USER MOD reduce.3.24.130724 H: found=0, std=0, add=1123, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1123 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 85 TYR OH : rot 30:sc= 0 USER MOD Set 1.2: A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 41 GLN : amide:sc= -2.06! C(o=-2.1!,f=-7!) USER MOD Set 2.2: A 42 THR OG1 : rot 180:sc= -0.0581 USER MOD Set 3.1: A 30 THR OG1 : rot 71:sc= -5.2! USER MOD Set 3.2: A 63 ASN : amide:sc= 0.177 X(o=-5,f=-5.4) USER MOD Set 4.1: A 29 TYR OH : rot 148:sc= 0.913 USER MOD Set 4.2: A 53 SER OG : rot 110:sc= -0.0999 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -128:sc= -1.62 (180deg=-4.39!) USER MOD Single : A 8 GLN : amide:sc= -1.54 K(o=-1.5,f=-5!) USER MOD Single : A 10 SER OG : rot -170:sc= -1.53! USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN :FLIP amide:sc= -0.0249 F(o=-0.71,f=-0.025) USER MOD Single : A 20 LYS NZ :NH3+ -178:sc= -0.7 (180deg=-0.73) USER MOD Single : A 22 SER OG : rot 95:sc= 1.13 USER MOD Single : A 25 CYS SG : rot 60:sc= -4.8! USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= -0.0433 (180deg=-0.42) USER MOD Single : A 37 HIS :FLIP no HD1:sc= -11.9! C(o=-14!,f=-12!) USER MOD Single : A 45 GLN : amide:sc= -6.17! C(o=-6.2!,f=-8!) USER MOD Single : A 46 ASN : amide:sc= -1.91! C(o=-1.9!,f=-2.9!) USER MOD Single : A 48 CYS SG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot -37:sc= 0.893 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= -1.39 USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 72 SER OG : rot 180:sc= 0.0108 USER MOD Single : A 74 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.011) USER MOD Single : A 77 GLN : amide:sc= -0.0579 X(o=-0.058,f=0) USER MOD Single : A 79 GLN : amide:sc= -0.0179 X(o=-0.018,f=-0.24) USER MOD Single : A 80 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 101 MET CE :methyl -121:sc= -0.151 (180deg=-3.52!) USER MOD Single : A 104 ASN : amide:sc= -0.267 K(o=-0.27,f=-3!) USER MOD Single : A 107 CYS SG : rot 110:sc= -1.02 USER MOD Single : A 111 LYS NZ :NH3+ -127:sc= 0.523 (180deg=0) USER MOD Single : A 117 HIS :FLIP no HD1:sc= -0.251 F(o=-1,f=-0.25) USER MOD Single : A 122 MET CE :methyl 138:sc= -1.42 (180deg=-1.99) USER MOD Single : A 124 CYS SG : rot -32:sc= -0.239 USER MOD Single : A 133 GLN : amide:sc= -0.0138 X(o=-0.014,f=0) USER MOD Single : A 134 GLN : amide:sc= 0.173 X(o=0.17,f=-0.0039) USER MOD Single : A 140 GLN : amide:sc= -0.686 X(o=-0.69,f=-0.74) USER MOD Single : A 141 GLN : amide:sc= 0.983 K(o=0.98,f=-0.26) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.050 -0.251 -24.941 1.00 0.00 N ATOM 2 CA MET A 1 -1.918 -1.217 -24.848 1.00 0.00 C ATOM 3 C MET A 1 -0.950 -0.840 -23.726 1.00 0.00 C ATOM 4 O MET A 1 -0.740 -1.616 -22.794 1.00 0.00 O ATOM 5 CB MET A 1 -1.183 -1.253 -26.192 1.00 0.00 C ATOM 6 CG MET A 1 -1.732 -2.295 -27.155 1.00 0.00 C ATOM 7 SD MET A 1 -1.951 -1.655 -28.826 1.00 0.00 S ATOM 8 CE MET A 1 -3.705 -1.929 -29.067 1.00 0.00 C ATOM 0 H1 MET A 1 -3.951 -0.770 -24.928 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.015 0.403 -24.133 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.974 0.288 -25.827 1.00 0.00 H new ATOM 0 HA MET A 1 -2.319 -2.204 -24.615 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.246 -0.270 -26.658 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.127 -1.454 -26.014 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.055 -3.149 -27.184 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.689 -2.659 -26.782 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.994 -1.583 -30.059 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.923 -2.993 -28.976 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.266 -1.378 -28.313 1.00 0.00 H new ATOM 20 N PRO A 2 -0.343 0.359 -23.798 1.00 0.00 N ATOM 21 CA PRO A 2 0.602 0.824 -22.778 1.00 0.00 C ATOM 22 C PRO A 2 -0.091 1.178 -21.467 1.00 0.00 C ATOM 23 O PRO A 2 -1.274 1.519 -21.451 1.00 0.00 O ATOM 24 CB PRO A 2 1.221 2.071 -23.408 1.00 0.00 C ATOM 25 CG PRO A 2 0.183 2.572 -24.352 1.00 0.00 C ATOM 26 CD PRO A 2 -0.531 1.353 -24.871 1.00 0.00 C ATOM 0 HA PRO A 2 1.331 0.056 -22.518 1.00 0.00 H new ATOM 0 HB2 PRO A 2 1.463 2.818 -22.652 1.00 0.00 H new ATOM 0 HB3 PRO A 2 2.148 1.833 -23.929 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -0.511 3.245 -23.848 1.00 0.00 H new ATOM 0 HG3 PRO A 2 0.637 3.135 -25.168 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -1.587 1.553 -25.052 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -0.106 1.010 -25.814 1.00 0.00 H new ATOM 34 N ARG A 3 0.653 1.096 -20.369 1.00 0.00 N ATOM 35 CA ARG A 3 0.107 1.410 -19.054 1.00 0.00 C ATOM 36 C ARG A 3 0.635 2.751 -18.555 1.00 0.00 C ATOM 37 O ARG A 3 -0.132 3.612 -18.126 1.00 0.00 O ATOM 38 CB ARG A 3 0.461 0.310 -18.047 1.00 0.00 C ATOM 39 CG ARG A 3 0.603 -1.072 -18.666 1.00 0.00 C ATOM 40 CD ARG A 3 0.003 -2.150 -17.777 1.00 0.00 C ATOM 41 NE ARG A 3 0.977 -3.185 -17.439 1.00 0.00 N ATOM 42 CZ ARG A 3 1.326 -4.172 -18.263 1.00 0.00 C ATOM 43 NH1 ARG A 3 0.783 -4.260 -19.471 1.00 0.00 N ATOM 44 NH2 ARG A 3 2.219 -5.072 -17.878 1.00 0.00 N ATOM 0 H ARG A 3 1.634 0.815 -20.364 1.00 0.00 H new ATOM 0 HA ARG A 3 -0.977 1.471 -19.148 1.00 0.00 H new ATOM 0 HB2 ARG A 3 1.395 0.573 -17.551 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -0.310 0.275 -17.277 1.00 0.00 H new ATOM 0 HG2 ARG A 3 0.112 -1.087 -19.639 1.00 0.00 H new ATOM 0 HG3 ARG A 3 1.658 -1.287 -18.838 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -0.376 -1.696 -16.861 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -0.849 -2.605 -18.283 1.00 0.00 H new ATOM 0 HE ARG A 3 1.415 -3.150 -16.519 1.00 0.00 H new ATOM 0 HH11 ARG A 3 0.095 -3.570 -19.772 1.00 0.00 H new ATOM 0 HH12 ARG A 3 1.054 -5.018 -20.098 1.00 0.00 H new ATOM 0 HH21 ARG A 3 2.639 -5.009 -16.951 1.00 0.00 H new ATOM 0 HH22 ARG A 3 2.486 -5.828 -18.509 1.00 0.00 H new ATOM 58 N VAL A 4 1.952 2.915 -18.608 1.00 0.00 N ATOM 59 CA VAL A 4 2.589 4.145 -18.155 1.00 0.00 C ATOM 60 C VAL A 4 2.383 5.286 -19.148 1.00 0.00 C ATOM 61 O VAL A 4 2.548 5.114 -20.355 1.00 0.00 O ATOM 62 CB VAL A 4 4.098 3.942 -17.932 1.00 0.00 C ATOM 63 CG1 VAL A 4 4.341 3.039 -16.732 1.00 0.00 C ATOM 64 CG2 VAL A 4 4.752 3.367 -19.181 1.00 0.00 C ATOM 0 H VAL A 4 2.600 2.210 -18.961 1.00 0.00 H new ATOM 0 HA VAL A 4 2.116 4.410 -17.209 1.00 0.00 H new ATOM 0 HB VAL A 4 4.551 4.912 -17.728 1.00 0.00 H new ATOM 0 HG11 VAL A 4 5.413 2.906 -16.588 1.00 0.00 H new ATOM 0 HG12 VAL A 4 3.909 3.494 -15.841 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.875 2.069 -16.906 1.00 0.00 H new ATOM 0 HG21 VAL A 4 5.819 