -17.480 4.116 1.00 1.00 H new ATOM 0 HD22 ASN A 138 14.338 -16.489 5.574 1.00 1.00 H new ATOM 2067 N PRO A 139 11.580 -15.780 9.633 1.00 1.00 N ATOM 2068 CA PRO A 139 10.791 -15.091 10.661 1.00 1.00 C ATOM 2069 C PRO A 139 11.271 -13.650 10.906 1.00 1.00 C ATOM 2070 O PRO A 139 10.478 -12.805 11.318 1.00 1.00 O ATOM 2071 CB PRO A 139 10.926 -15.945 11.925 1.00 1.00 C ATOM 2072 CG PRO A 139 12.288 -16.602 11.744 1.00 1.00 C ATOM 2073 CD PRO A 139 12.333 -16.879 10.244 1.00 1.00 C ATOM 0 HA PRO A 139 9.752 -14.991 10.346 1.00 1.00 H new ATOM 0 HB2 PRO A 139 10.887 -15.338 12.829 1.00 1.00 H new ATOM 0 HB3 PRO A 139 10.128 -16.683 12.002 1.00 1.00 H new ATOM 0 HG2 PRO A 139 13.099 -15.945 12.059 1.00 1.00 H new ATOM 0 HG3 PRO A 139 12.376 -17.519 12.327 1.00 1.00 H new ATOM 0 HD2 PRO A 139 13.359 -16.906 9.878 1.00 1.00 H new ATOM 0 HD3 PRO A 139 11.885 -17.844 10.007 1.00 1.00 H new ATOM 2081 N TRP A 140 12.536 -13.334 10.589 1.00 1.00 N ATOM 2082 CA TRP A 140 13.074 -11.983 10.691 1.00 1.00 C ATOM 2083 C TRP A 140 12.475 -11.084 9.632 1.00 1.00 C ATOM 2084 O TRP A 140 12.021 -9.997 9.952 1.00 1.00 O ATOM 2085 CB TRP A 140 14.600 -11.936 10.593 1.00 1.00 C ATOM 2086 CG TRP A 140 15.137 -10.532 10.713 1.00 1.00 C ATOM 2087 CD1 TRP A 140 15.468 -9.912 11.868 1.00 1.00 C ATOM 2088 CD2 TRP A 140 15.302 -9.513 9.672 1.00 1.00 C ATOM 2089 NE1 TRP A 140 15.979 -8.658 11.594 1.00 1.00 N ATOM 2090 CE2 TRP A 140 15.798 -8.318 10.272 1.00 1.00 C ATOM 2091 CE3 TRP A 140 15.043 -9.458 8.288 1.00 1.00 C ATOM 2092 CZ2 TRP A 140 16.002 -7.135 9.546 1.00 1.00 C ATOM 2093 CZ3 TRP A 140 15.203 -8.267 7.551 1.00 1.00 C ATOM 2094 CH2 TRP A 140 15.688 -7.108 8.178 1.00 1.00 C ATOM 0 H TRP A 140 13.213 -14.019 10.253 1.00 1.00 H new ATOM 0 HA TRP A 140 12.798 -11.624 11.682 1.00 1.00 H new ATOM 0 HB2 TRP A 140 15.032 -12.556 11.378 1.00 1.00 H new ATOM 0 HB3 TRP A 140 14.914 -12.363 9.641 1.00 1.00 H new ATOM 0 HD1 TRP A 140 15.351 -10.333 12.855 1.00 1.00 H new ATOM 0 HE1 TRP A 140 16.433 -8.060 12.284 1.00 1.00 H new ATOM 0 HE3 TRP A 140 14.713 -10.351 7.779 1.00 1.00 H new ATOM 0 HZ2 TRP A 140 16.396 -6.256 10.034 1.00 1.00 H new ATOM 0 HZ3 TRP A 140 14.952 -8.246 6.501 1.00 1.00 H new ATOM 0 HH2 TRP A 140 15.819 -6.199 7.610 1.00 1.00 H new ATOM 2105 N VAL A 141 12.417 -11.553 8.387 1.00 1.00 N ATOM 2106 CA VAL A 141 11.836 -10.783 7.287 1.00 1.00 C ATOM 2107 C VAL A 141 10.338 -10.600 7.518 1.00 1.00 C ATOM 2108 O VAL A 141 9.798 -9.548 7.205 1.00 1.00 O ATOM 2109 CB VAL A 141 12.090 -11.407 5.909 1.00 1.00 C ATOM 2110 CG1 VAL A 141 