3.231 -19.003 1.00 0.00 H new ATOM 0 HG22 VAL A 4 4.298 2.405 -19.419 1.00 0.00 H new ATOM 0 HG23 VAL A 4 4.608 4.053 -20.016 1.00 0.00 H new ATOM 74 N VAL A 5 2.025 6.451 -18.620 1.00 0.00 N ATOM 75 CA VAL A 5 1.798 7.636 -19.439 1.00 0.00 C ATOM 76 C VAL A 5 3.099 8.407 -19.653 1.00 0.00 C ATOM 77 O VAL A 5 3.992 8.366 -18.808 1.00 0.00 O ATOM 78 CB VAL A 5 0.756 8.573 -18.799 1.00 0.00 C ATOM 79 CG1 VAL A 5 -0.603 7.891 -18.728 1.00 0.00 C ATOM 80 CG2 VAL A 5 1.211 9.019 -17.416 1.00 0.00 C ATOM 0 H VAL A 5 1.885 6.600 -17.621 1.00 0.00 H new ATOM 0 HA VAL A 5 1.418 7.291 -20.400 1.00 0.00 H new ATOM 0 HB VAL A 5 0.660 9.460 -19.426 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -1.326 8.568 -18.273 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -0.932 7.631 -19.734 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.525 6.986 -18.126 1.00 0.00 H new ATOM 0 HG21 VAL A 5 0.461 9.680 -16.982 1.00 0.00 H new ATOM 0 HG22 VAL A 5 1.339 8.146 -16.776 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.159 9.551 -17.499 1.00 0.00 H new ATOM 90 N PRO A 6 3.222 9.121 -20.791 1.00 0.00 N ATOM 91 CA PRO A 6 4.412 9.906 -21.123 1.00 0.00 C ATOM 92 C PRO A 6 5.107 10.483 -19.892 1.00 0.00 C ATOM 93 O PRO A 6 6.327 10.390 -19.757 1.00 0.00 O ATOM 94 CB PRO A 6 3.830 11.014 -21.991 1.00 0.00 C ATOM 95 CG PRO A 6 2.696 10.364 -22.720 1.00 0.00 C ATOM 96 CD PRO A 6 2.201 9.228 -21.850 1.00 0.00 C ATOM 0 HA PRO A 6 5.186 9.311 -21.607 1.00 0.00 H new ATOM 0 HB2 PRO A 6 3.484 11.852 -21.386 1.00 0.00 H new ATOM 0 HB3 PRO A 6 4.574 11.407 -22.684 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.897 11.081 -22.908 1.00 0.00 H new ATOM 0 HG3 PRO A 6 3.025 9.991 -23.690 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.216 9.442 -21.435 1.00 0.00 H new ATOM 0 HD3 PRO A 6 2.113 8.300 -22.416 1.00 0.00 H new ATOM 104 N ASP A 7 4.321 11.055 -18.986 1.00 0.00 N ATOM 105 CA ASP A 7 4.852 11.618 -17.761 1.00 0.00 C ATOM 106 C ASP A 7 4.028 11.124 -16.580 1.00 0.00 C ATOM 107 O ASP A 7 3.042 11.741 -16.184 1.00 0.00 O ATOM 108 CB ASP A 7 4.851 13.145 -17.825 1.00 0.00 C ATOM 109 CG ASP A 7 5.892 13.684 -18.787 1.00 0.00 C ATOM 110 OD1 ASP A 7 5.727 13.492 -20.009 1.00 0.00 O ATOM 111 OD2 ASP A 7 6.873 14.299 -18.317 1.00 0.00 O ATOM 0 H ASP A 7 3.309 11.139 -19.083 1.00 0.00 H new ATOM 0 HA ASP A 7 5.885 11.293 -17.634 1.00 0.00 H new ATOM 0 HB2 ASP A 7 3.864 13.492 -18.130 1.00 0.00 H new ATOM 0 HB3 ASP A 7 5.037 13.548 -16.829 1.00 0.00 H new ATOM 116 N GLN A 8 4.440 9.993 -16.032 1.00 0.00 N ATOM 117 CA GLN A 8 3.752 9.390 -14.902 1.00 0.00 C ATOM 118 C GLN A 8 3.764 10.349 -13.728 1.00 0.00 C ATOM 119 O GLN A 8 2.748 10.566 -13.069 1.00 0.00 O ATOM 120 CB GLN A 8 4.417 8.069 -14.516 1.00 0.00 C ATOM 121 CG GLN A 8 4.339 7.009 -15.603 1.00 0.00 C ATOM 122 CD GLN A 8 5.681 6.743 -16.255 1.00 0.00 C ATOM 123 OE1 GLN A 8 6.651 6.389 -15.585 1.00 0.00 O ATOM 124 NE2 GLN A 8 5.743 6.914 -17.571 1.00 0.00 N ATOM 0 H GLN A 8 5.254 9.470 -16.354 1.00 0.00 H new ATOM 0 HA GLN A 8 2.719 9.184 -15.183 1.00 0.00 H new ATOM 0 HB2 GLN A 8 5.464 8.255 -14.276 1.00 0.00 H new ATOM 0 HB3 GLN A 8 3.946 7.685 -13.611 1.00 0.00 H new ATOM 0 HG2 GLN A 8 3.957 6.082 -15.175 1.00 0.00 H new ATOM 0 HG3 GLN A 8 3.626 7.326 -16.364 1.00 0.00 H new ATOM 0 HE21 GLN A 8 4.914 7.208 -18.087 1.00 0.00 H new ATOM 0 HE22 GLN A 8 6.620 6.751 -18.066 1.00 0.00 H new ATOM 133 N ARG A 9 4.922 10.948 -13.494 1.00 0.00 N ATOM 134 CA ARG A 9 5.068 11.916 -12.426 1.00 0.00 C ATOM 135 C ARG A 9 4.208 13.131 -12.720 1.00 0.00 C ATOM 136 O ARG A 9 3.809 13.849 -11.810 1.00 0.00 O ATOM 137 CB ARG A 9 6.531 12.328 -12.265 1.00 0.00 C ATOM 138 CG ARG A 9 7.137 12.932 -13.522 1.00 0.00 C ATOM 139 CD ARG A 9 8.652 12.799 -13.530 1.00 0.00 C ATOM 140 NE ARG A 9 9.272 13.649 -14.544 1.00 0.00 N ATOM 141 CZ ARG A 9 9.452 14.960 -14.403 1.00 0.00 C ATOM 142 NH1 ARG A 9 9.057 15.577 -13.296 1.00 0.00 N ATOM 143 NH2 ARG A 9 10.029 15.658 -15.373 1.00 0.00 N ATOM 0 H ARG A 9 5.772 10.778 -14.031 1.00 0.00 H new ATOM 0 HA ARG A 9 4.740 11.461 -11.491 1.00 0.00 H new ATOM 0 HB2 ARG A 9 6.609 13.050 -11.452 1.00 0.00 H new ATOM 0 HB3 ARG A 9 7.115 11.455 -11.974 1.00 0.00 H new ATOM 0 HG2 ARG A 9 6.723 12.438 -14.401 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.863 13.985 -13.590 1.00 0.00 H new ATOM 0 HD2 ARG A 9 9.044 13.062 -12.548 1.00 0.00 H new ATOM 0 HD3 ARG A 9 8.923 11.759 -13.713 1.00 0.00 H new ATOM 0 HE ARG A 9 9.585 13.212 -15.411 1.00 0.00 H new ATOM 0 HH11 ARG A 9 8.613 15.046 -12.547 1.00 0.00 H new ATOM 0 HH12 ARG A 9 9.198 16.582 -13.194 1.00 0.00 H new ATOM 0 HH21 ARG A 9 10.334 15.190 -16.226 1.00 0.00 H new ATOM 0 HH22 ARG A 9 10.167 16.663 -15.265 1.00 0.00 H new ATOM 157 N SER A 10 3.915 13.355 -13.999 1.00 0.00 N ATOM 158 CA SER A 10 3.086 14.492 -14.383 1.00 0.00 C ATOM 159 C SER A 10 1.680 14.337 -13.825 1.00 0.00 C ATOM 160 O SER A 10 1.076 15.304 -13.361 1.00 0.00 O ATOM 161 CB SER A 10 3.030 14.651 -15.907 1.00 0.00 C ATOM 162 OG SER A 10 4.111 15.438 -16.378 1.00 0.00 O ATOM 0 H SER A 10 4.234 12.774 -14.775 1.00 0.00 H new ATOM 0 HA SER A 10 3.539 15.390 -13.963 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.058 13.669 -16.379 1.00 0.00 H new ATOM 0 HB3 SER A 10 2.086 15.115 -16.193 1.00 0.00 H new ATOM 0 HG SER A 10 3.969 15.657 -17.323 1.00 0.00 H new ATOM 168 N LYS A 11 1.166 13.114 -13.862 1.00 0.00 N ATOM 169 CA LYS A 11 -0.167 12.840 -13.348 1.00 0.00 C ATOM 170 C LYS A 11 -0.129 12.608 -11.855 1.00 0.00 C ATOM 171 O LYS A 11 -1.017 13.046 -11.133 1.00 0.00 O ATOM 172 CB LYS A 11 -0.785 11.636 -14.061 1.00 0.00 C ATOM 173 CG LYS A 11 -0.639 11.683 -15.573 1.00 0.00 C ATOM 174 CD LYS A 11 -1.477 12.800 -16.178 1.00 0.00 C ATOM 175 CE LYS A 11 -0.788 13.421 -17.383 1.00 0.00 C ATOM 176 NZ LYS A 11 -1.462 14.673 -17.824 1.00 0.00 N ATOM 0 H LYS A 11 1.651 12.300 -14.241 1.00 0.00 H new ATOM 0 HA LYS A 11 -0.790 13.713 -13.543 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -0.318 10.724 -13.688 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -1.844 11.579 -13.808 1.00 0.00 H new ATOM 0 HG2 LYS A 11 0.409 11.830 -15.834 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -0.943 10.727 -15.999 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -2.449 12.407 -16.476 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -1.660 13.568 -15.426 1.00 0.00 H new ATOM 0 HE2 LYS A 11 0.252 13.636 -17.136 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -0.779 12.705 -18.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -0.962 15.065 -18.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -2.447 14.464 -18.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -1.449 15.366 -17.049 1.00 0.00 H new ATOM 190 N PHE A 12 0.912 11.950 -11.381 1.00 0.00 N ATOM 191 CA PHE A 12 1.046 11.708 -9.970 1.00 0.00 C ATOM 192 C PHE A 12 1.332 13.031 -9.259 1.00 0.00 C ATOM 193 O PHE A 12 1.103 13.166 -8.057 1.00 0.00 O ATOM 194 CB PHE A 12 2.141 10.659 -9.726 1.00 0.00 C ATOM 195 CG PHE A 12 2.857 10.790 -8.417 1.00 0.00 C ATOM 196 CD1 PHE A 12 3.862 11.721 -8.275 1.00 0.00 C ATOM 197 CD2 PHE A 12 2.526 9.984 -7.338 1.00 0.00 C ATOM 198 CE1 PHE A 12 4.535 11.855 -7.075 1.00 0.00 C ATOM 199 CE2 PHE A 12 3.193 10.107 -6.133 1.00 0.00 C ATOM 200 CZ PHE A 12 4.200 11.047 -6.001 1.00 0.00 C ATOM 0 H PHE A 12 1.669 11.578 -11.954 1.00 0.00 H new ATOM 0 HA PHE A 12 0.120 11.306 -9.560 1.00 0.00 H new ATOM 0 HB2 PHE A 12 1.693 9.667 -9.781 1.00 0.00 H new ATOM 0 HB3 PHE A 12 2.872 10.723 -10.532 1.00 0.00 H new ATOM 0 HD1 PHE A 12 4.127 12.353 -9.110 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.738 9.252 -7.440 1.00 0.00 H new ATOM 0 HE1 PHE A 12 5.321 12.589 -6.975 1.00 0.00 H new ATOM 0 HE2 PHE A 12 2.930 9.473 -5.299 1.00 0.00 H new ATOM 0 HZ PHE A 12 4.724 11.150 -5.062 1.00 0.00 H new ATOM 210 N GLU A 13 1.827 14.014 -10.021 1.00 0.00 N ATOM 211 CA GLU A 13 2.134 15.331 -9.463 1.00 0.00 C ATOM 212 C GLU A 13 1.042 16.362 -9.765 1.00 0.00 C ATOM 213 O GLU A 13 0.859 17.318 -9.010 1.00 0.00 O ATOM 214 CB GLU A 13 3.486 15.837 -9.983 1.00 0.00 C ATOM 215 CG GLU A 13 3.427 16.446 -11.377 1.00 0.00 C ATOM 216 CD GLU A 13 3.494 17.960 -11.357 1.00 0.00 C ATOM 217 OE1 GLU A 13 2.659 18.582 -10.666 1.00 0.00 O ATOM 218 OE2 GLU A 13 4.382 18.525 -12.029 1.00 0.00 O ATOM 0 H GLU A 13 2.021 13.921 -11.018 1.00 0.00 H new ATOM 0 HA GLU A 13 2.183 15.210 -8.381 1.00 0.00 H new ATOM 0 HB2 GLU A 13 3.874 16.582 -9.289 1.00 0.00 H new ATOM 0 HB3 GLU A 13 4.194 15.008 -9.990 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.252 16.058 -11.974 1.00 0.00 H new ATOM 0 HG3 GLU A 13 2.505 16.134 -11.867 1.00 0.00 H new ATOM 225 N ASN A 14 0.351 16.194 -10.892 1.00 0.00 N ATOM 226 CA ASN A 14 -0.677 17.151 -11.304 1.00 0.00 C ATOM 227 C ASN A 14 -2.096 16.688 -10.975 1.00 0.00 C ATOM 228 O ASN A 14 -2.978 17.517 -10.751 1.00 0.00 O ATOM 229 CB ASN A 14 -0.565 17.423 -12.805 1.00 0.00 C ATOM 230 CG ASN A 14 -1.266 18.704 -13.215 1.00 0.00 C ATOM 231 OD1 ASN A 14 -2.593 18.667 -13.247 1.00 0.00 O flip ATOM 232 ND2 ASN A 14 -0.623 19.713 -13.501 1.00 0.00 N flip ATOM 0 H ASN A 14 0.482 15.411 -11.532 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.498 18.064 -10.736 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.487 17.483 -13.083 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -0.993 16.586 -13.356 1.00 0.00 H new ATOM 0 HD21 ASN A 14 0.396 19.696 -13.463 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.109 20.566 -13.776 1.00 0.00 H new ATOM 239 N GLU A 15 -2.328 15.381 -10.951 1.00 0.00 N ATOM 240 CA GLU A 15 -3.667 14.871 -10.653 1.00 0.00 C ATOM 241 C GLU A 15 -4.080 15.256 -9.232 1.00 0.00 C ATOM 242 O GLU A 15 -3.280 15.184 -8.304 1.00 0.00 O ATOM 243 CB GLU A 15 -3.724 13.357 -10.846 1.00 0.00 C ATOM 244 CG GLU A 15 -3.994 12.944 -12.281 1.00 0.00 C ATOM 245 CD GLU A 15 -5.419 13.232 -12.713 1.00 0.00 C ATOM 246 OE1 GLU A 15 -6.082 14.062 -12.057 1.00 0.00 O ATOM 247 OE2 GLU A 15 -5.871 12.627 -13.709 1.00 0.00 O ATOM 0 H GLU A 15 -1.624 14.665 -11.130 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.372 15.325 -11.349 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.779 12.921 -10.521 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.503 12.945 -10.204 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -3.305 13.469 -12.942 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.793 11.879 -12.392 1.00 0.00 H new ATOM 254 N GLU A 16 -5.329 15.702 -9.081 1.00 0.00 N ATOM 255 CA GLU A 16 -5.844 16.146 -7.780 1.00 0.00 C ATOM 256 C GLU A 16 -5.950 15.005 -6.772 1.00 0.00 C ATOM 257 O GLU A 16 -5.195 14.967 -5.800 1.00 0.00 O ATOM 258 CB GLU A 16 -7.196 16.853 -7.936 1.00 0.00 C ATOM 259 CG GLU A 16 -8.244 16.046 -8.686 1.00 0.00 C ATOM 260 CD GLU A 16 -9.143 16.914 -9.546 1.00 0.00 C ATOM 261 OE1 GLU A 16 -9.583 17.976 -9.060 1.00 0.00 O ATOM 262 OE2 GLU A 16 -9.405 16.530 -10.704 1.00 0.00 O ATOM 0 H GLU A 16 -6.004 15.766 -9.843 1.00 0.00 H new ATOM 0 HA GLU A 16 -5.119 16.857 -7.384 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -7.582 17.096 -6.946 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -7.040 17.797 -8.458 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -7.747 15.308 -9.316 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -8.854 15.495 -7.970 1.00 0.00 H new ATOM 269 N PHE A 17 -6.870 14.068 -6.993 1.00 0.00 N ATOM 270 CA PHE A 17 -7.022 12.942 -6.082 1.00 0.00 C ATOM 271 C PHE A 17 -5.692 12.231 -5.956 1.00 0.00 C ATOM 272 O PHE A 17 -5.290 11.807 -4.874 1.00 0.00 O ATOM 273 CB PHE A 17 -8.125 11.995 -6.585 1.00 0.00 C ATOM 274 CG PHE A 17 -7.789 10.530 -6.484 1.00 0.00 C ATOM 275 CD1 PHE A 17 -6.886 9.953 -7.360 1.00 0.00 C ATOM 276 CD2 PHE A 17 -8.379 9.735 -5.514 1.00 0.00 C ATOM 277 CE1 PHE A 17 -6.574 8.609 -7.271 1.00 0.00 C ATOM 278 CE2 PHE A 17 -8.071 8.390 -5.421 1.00 0.00 C ATOM 279 CZ PHE A 17 -7.167 7.827 -6.301 1.00 0.00 C ATOM 0 H PHE A 17 -7.513 14.067 -7.785 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.324 13.296 -5.096 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.036 12.185 -6.017 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.343 12.233 -7.626 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -6.420 10.560 -8.122 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -9.086 10.170 -4.824 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -5.867 8.172 -7.960 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -8.537 7.780 -4.661 1.00 0.00 H new ATOM 0 HZ PHE A 17 -6.925 6.777 -6.230 1.00 0.00 H new ATOM 289 N PHE A 18 -5.016 12.116 -7.081 1.00 0.00 N ATOM 290 CA PHE A 18 -3.732 11.472 -7.144 1.00 0.00 C ATOM 291 C PHE A 18 -2.727 12.277 -6.332 1.00 0.00 C ATOM 292 O PHE A 18 -1.749 11.733 -5.833 1.00 0.00 O ATOM 293 CB PHE A 18 -3.324 11.416 -8.603 1.00 0.00 C ATOM 294 CG PHE A 18 -2.580 10.190 -8.989 1.00 0.00 C ATOM 295 CD1 PHE A 18 -1.316 9.909 -8.518 1.00 0.00 C ATOM 296 CD2 PHE A 18 -3.191 9.309 -9.848 1.00 0.00 C ATOM 297 CE1 PHE A 18 -0.666 8.752 -8.910 1.00 0.00 C ATOM 298 CE2 PHE A 18 -2.558 8.153 -10.246 1.00 0.00 C ATOM 299 CZ PHE A 18 -1.292 7.872 -9.779 1.00 0.00 C ATOM 0 H PHE A 18 -5.348 12.470 -7.978 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.771 10.464 -6.731 