11.356 -10.519 4.873 1.00 1.00 C ATOM 2111 CG2 VAL A 141 13.563 -11.600 5.477 1.00 1.00 C ATOM 0 H VAL A 141 12.768 -12.470 8.113 1.00 1.00 H new ATOM 0 HA VAL A 141 12.335 -9.814 7.281 1.00 1.00 H new ATOM 0 HB VAL A 141 11.716 -12.429 5.968 1.00 1.00 H new ATOM 0 HG11 VAL A 141 11.508 -10.925 3.873 1.00 1.00 H new ATOM 0 HG12 VAL A 141 10.290 -10.502 5.099 1.00 1.00 H new ATOM 0 HG13 VAL A 141 11.753 -9.505 4.917 1.00 1.00 H new ATOM 0 HG21 VAL A 141 13.595 -12.050 4.485 1.00 1.00 H new ATOM 0 HG22 VAL A 141 14.065 -10.633 5.454 1.00 1.00 H new ATOM 0 HG23 VAL A 141 14.068 -12.254 6.188 1.00 1.00 H new ATOM 2121 N GLU A 142 9.654 -11.578 8.103 1.00 1.00 N ATOM 2122 CA GLU A 142 8.251 -11.438 8.468 1.00 1.00 C ATOM 2123 C GLU A 142 8.090 -10.338 9.526 1.00 1.00 C ATOM 2124 O GLU A 142 7.307 -9.415 9.334 1.00 1.00 O ATOM 2125 CB GLU A 142 7.701 -12.807 8.922 1.00 1.00 C ATOM 2126 CG GLU A 142 6.582 -13.349 8.038 1.00 1.00 C ATOM 2127 CD GLU A 142 5.777 -14.435 8.777 1.00 1.00 C ATOM 2128 OE1 GLU A 142 4.788 -14.089 9.470 1.00 1.00 O ATOM 2129 OE2 GLU A 142 6.125 -15.637 8.674 1.00 1.00 O1- ATOM 0 H GLU A 142 10.056 -12.486 8.336 1.00 1.00 H new ATOM 0 HA GLU A 142 7.661 -11.125 7.607 1.00 1.00 H new ATOM 0 HB2 GLU A 142 8.518 -13.528 8.939 1.00 1.00 H new ATOM 0 HB3 GLU A 142 7.332 -12.718 9.944 1.00 1.00 H new ATOM 0 HG2 GLU A 142 5.919 -12.536 7.744 1.00 1.00 H new ATOM 0 HG3 GLU A 142 7.004 -13.763 7.122 1.00 1.00 H new ATOM 2136 N HIS A 143 8.905 -10.371 10.580 1.00 1.00 N ATOM 2137 CA HIS A 143 8.896 -9.398 11.670 1.00 1.00 C ATOM 2138 C HIS A 143 9.267 -7.995 11.179 1.00 1.00 C ATOM 2139 O HIS A 143 8.476 -7.066 11.309 1.00 1.00 O ATOM 2140 CB HIS A 143 9.825 -9.876 12.796 1.00 1.00 C ATOM 2141 CG HIS A 143 9.975 -8.864 13.904 1.00 1.00 C ATOM 2142 ND1 HIS A 143 9.040 -8.566 14.871 1.00 1.00 N ATOM 2143 CD2 HIS A 143 11.050 -8.038 14.118 1.00 1.00 C ATOM 2144 CE1 HIS A 143 9.539 -7.588 15.647 1.00 1.00 C ATOM 2145 NE2 HIS A 143 10.767 -7.230 15.227 1.00 1.00 N ATOM 0 H HIS A 143 9.610 -11.098 10.702 1.00 1.00 H new ATOM 0 HA HIS A 143 7.883 -9.325 12.066 1.00 1.00 H new ATOM 0 HB2 HIS A 143 9.436 -10.806 13.211 1.00 1.00 H new ATOM 0 HB3 HIS A 143 10.807 -10.099 12.379 1.00 1.00 H new ATOM 0 HD2 HIS A 143 11.957 -8.015 13.533 1.00 1.00 H new ATOM 0 HE1 HIS A 143 9.026 -7.150 16.490 1.00 1.00 H new ATOM 0 HE2 HIS A 143 11.370 -6.515 15.634 1.00 1.00 H new ATOM 2153 N TRP A 144 10.426 -7.857 10.538 1.00 1.00 N ATOM 2154 CA TRP A 144 10.910 -6.633 9.908 1.00 1.00 C ATOM 2155 C TRP A 144 9.943 -6.118 8.842 1.00 1.00 