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.219 11.492 -9.220 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -2.707 12.286 -8.828 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -0.830 10.595 -7.840 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -4.183 9.526 -10.217 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.325 8.535 -8.540 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -3.051 7.469 -10.921 1.00 0.00 H new ATOM 0 HZ PHE A 18 -0.789 6.968 -10.089 1.00 0.00 H new ATOM 309 N ARG A 19 -2.995 13.579 -6.190 1.00 0.00 N ATOM 310 CA ARG A 19 -2.132 14.463 -5.416 1.00 0.00 C ATOM 311 C ARG A 19 -2.500 14.376 -3.939 1.00 0.00 C ATOM 312 O ARG A 19 -1.695 13.936 -3.112 1.00 0.00 O ATOM 313 CB ARG A 19 -2.263 15.912 -5.895 1.00 0.00 C ATOM 314 CG ARG A 19 -1.221 16.310 -6.931 1.00 0.00 C ATOM 315 CD ARG A 19 -0.271 17.371 -6.395 1.00 0.00 C ATOM 316 NE ARG A 19 1.059 16.829 -6.127 1.00 0.00 N ATOM 317 CZ ARG A 19 2.036 17.519 -5.544 1.00 0.00 C ATOM 318 NH1 ARG A 19 1.836 18.776 -5.165 1.00 0.00 N ATOM 319 NH2 ARG A 19 3.217 16.952 -5.340 1.00 0.00 N ATOM 0 H ARG A 19 -3.805 14.040 -6.604 1.00 0.00 H new ATOM 0 HA ARG A 19 -1.099 14.145 -5.557 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -3.257 16.057 -6.318 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -2.182 16.578 -5.036 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -0.652 15.430 -7.231 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -1.721 16.686 -7.824 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -0.192 18.185 -7.116 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -0.681 17.795 -5.479 1.00 0.00 H new ATOM 0 HE ARG A 19 1.250 15.866 -6.403 1.00 0.00 H new ATOM 0 HH11 ARG A 19 0.930 19.217 -5.320 1.00 0.00 H new ATOM 0 HH12 ARG A 19 2.589 19.300 -4.719 1.00 0.00 H new ATOM 0 HH21 ARG A 19 3.376 15.987 -5.630 1.00 0.00 H new ATOM 0 HH22 ARG A 19 3.966 17.481 -4.893 1.00 0.00 H new ATOM 333 N LYS A 20 -3.736 14.769 -3.612 1.00 0.00 N ATOM 334 CA LYS A 20 -4.202 14.704 -2.230 1.00 0.00 C ATOM 335 C LYS A 20 -3.915 13.319 -1.663 1.00 0.00 C ATOM 336 O LYS A 20 -3.679 13.163 -0.465 1.00 0.00 O ATOM 337 CB LYS A 20 -5.693 15.036 -2.125 1.00 0.00 C ATOM 338 CG LYS A 20 -6.581 14.162 -2.988 1.00 0.00 C ATOM 339 CD LYS A 20 -7.854 14.894 -3.390 1.00 0.00 C ATOM 340 CE LYS A 20 -9.030 13.939 -3.533 1.00 0.00 C ATOM 341 NZ LYS A 20 -10.030 14.123 -2.446 1.00 0.00 N ATOM 0 H LYS A 20 -4.420 15.130 -4.277 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.664 15.451 -1.646 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -6.004 14.938 -1.085 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.843 16.078 -2.406 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.037 13.857 -3.882 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.838 13.252 -2.445 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -8.089 15.652 -2.643 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.692 15.416 -4.333 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.510 14.097 -4.499 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.667 12.911 -3.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.798 13.431 -2.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.571 13.981 -1.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.421 15.086 -2.493 1.00 0.00 H new ATOM 355 N LEU A 21 -3.893 12.321 -2.547 1.00 0.00 N ATOM 356 CA LEU A 21 -3.582 10.960 -2.138 1.00 0.00 C ATOM 357 C LEU A 21 -2.072 10.756 -2.216 1.00 0.00 C ATOM 358 O LEU A 21 -1.485 10.073 -1.376 1.00 0.00 O ATOM 359 CB LEU A 21 -4.304 9.931 -3.018 1.00 0.00 C ATOM 360 CG LEU A 21 -5.824 9.813 -2.810 1.00 0.00 C ATOM 361 CD1 LEU A 21 -6.277 8.381 -3.044 1.00 0.00 C ATOM 362 CD2 LEU A 21 -6.233 10.274 -1.417 1.00 0.00 C ATOM 0 H LEU A 21 -4.086 12.432 -3.542 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.927 10.812 -1.115 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -4.119 10.182 -4.062 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -3.856 8.953 -2.841 1.00 0.00 H new ATOM 0 HG LEU A 21 -6.312 10.465 -3.534 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -7.354 8.311 -2.894 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.033 8.084 -4.064 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -5.769 7.719 -2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.313 10.177 -1.304 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.733 9.659 -0.669 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.946 11.316 -1.280 1.00 0.00 H new ATOM 374 N SER A 22 -1.441 11.392 -3.211 1.00 0.00 N ATOM 375 CA SER A 22 0.014 11.319 -3.377 1.00 0.00 C ATOM 376 C SER A 22 0.722 11.716 -2.085 1.00 0.00 C ATOM 377 O SER A 22 1.905 11.435 -1.900 1.00 0.00 O ATOM 378 CB SER A 22 0.482 12.237 -4.509 1.00 0.00 C ATOM 379 OG SER A 22 1.857 12.554 -4.376 1.00 0.00 O ATOM 0 H SER A 22 -1.915 11.962 -3.912 1.00 0.00 H new ATOM 0 HA SER A 22 0.266 10.288 -3.627 1.00 0.00 H new ATOM 0 HB2 SER A 22 0.309 11.752 -5.470 1.00 0.00 H new ATOM 0 HB3 SER A 22 -0.107 13.154 -4.505 1.00 0.00 H new ATOM 0 HG SER A 22 2.389 11.940 -4.924 1.00 0.00 H new ATOM 385 N ARG A 23 -0.009 12.385 -1.198 1.00 0.00 N ATOM 386 CA ARG A 23 0.547 12.833 0.070 1.00 0.00 C ATOM 387 C ARG A 23 0.178 11.865 1.189 1.00 0.00 C ATOM 388 O ARG A 23 -0.266 10.744 0.932 1.00 0.00 O ATOM 389 CB ARG A 23 0.028 14.234 0.395 1.00 0.00 C ATOM 390 CG ARG A 23 -0.069 15.147 -0.820 1.00 0.00 C ATOM 391 CD ARG A 23 1.227 15.905 -1.057 1.00 0.00 C ATOM 392 NE ARG A 23 1.487 16.888 -0.006 1.00 0.00 N ATOM 393 CZ ARG A 23 2.266 16.665 1.052 1.00 0.00 C ATOM 394 NH1 ARG A 23 2.860 15.488 1.218 1.00 0.00 N ATOM 395 NH2 ARG A 23 2.448 17.622 1.951 1.00 0.00 N ATOM 0 H ARG A 23 -0.990 12.628 -1.337 1.00 0.00 H new ATOM 0 HA ARG A 23 1.633 12.863 -0.015 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.957 14.150 0.855 1.00 0.00 H new ATOM 0 HB3 ARG A 23 0.686 14.694 1.133 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.311 14.554 -1.702 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.885 15.856 -0.679 1.00 0.00 H new ATOM 0 HD2 ARG A 23 2.056 15.199 -1.106 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.180 16.410 -2.022 1.00 0.00 H new ATOM 0 HE ARG A 23 1.044 17.803 -0.088 1.00 0.00 H new ATOM 0 HH11 ARG A 23 2.722 14.746 0.532 1.00 0.00 H new ATOM 0 HH12 ARG A 23 3.454 15.327 2.031 1.00 0.00 H new ATOM 0 HH21 ARG A 23 1.992 18.527 1.832 1.00 0.00 H new ATOM 0 HH22 ARG A 23 3.044 17.454 2.762 1.00 0.00 H new ATOM 409 N GLU A 24 0.385 12.297 2.428 1.00 0.00 N ATOM 410 CA GLU A 24 0.092 11.462 3.590 1.00 0.00 C ATOM 411 C GLU A 24 -1.084 12.011 4.394 1.00 0.00 C ATOM 412 O GLU A 24 -1.100 13.183 4.769 1.00 0.00 O ATOM 413 CB GLU A 24 1.325 11.356 4.490 1.00 0.00 C ATOM 414 CG GLU A 24 2.625 11.151 3.728 1.00 0.00 C ATOM 415 CD GLU A 24 3.673 12.191 4.070 1.00 0.00 C ATOM 416 OE1 GLU A 24 3.516 13.355 3.645 1.00 0.00 O ATOM 417 OE2 GLU A 24 4.653 11.842 4.762 1.00 0.00 O ATOM 0 H GLU A 24 0.754 13.220 2.655 1.00 0.00 H new ATOM 0 HA GLU A 24 -0.179 10.472 3.223 1.00 0.00 H new ATOM 0 HB2 GLU A 24 1.405 12.263 5.089 1.00 0.00 H new ATOM 0 HB3 GLU A 24 1.187 10.527 5.184 1.00 0.00 H new ATOM 0 HG2 GLU A 24 3.018 10.159 3.949 1.00 0.00 H new ATOM 0 HG3 GLU A 24 2.423 11.183 2.657 1.00 0.00 H new ATOM 424 N CYS A 25 -2.062 11.149 4.663 1.00 0.00 N ATOM 425 CA CYS A 25 -3.239 11.539 5.434 1.00 0.00 C ATOM 426 C CYS A 25 -3.813 10.360 6.212 1.00 0.00 C ATOM 427 O CYS A 25 -3.641 9.201 5.837 1.00 0.00 O ATOM 428 CB CYS A 25 -4.304 12.176 4.532 1.00 0.00 C ATOM 429 SG CYS A 25 -4.298 11.587 2.821 1.00 0.00 S ATOM 0 H CYS A 25 -2.062 10.176 4.358 1.00 0.00 H new ATOM 0 HA CYS A 25 -2.922 12.288 6.160 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -5.287 11.986 4.964 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -4.160 13.256 4.530 1.00 0.00 H new ATOM 0 HG CYS A 25 -4.511 10.305 2.803 1.00 0.00 H new ATOM 435 N GLU A 26 -4.474 10.683 7.319 1.00 0.00 N ATOM 436 CA GLU A 26 -5.066 9.683 8.205 1.00 0.00 C ATOM 437 C GLU A 26 -5.835 8.600 7.451 1.00 0.00 C ATOM 438 O GLU A 26 -6.527 8.867 6.467 1.00 0.00 O ATOM 439 CB GLU A 26 -5.998 10.360 9.214 1.00 0.00 C ATOM 440 CG GLU A 26 -5.413 11.617 9.838 1.00 0.00 C ATOM 441 CD GLU A 26 -5.656 11.695 11.333 1.00 0.00 C ATOM 442 OE1 GLU A 26 -6.762 11.321 11.775 1.00 0.00 O ATOM 443 OE2 GLU A 26 -4.739 12.129 12.061 1.00 0.00 O ATOM 0 H GLU A 26 -4.615 11.645 7.628 1.00 0.00 H new ATOM 0 HA GLU A 26 -4.239 9.195 8.721 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.934 10.614 8.717 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.239 9.650 10.005 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.340 11.648 9.646 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -5.848 12.493 9.357 1.00 0.00 H new ATOM 450 N ILE A 27 -5.717 7.374 7.952 1.00 0.00 N ATOM 451 CA ILE A 27 -6.406 6.225 7.372 1.00 0.00 C ATOM 452 C ILE A 27 -7.042 5.369 8.469 1.00 0.00 C ATOM 453 O ILE A 27 -6.653 5.449 9.633 1.00 0.00 O ATOM 454 CB ILE A 27 -5.458 5.345 6.526 1.00 0.00 C ATOM 455 CG1 ILE A 27 -4.401 4.669 7.407 1.00 0.00 C ATOM 456 CG2 ILE A 27 -4.793 6.176 5.442 1.00 0.00 C ATOM 457 CD1 ILE A 27 -3.665 3.539 6.715 1.00 0.00 C ATOM 0 H ILE A 27 -5.145 7.149 8.766 1.00 0.00 H new ATOM 0 HA ILE A 27 -7.181 6.621 6.716 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.053 4.563 6.053 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -3.678 5.417 7.731 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -4.883 4.281 8.305 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.128 5.543 4.854 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.556 6.603 4.791 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.217 6.979 5.901 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -2.933 3.109 7.399 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -4.377 2.771 6.415 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -3.154 3.924 5.833 1.00 0.00 H new ATOM 469 N LYS A 28 -8.015 4.549 8.088 1.00 0.00 N ATOM 470 CA LYS A 28 -8.702 3.673 9.036 1.00 0.00 C ATOM 471 C LYS A 28 -9.079 2.362 8.360 1.00 0.00 C ATOM 472 O LYS A 28 -9.244 2.317 7.144 1.00 0.00 O ATOM 473 CB LYS A 28 -9.953 4.358 9.588 1.00 0.00 C ATOM 474 CG LYS A 28 -10.920 4.821 8.510 1.00 0.00 C ATOM 475 CD LYS A 28 -12.355 4.814 9.009 1.00 0.00 C ATOM 476 CE LYS A 28 -13.302 5.427 7.990 1.00 0.00 C ATOM 477 NZ LYS A 28 -12.977 6.854 7.717 1.00 0.00 N ATOM 0 H LYS A 28 -8.348 4.471 7.127 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.027 3.462 9.865 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -10.470 3.669 10.256 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.652 5.217 10.187 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -10.651 5.826 8.186 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -10.833 4.172 7.639 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.662 3.790 9.223 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.418 5.368 9.946 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.252 4.859 7.061 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.326 5.352 8.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -13.801 7.322 7.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.733 7.331 8.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.169 6.907 7.064 1.00 0.00 H new ATOM 491 N TYR A 29 -9.204 1.290 9.139 1.00 0.00 N ATOM 492 CA TYR A 29 -9.547 -0.008 8.568 1.00 0.00 C ATOM 493 C TYR A 29 -11.046 -0.152 8.327 1.00 0.00 C ATOM 494 O TYR A 29 -11.866 0.223 9.166 1.00 0.00 O ATOM 495 CB TYR A 29 -9.055 -1.144 9.459 1.00 0.00 C ATOM 496 CG TYR A 29 -8.759 -2.403 8.682 1.00 0.00 C ATOM 497 CD1 TYR A 29 -7.526 -2.589 8.073 1.00 0.00 C ATOM 498 CD2 TYR A 29 -9.717 -3.400 8.545 1.00 0.00 C ATOM 499 CE1 TYR A 29 -7.253 -3.733 7.349 1.00 0.00 C ATOM 500 CE2 TYR A 29 -9.452 -4.549 7.824 1.00 0.00 C ATOM 501 CZ TYR A 29 -8.217 -4.709 7.228 1.00 0.00 C ATOM 502 OH TYR A 29 -7.949 -5.847 6.505 1.00 0.00 O ATOM 0 H TYR A 29 -9.075 1.293 10.151 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.045 -0.068 7.602 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -8.155 -0.825 9.984 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -9.808 -1.358 10.218 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.767 -1.826 8.167 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -10.684 -3.275 9.009 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.289 -3.862 6.880 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -10.206 -5.316 7.728 1.00 0.00 H new ATOM 0 HH TYR A 29 -8.437 -6.603 6.892 1.00 0.00 H new ATOM 512 N THR A 30 -11.389 -0.711 7.166 1.00 0.00 N ATOM 513 CA THR A 30 -12.781 -0.925 6.788 1.00 0.00 C ATOM 514 C THR A 30 -12.893 -2.024 5.731 1.00 0.00 C ATOM 515 O THR A 30 -13.830 -2.035 4.933 1.00 0.00 O ATOM 516 CB THR A 30 -13.394 0.371 6.253 1.00 0.00 C ATOM 517 OG1 THR A 30 -12.818 0.724 5.007 1.00 0.00 O ATOM 518 CG2 THR A 30 -13.222 1.548 7.190 1.00 0.00 C ATOM 0 H THR A 30 -10.714 -1.025 6.468 1.00 0.00 H new ATOM 0 HA THR A 30 -13.328 -1.238 7.677 1.00 0.00 H new ATOM 0 HB THR A 30 -14.459 0.163 6.150 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.125 0.100 4.316 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.679 2.434 6.749 