C ATOM 2156 O TRP A 144 9.723 -4.919 8.745 1.00 1.00 O ATOM 2157 CB TRP A 144 12.294 -6.893 9.300 1.00 1.00 C ATOM 2158 CG TRP A 144 12.861 -5.715 8.576 1.00 1.00 C ATOM 2159 CD1 TRP A 144 13.518 -4.691 9.157 1.00 1.00 C ATOM 2160 CD2 TRP A 144 12.841 -5.426 7.145 1.00 1.00 C ATOM 2161 NE1 TRP A 144 13.877 -3.778 8.191 1.00 1.00 N ATOM 2162 CE2 TRP A 144 13.437 -4.154 6.938 1.00 1.00 C ATOM 2163 CE3 TRP A 144 12.388 -6.112 6.000 1.00 1.00 C ATOM 2164 CZ2 TRP A 144 13.539 -3.567 5.666 1.00 1.00 C ATOM 2165 CZ3 TRP A 144 12.560 -5.571 4.708 1.00 1.00 C ATOM 2166 CH2 TRP A 144 13.118 -4.293 4.540 1.00 1.00 C ATOM 0 H TRP A 144 11.082 -8.632 10.440 1.00 1.00 H new ATOM 0 HA TRP A 144 10.981 -5.859 10.672 1.00 1.00 H new ATOM 0 HB2 TRP A 144 12.981 -7.186 10.094 1.00 1.00 H new ATOM 0 HB3 TRP A 144 12.226 -7.734 8.610 1.00 1.00 H new ATOM 0 HD1 TRP A 144 13.729 -4.601 10.212 1.00 1.00 H new ATOM 0 HE1 TRP A 144 14.405 -2.926 8.379 1.00 1.00 H new ATOM 0 HE3 TRP A 144 11.900 -7.069 6.114 1.00 1.00 H new ATOM 0 HZ2 TRP A 144 13.937 -2.569 5.555 1.00 1.00 H new ATOM 0 HZ3 TRP A 144 12.261 -6.144 3.843 1.00 1.00 H new ATOM 0 HH2 TRP A 144 13.223 -3.871 3.551 1.00 1.00 H new ATOM 2177 N GLY A 145 9.278 -7.017 8.116 1.00 1.00 N ATOM 2178 CA GLY A 145 8.204 -6.717 7.171 1.00 1.00 C ATOM 2179 C GLY A 145 7.091 -5.845 7.757 1.00 1.00 C ATOM 2180 O GLY A 145 6.564 -4.979 7.065 1.00 1.00 O ATOM 0 H GLY A 145 9.482 -8.015 8.173 1.00 1.00 H new ATOM 0 HA2 GLY A 145 8.628 -6.214 6.302 1.00 1.00 H new ATOM 0 HA3 GLY A 145 7.771 -7.653 6.818 1.00 1.00 H new ATOM 2184 N THR A 146 6.791 -5.978 9.053 1.00 1.00 N ATOM 2185 CA THR A 146 5.816 -5.136 9.747 1.00 1.00 C ATOM 2186 C THR A 146 6.256 -3.679 9.958 1.00 1.00 C ATOM 2187 O THR A 146 5.421 -2.826 10.272 1.00 1.00 O ATOM 2188 CB THR A 146 5.407 -5.769 11.087 1.00 1.00 C ATOM 2189 OG1 THR A 146 6.398 -5.610 12.072 1.00 1.00 O ATOM 2190 CG2 THR A 146 5.073 -7.267 11.001 1.00 1.00 C ATOM 0 H THR A 146 7.223 -6.680 9.654 1.00 1.00 H new ATOM 0 HA THR A 146 4.957 -5.087 9.078 1.00 1.00 H new ATOM 0 HB THR A 146 4.501 -5.228 11.360 1.00 1.00 H new ATOM 0 HG1 THR A 146 7.243 -5.987 11.750 1.00 1.00 H new ATOM 0 HG21 THR A 146 4.795 -7.635 11.989 1.00 1.00 H new ATOM 0 HG22 THR A 146 4.242 -7.416 10.311 1.00 1.00 H new ATOM 0 HG23 THR A 146 5.945 -7.814 10.642 1.00 1.00 H new ATOM 2198 N LEU A 147 7.539 -3.366 9.744 1.00 1.00 N ATOM 2199 CA LEU A 147 8.111 -2.032 9.825 1.00 1.00 C ATOM 2200 C LEU A 147 7.900 -1.237 8.523 1.00 1.00 C ATOM 2201 O LEU A 147 8.048 -0.011 8.544 1.00 1.00 O ATOM 