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.703 1.328 8.143 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.160 1.731 7.353 1.00 0.00 H new ATOM 526 N GLY A 31 -11.933 -2.947 5.732 1.00 0.00 N ATOM 527 CA GLY A 31 -11.944 -4.036 4.768 1.00 0.00 C ATOM 528 C GLY A 31 -12.948 -5.113 5.127 1.00 0.00 C ATOM 529 O GLY A 31 -14.020 -5.197 4.529 1.00 0.00 O ATOM 0 H GLY A 31 -11.148 -2.960 6.383 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -12.177 -3.641 3.779 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -10.948 -4.476 4.709 1.00 0.00 H new ATOM 533 N PHE A 32 -12.609 -5.927 6.123 1.00 0.00 N ATOM 534 CA PHE A 32 -13.497 -6.990 6.581 1.00 0.00 C ATOM 535 C PHE A 32 -13.825 -6.791 8.054 1.00 0.00 C ATOM 536 O PHE A 32 -14.227 -7.723 8.749 1.00 0.00 O ATOM 537 CB PHE A 32 -12.868 -8.372 6.370 1.00 0.00 C ATOM 538 CG PHE A 32 -11.367 -8.388 6.444 1.00 0.00 C ATOM 539 CD1 PHE A 32 -10.714 -8.360 7.666 1.00 0.00 C ATOM 540 CD2 PHE A 32 -10.612 -8.445 5.286 1.00 0.00 C ATOM 541 CE1 PHE A 32 -9.331 -8.388 7.730 1.00 0.00 C ATOM 542 CE2 PHE A 32 -9.232 -8.472 5.342 1.00 0.00 C ATOM 543 CZ PHE A 32 -8.591 -8.445 6.566 1.00 0.00 C ATOM 0 H PHE A 32 -11.725 -5.870 6.628 1.00 0.00 H new ATOM 0 HA PHE A 32 -14.413 -6.942 5.992 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -13.264 -9.057 7.120 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -13.176 -8.753 5.396 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -11.290 -8.316 8.578 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -11.108 -8.469 4.327 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.833 -8.365 8.688 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -8.655 -8.514 4.430 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.512 -8.468 6.612 1.00 0.00 H new ATOM 553 N ARG A 33 -13.629 -5.563 8.519 1.00 0.00 N ATOM 554 CA ARG A 33 -13.875 -5.206 9.904 1.00 0.00 C ATOM 555 C ARG A 33 -15.310 -4.761 10.135 1.00 0.00 C ATOM 556 O ARG A 33 -15.744 -4.602 11.276 1.00 0.00 O ATOM 557 CB ARG A 33 -12.916 -4.096 10.305 1.00 0.00 C ATOM 558 CG ARG A 33 -13.197 -2.765 9.625 1.00 0.00 C ATOM 559 CD ARG A 33 -14.288 -1.987 10.341 1.00 0.00 C ATOM 560 NE ARG A 33 -13.817 -0.684 10.807 1.00 0.00 N ATOM 561 CZ ARG A 33 -14.454 0.055 11.712 1.00 0.00 C ATOM 562 NH1 ARG A 33 -15.589 -0.375 12.250 1.00 0.00 N ATOM 563 NH2 ARG A 33 -13.955 1.227 12.079 1.00 0.00 N ATOM 0 H ARG A 33 -13.295 -4.790 7.944 1.00 0.00 H new ATOM 0 HA ARG A 33 -13.711 -6.091 10.518 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.965 -3.959 11.385 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.898 -4.406 10.069 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -12.284 -2.170 9.598 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -13.494 -2.940 8.591 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -15.134 -1.847 9.668 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -14.649 -2.567 11.191 1.00 0.00 H new ATOM 0 HE ARG A 33 -12.949 -0.320 10.415 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -15.977 -1.276 11.970 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -16.073 0.196 12.943 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -13.084 1.562 11.668 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -14.442 1.794 12.773 1.00 0.00 H new ATOM 577 N ASP A 34 -16.037 -4.556 9.051 1.00 0.00 N ATOM 578 CA ASP A 34 -17.430 -4.122 9.126 1.00 0.00 C ATOM 579 C ASP A 34 -18.263 -5.013 10.055 1.00 0.00 C ATOM 580 O ASP A 34 -19.423 -4.707 10.333 1.00 0.00 O ATOM 581 CB ASP A 34 -18.051 -4.110 7.728 1.00 0.00 C ATOM 582 CG ASP A 34 -17.901 -2.768 7.039 1.00 0.00 C ATOM 583 OD1 ASP A 34 -17.023 -1.982 7.454 1.00 0.00 O ATOM 584 OD2 ASP A 34 -18.663 -2.502 6.085 1.00 0.00 O ATOM 0 H ASP A 34 -15.688 -4.683 8.101 1.00 0.00 H new ATOM 0 HA ASP A 34 -17.435 -3.114 9.542 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.582 -4.882 7.119 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -19.109 -4.361 7.802 1.00 0.00 H new ATOM 589 N ARG A 35 -17.675 -6.107 10.539 1.00 0.00 N ATOM 590 CA ARG A 35 -18.378 -7.014 11.435 1.00 0.00 C ATOM 591 C ARG A 35 -17.513 -7.374 12.649 1.00 0.00 C ATOM 592 O ARG A 35 -17.875 -7.057 13.782 1.00 0.00 O ATOM 593 CB ARG A 35 -18.838 -8.277 10.690 1.00 0.00 C ATOM 594 CG ARG A 35 -18.914 -8.110 9.175 1.00 0.00 C ATOM 595 CD ARG A 35 -17.543 -8.210 8.519 1.00 0.00 C ATOM 596 NE ARG A 35 -17.562 -7.741 7.136 1.00 0.00 N ATOM 597 CZ ARG A 35 -18.000 -8.470 6.110 1.00 0.00 C ATOM 598 NH1 ARG A 35 -18.457 -9.701 6.310 1.00 0.00 N ATOM 599 NH2 ARG A 35 -17.980 -7.968 4.884 1.00 0.00 N ATOM 0 H ARG A 35 -16.717 -6.383 10.324 1.00 0.00 H new ATOM 0 HA ARG A 35 -19.266 -6.499 11.801 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -18.153 -9.093 10.922 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -19.820 -8.569 11.063 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -19.571 -8.874 8.759 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -19.359 -7.143 8.939 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -16.824 -7.623 9.091 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -17.203 -9.245 8.546 1.00 0.00 H new ATOM 0 HE ARG A 35 -17.220 -6.800 6.944 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -18.474 -10.092 7.252 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -18.791 -10.255 5.522 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -17.629 -7.023 4.725 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -18.315 -8.526 4.099 1.00 0.00 H new ATOM 613 N PRO A 36 -16.355 -8.043 12.445 1.00 0.00 N ATOM 614 CA PRO A 36 -15.463 -8.434 13.527 1.00 0.00 C ATOM 615 C PRO A 36 -14.267 -7.496 13.670 1.00 0.00 C ATOM 616 O PRO A 36 -13.132 -7.949 13.777 1.00 0.00 O ATOM 617 CB PRO A 36 -14.996 -9.794 13.032 1.00 0.00 C ATOM 618 CG PRO A 36 -14.846 -9.602 11.554 1.00 0.00 C ATOM 619 CD PRO A 36 -15.805 -8.494 11.157 1.00 0.00 C ATOM 0 HA PRO A 36 -15.943 -8.423 14.506 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.054 -10.087 13.495 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -15.721 -10.575 13.263 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -13.820 -9.335 11.301 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -15.077 -10.523 11.019 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -15.292 -7.687 10.634 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -16.587 -8.859 10.491 1.00 0.00 H new ATOM 627 N HIS A 37 -14.524 -6.190 13.657 1.00 0.00 N ATOM 628 CA HIS A 37 -13.461 -5.186 13.773 1.00 0.00 C ATOM 629 C HIS A 37 -12.415 -5.580 14.820 1.00 0.00 C ATOM 630 O HIS A 37 -11.233 -5.745 14.505 1.00 0.00 O ATOM 631 CB HIS A 37 -14.073 -3.823 14.116 1.00 0.00 C ATOM 632 CG HIS A 37 -13.097 -2.684 14.096 1.00 0.00 C ATOM 633 ND1 HIS A 37 -12.440 -2.086 13.069 1.00 0.00 N flip ATOM 634 CD2 HIS A 37 -12.719 -2.004 15.233 1.00 0.00 C flip ATOM 635 CE1 HIS A 37 -11.691 -1.068 13.603 1.00 0.00 C flip ATOM 636 NE2 HIS A 37 -11.877 -1.040 14.910 1.00 0.00 N flip ATOM 0 H HIS A 37 -15.461 -5.798 13.567 1.00 0.00 H new ATOM 0 HA HIS A 37 -12.950 -5.125 12.812 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -14.876 -3.610 13.410 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -14.526 -3.880 15.106 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -13.059 -2.225 16.234 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -11.053 -0.399 13.045 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -11.443 -0.384 15.560 1.00 0.00 H new ATOM 645 N GLU A 38 -12.850 -5.733 16.065 1.00 0.00 N ATOM 646 CA GLU A 38 -11.943 -6.109 17.145 1.00 0.00 C ATOM 647 C GLU A 38 -11.180 -7.386 16.806 1.00 0.00 C ATOM 648 O GLU A 38 -10.079 -7.611 17.307 1.00 0.00 O ATOM 649 CB GLU A 38 -12.715 -6.290 18.453 1.00 0.00 C ATOM 650 CG GLU A 38 -13.799 -7.353 18.377 1.00 0.00 C ATOM 651 CD GLU A 38 -15.105 -6.901 18.999 1.00 0.00 C ATOM 652 OE1 GLU A 38 -15.502 -5.739 18.766 1.00 0.00 O ATOM 653 OE2 GLU A 38 -15.732 -7.707 19.718 1.00 0.00 O ATOM 0 H GLU A 38 -13.820 -5.603 16.352 1.00 0.00 H new ATOM 0 HA GLU A 38 -11.220 -5.303 17.269 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -12.014 -6.553 19.245 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -13.169 -5.339 18.732 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.970 -7.617 17.334 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.454 -8.255 18.882 1.00 0.00 H new ATOM 660 N GLU A 39 -11.754 -8.203 15.931 1.00 0.00 N ATOM 661 CA GLU A 39 -11.103 -9.433 15.504 1.00 0.00 C ATOM 662 C GLU A 39 -10.180 -9.107 14.355 1.00 0.00 C ATOM 663 O GLU A 39 -9.059 -9.606 14.260 1.00 0.00 O ATOM 664 CB GLU A 39 -12.130 -10.480 15.073 1.00 0.00 C ATOM 665 CG GLU A 39 -11.788 -11.891 15.525 1.00 0.00 C ATOM 666 CD GLU A 39 -12.946 -12.854 15.353 1.00 0.00 C ATOM 667 OE1 GLU A 39 -13.793 -12.613 14.467 1.00 0.00 O ATOM 668 OE2 GLU A 39 -13.007 -13.850 16.106 1.00 0.00 O ATOM 0 H GLU A 39 -12.666 -8.036 15.505 1.00 0.00 H new ATOM 0 HA GLU A 39 -10.539 -9.851 16.338 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.106 -10.206 15.474 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.216 -10.466 13.986 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -10.931 -12.253 14.957 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -11.490 -11.871 16.573 1.00 0.00 H new ATOM 675 N ARG A 40 -10.679 -8.233 13.493 1.00 0.00 N ATOM 676 CA ARG A 40 -9.945 -7.776 12.340 1.00 0.00 C ATOM 677 C ARG A 40 -8.581 -7.251 12.761 1.00 0.00 C ATOM 678 O ARG A 40 -7.638 -7.246 11.971 1.00 0.00 O ATOM 679 CB ARG A 40 -10.744 -6.689 11.629 1.00 0.00 C ATOM 680 CG ARG A 40 -9.936 -5.909 10.603 1.00 0.00 C ATOM 681 CD ARG A 40 -9.288 -4.683 11.222 1.00 0.00 C ATOM 682 NE ARG A 40 -8.020 -4.350 10.576 1.00 0.00 N ATOM 683 CZ ARG A 40 -7.105 -3.546 11.109 1.00 0.00 C ATOM 684 NH1 ARG A 40 -7.281 -3.043 12.321 1.00 0.00 N ATOM 685 NH2 ARG A 40 -6.004 -3.259 10.433 1.00 0.00 N ATOM 0 H ARG A 40 -11.609 -7.824 13.581 1.00 0.00 H new ATOM 0 HA ARG A 40 -9.792 -8.609 11.654 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -11.601 -7.146 11.133 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -11.138 -5.995 12.372 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -9.166 -6.553 10.178 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -10.585 -5.604 9.782 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.968 -3.835 11.144 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -9.119 -4.860 12.284 1.00 0.00 H new ATOM 0 HE ARG A 40 -7.825 -4.759 9.662 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -8.122 -3.272 12.851 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -6.576 -2.427 12.725 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -5.858 -3.654 9.504 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -5.301 -2.642 10.841 1.00 0.00 H new ATOM 699 N GLN A 41 -8.472 -6.824 14.019 1.00 0.00 N ATOM 700 CA GLN A 41 -7.200 -6.324 14.526 1.00 0.00 C ATOM 701 C GLN A 41 -6.140 -7.404 14.350 1.00 0.00 C ATOM 702 O GLN A 41 -5.010 -7.132 13.937 1.00 0.00 O ATOM 703 CB GLN A 41 -7.314 -5.902 15.997 1.00 0.00 C ATOM 704 CG GLN A 41 -7.446 -7.060 16.975 1.00 0.00 C ATOM 705 CD GLN A 41 -6.111 -7.511 17.535 1.00 0.00 C ATOM 706 OE1 GLN A 41 -5.099 -7.520 16.835 1.00 0.00 O ATOM 707 NE2 GLN A 41 -6.101 -7.889 18.809 1.00 0.00 N ATOM 0 H GLN A 41 -9.237 -6.815 14.694 1.00 0.00 H new ATOM 0 HA GLN A 41 -6.913 -5.437 13.961 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.434 -5.316 16.263 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.179 -5.248 16.109 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.098 -6.763 17.797 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.927 -7.900 16.474 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.963 -7.866 19.354 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.232 -8.202 19.241 1.00 0.00 H new ATOM 716 N THR A 42 -6.539 -8.639 14.628 1.00 0.00 N ATOM 717 CA THR A 42 -5.660 -9.784 14.468 1.00 0.00 C ATOM 718 C THR A 42 -5.718 -10.264 13.030 1.00 0.00 C ATOM 719 O THR A 42 -4.724 -10.744 12.488 1.00 0.00 O ATOM 720 CB THR A 42 -6.057 -10.910 15.424 1.00 0.00 C ATOM 721 OG1 THR A 42 -6.109 -10.439 16.759 1.00 0.00 O ATOM 722 CG2 THR A 42 -5.106 -12.086 15.390 1.00 0.00 C ATOM 0 H THR A 42 -7.472 -8.871 14.967 1.00 0.00 H new ATOM 0 HA THR A 42 -4.640 -9.485 14.708 1.00 0.00 H new ATOM 0 HB THR A 42 -7.037 -11.245 15.085 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.366 -11.173 17.355 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.445 -12.849 16.091 1.00 0.00 H new ATOM 0 HG22 THR A 42 -5.080 -12.504 14.384 1.00 0.00 H new ATOM 0 HG23 THR A 42 -4.107 -11.754 15.671 1.00 0.00 H new ATOM 730 N ARG A 43 -6.884 -10.108 12.401 1.00 0.00 N ATOM 731 CA ARG A 43 -7.031 -10.509 11.008 1.00 0.00 C ATOM 732 C ARG A 43 -6.124 -9.653 10.136 1.00 0.00 C ATOM 733 O ARG A 43 -5.642 -10.098 9.094 1.00 0.00 O ATOM 734 CB ARG A 43 -8.481 -10.379 10.540 1.00 0.00 C ATOM 735 CG ARG A 43 -9.487 -11.031 11.473 1.00 0.00 C ATOM 736 CD ARG A 43 -9.672 -12.505 11.150 1.00 0.00 C ATOM 737 NE ARG A 43 -11.074 -12.910 11.222 1.00 0.00 N ATOM 738 CZ ARG A 43 -11.962 -12.687 10.255 1.00 0.00 C ATOM 739 NH1 ARG A 43 -11.600 -12.058 9.143 1.00 0.00 N ATOM 740 NH2 ARG A 43 -13.216 -13.092 10.401 1.00 0.00 N ATOM 0 H ARG A 43 -7.723 -9.714 12.827 