2202 CB LEU A 147 9.614 -2.113 10.163 1.00 1.00 C ATOM 2203 CG LEU A 147 10.057 -2.703 11.527 1.00 1.00 C ATOM 2204 CD1 LEU A 147 10.144 -1.595 12.581 1.00 1.00 C ATOM 2205 CD2 LEU A 147 9.211 -3.819 12.146 1.00 1.00 C ATOM 0 H LEU A 147 8.232 -4.073 9.499 1.00 1.00 H new ATOM 0 HA LEU A 147 7.592 -1.501 10.623 1.00 1.00 H new ATOM 0 HB2 LEU A 147 10.094 -2.701 9.381 1.00 1.00 H new ATOM 0 HB3 LEU A 147 10.019 -1.103 10.096 1.00 1.00 H new ATOM 0 HG LEU A 147 11.011 -3.161 11.267 1.00 1.00 H new ATOM 0 HD11 LEU A 147 10.456 -2.023 13.534 1.00 1.00 H new ATOM 0 HD12 LEU A 147 10.871 -0.847 12.264 1.00 1.00 H new ATOM 0 HD13 LEU A 147 9.167 -1.125 12.697 1.00 1.00 H new ATOM 0 HD21 LEU A 147 9.650 -4.124 13.096 1.00 1.00 H new ATOM 0 HD22 LEU A 147 8.197 -3.456 12.315 1.00 1.00 H new ATOM 0 HD23 LEU A 147 9.183 -4.672 11.469 1.00 1.00 H new ATOM 2217 N LEU A 148 7.577 -1.901 7.401 1.00 1.00 N ATOM 2218 CA LEU A 148 7.352 -1.254 6.120 1.00 1.00 C ATOM 2219 C LEU A 148 5.952 -0.596 6.073 1.00 1.00 C ATOM 2220 O LEU A 148 5.114 -0.813 6.959 1.00 1.00 O ATOM 2221 CB LEU A 148 7.513 -2.297 5.004 1.00 1.00 C ATOM 2222 CG LEU A 148 8.932 -2.809 4.719 1.00 1.00 C ATOM 2223 CD1 LEU A 148 9.782 -1.786 3.979 1.00 1.00 C ATOM 2224 CD2 LEU A 148 9.734 -3.293 5.917 1.00 1.00 C ATOM 0 H LEU A 148 7.466 -2.914 7.369 1.00 1.00 H new ATOM 0 HA LEU A 148 8.085 -0.460 5.978 1.00 1.00 H new ATOM 0 HB2 LEU A 148 6.888 -3.155 5.251 1.00 1.00 H new ATOM 0 HB3 LEU A 148 7.117 -1.869 4.083 1.00 1.00 H new ATOM 0 HG LEU A 148 8.727 -3.682 4.100 1.00 1.00 H new ATOM 0 HD11 LEU A 148 10.776 -2.198 3.802 1.00 1.00 H new ATOM 0 HD12 LEU A 148 9.314 -1.546 3.024 1.00 1.00 H new ATOM 0 HD13 LEU A 148 9.866 -0.880 4.580 1.00 1.00 H new ATOM 0 HD21 LEU A 148 10.717 -3.628 5.585 1.00 1.00 H new ATOM 0 HD22 LEU A 148 9.851 -2.477 6.630 1.00 1.00 H new ATOM 0 HD23 LEU A 148 9.210 -4.121 6.395 1.00 1.00 H new ATOM 2236 N SER A 149 5.698 0.181 5.012 1.00 1.00 N ATOM 2237 CA SER A 149 4.495 1.009 4.829 1.00 1.00 C ATOM 2238 C SER A 149 3.807 0.852 3.465 1.00 1.00 C ATOM 2239 O SER A 149 3.924 1.747 2.598 1.00 1.00 O ATOM 2240 CB SER A 149 4.785 2.479 5.159 1.00 1.00 C ATOM 2241 OG SER A 149 5.204 2.606 6.514 1.00 1.00 O ATOM 2242 OXT SER A 149 3.099 -0.162 3.268 1.00 1.00 O1- ATOM 0 H SER A 149 6.347 0.254 4.228 1.00 1.00 H new ATOM 0 HA SER A 149 3.767 0.627 5.544 1.00 1.00 H new ATOM 0 HB2 SER A 149 5.559 2.863 4.494 1.00 1.00 H new ATOM 0 HB3 SER A 149 3.892 3.080 4.989 1.00 1.00 H new ATOM 0 HG SER A 149 5.388 3.548 6.713 1.00 1.00 H new TER 2248 SER A 149