1.00 0.00 H new ATOM 0 HA ARG A 43 -6.746 -11.557 10.921 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.727 -9.322 10.437 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -8.575 -10.826 9.550 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.152 -10.923 12.504 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.445 -10.517 11.394 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.287 -12.708 10.151 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -9.085 -13.105 11.846 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.391 -13.392 12.063 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.637 -11.743 9.026 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -12.285 -11.890 8.406 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -13.500 -13.574 11.254 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -13.897 -12.921 9.661 1.00 0.00 H new ATOM 754 N PHE A 44 -5.876 -8.425 10.588 1.00 0.00 N ATOM 755 CA PHE A 44 -5.011 -7.507 9.877 1.00 0.00 C ATOM 756 C PHE A 44 -3.554 -7.878 10.147 1.00 0.00 C ATOM 757 O PHE A 44 -2.773 -8.095 9.221 1.00 0.00 O ATOM 758 CB PHE A 44 -5.296 -6.074 10.324 1.00 0.00 C ATOM 759 CG PHE A 44 -4.080 -5.205 10.345 1.00 0.00 C ATOM 760 CD1 PHE A 44 -3.609 -4.625 9.182 1.00 0.00 C ATOM 761 CD2 PHE A 44 -3.410 -4.980 11.528 1.00 0.00 C ATOM 762 CE1 PHE A 44 -2.484 -3.830 9.198 1.00 0.00 C ATOM 763 CE2 PHE A 44 -2.281 -4.184 11.557 1.00 0.00 C ATOM 764 CZ PHE A 44 -1.816 -3.608 10.390 1.00 0.00 C ATOM 0 H PHE A 44 -6.269 -8.048 11.451 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.200 -7.575 8.806 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -6.037 -5.634 9.656 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -5.737 -6.093 11.321 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -4.128 -4.797 8.251 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -3.771 -5.430 12.441 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -2.124 -3.381 8.284 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.763 -4.012 12.489 1.00 0.00 H new ATOM 0 HZ PHE A 44 -0.933 -2.986 10.408 1.00 0.00 H new ATOM 774 N GLN A 45 -3.205 -7.965 11.432 1.00 0.00 N ATOM 775 CA GLN A 45 -1.850 -8.329 11.835 1.00 0.00 C ATOM 776 C GLN A 45 -1.470 -9.677 11.231 1.00 0.00 C ATOM 777 O GLN A 45 -0.309 -9.924 10.905 1.00 0.00 O ATOM 778 CB GLN A 45 -1.745 -8.386 13.362 1.00 0.00 C ATOM 779 CG GLN A 45 -0.548 -7.630 13.917 1.00 0.00 C ATOM 780 CD GLN A 45 0.649 -8.529 14.157 1.00 0.00 C ATOM 781 OE1 GLN A 45 0.643 -9.702 13.785 1.00 0.00 O ATOM 782 NE2 GLN A 45 1.685 -7.982 14.783 1.00 0.00 N ATOM 0 H GLN A 45 -3.842 -7.788 12.208 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.160 -7.570 11.468 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -2.657 -7.976 13.796 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -1.683 -9.428 13.675 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -0.269 -6.838 13.222 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -0.829 -7.148 14.853 1.00 0.00 H new ATOM 0 HE21 GLN A 45 1.647 -7.005 15.074 1.00 0.00 H new ATOM 0 HE22 GLN A 45 2.518 -8.539 14.973 1.00 0.00 H new ATOM 791 N ASN A 46 -2.473 -10.534 11.064 1.00 0.00 N ATOM 792 CA ASN A 46 -2.271 -11.851 10.471 1.00 0.00 C ATOM 793 C ASN A 46 -2.260 -11.724 8.955 1.00 0.00 C ATOM 794 O ASN A 46 -1.603 -12.496 8.256 1.00 0.00 O ATOM 795 CB ASN A 46 -3.371 -12.821 10.909 1.00 0.00 C ATOM 796 CG ASN A 46 -3.050 -13.500 12.225 1.00 0.00 C ATOM 797 OD1 ASN A 46 -1.887 -13.630 12.603 1.00 0.00 O ATOM 798 ND2 ASN A 46 -4.086 -13.939 12.932 1.00 0.00 N ATOM 0 H ASN A 46 -3.437 -10.338 11.332 1.00 0.00 H new ATOM 0 HA ASN A 46 -1.315 -12.248 10.813 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.313 -12.280 11.002 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -3.513 -13.578 10.138 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -3.932 -14.405 13.826 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -5.035 -13.810 12.580 1.00 0.00 H new ATOM 805 N ALA A 47 -2.967 -10.713 8.462 1.00 0.00 N ATOM 806 CA ALA A 47 -3.023 -10.436 7.040 1.00 0.00 C ATOM 807 C ALA A 47 -1.654 -9.969 6.591 1.00 0.00 C ATOM 808 O ALA A 47 -1.225 -10.235 5.468 1.00 0.00 O ATOM 809 CB ALA A 47 -4.081 -9.384 6.737 1.00 0.00 C ATOM 0 H ALA A 47 -3.512 -10.069 9.036 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.300 -11.340 6.497 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.106 -9.191 5.664 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -5.056 -9.744 7.064 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.839 -8.462 7.266 1.00 0.00 H new ATOM 815 N CYS A 48 -0.952 -9.305 7.507 1.00 0.00 N ATOM 816 CA CYS A 48 0.398 -8.843 7.231 1.00 0.00 C ATOM 817 C CYS A 48 1.289 -10.052 7.001 1.00 0.00 C ATOM 818 O CYS A 48 2.338 -9.958 6.365 1.00 0.00 O ATOM 819 CB CYS A 48 0.932 -8.000 8.391 1.00 0.00 C ATOM 820 SG CYS A 48 0.461 -6.256 8.314 1.00 0.00 S ATOM 0 H CYS A 48 -1.297 -9.078 8.440 1.00 0.00 H new ATOM 0 HA CYS A 48 0.391 -8.214 6.341 1.00 0.00 H new ATOM 0 HB2 CYS A 48 0.571 -8.422 9.329 1.00 0.00 H new ATOM 0 HB3 CYS A 48 2.020 -8.071 8.407 1.00 0.00 H new ATOM 0 HG CYS A 48 0.957 -5.627 9.338 1.00 0.00 H new ATOM 826 N ARG A 49 0.837 -11.202 7.502 1.00 0.00 N ATOM 827 CA ARG A 49 1.571 -12.445 7.329 1.00 0.00 C ATOM 828 C ARG A 49 1.365 -12.963 5.906 1.00 0.00 C ATOM 829 O ARG A 49 2.216 -13.660 5.353 1.00 0.00 O ATOM 830 CB ARG A 49 1.125 -13.483 8.373 1.00 0.00 C ATOM 831 CG ARG A 49 0.326 -14.652 7.812 1.00 0.00 C ATOM 832 CD ARG A 49 0.020 -15.683 8.887 1.00 0.00 C ATOM 833 NE ARG A 49 -1.106 -16.540 8.521 1.00 0.00 N ATOM 834 CZ ARG A 49 -1.615 -17.475 9.320 1.00 0.00 C ATOM 835 NH1 ARG A 49 -1.105 -17.677 10.528 1.00 0.00 N ATOM 836 NH2 ARG A 49 -2.640 -18.211 8.909 1.00 0.00 N ATOM 0 H ARG A 49 -0.032 -11.293 8.029 1.00 0.00 H new ATOM 0 HA ARG A 49 2.635 -12.263 7.482 1.00 0.00 H new ATOM 0 HB2 ARG A 49 2.009 -13.874 8.876 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.523 -12.980 9.130 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -0.606 -14.285 7.383 1.00 0.00 H new ATOM 0 HG3 ARG A 49 0.886 -15.122 7.004 1.00 0.00 H new ATOM 0 HD2 ARG A 49 0.903 -16.299 9.060 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -0.202 -15.174 9.825 1.00 0.00 H new ATOM 0 HE ARG A 49 -1.526 -16.414 7.600 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -0.318 -17.114 10.850 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -1.500 -18.395 11.135 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -3.037 -18.060 7.982 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -3.031 -18.928 9.520 1.00 0.00 H new ATOM 850 N ASP A 50 0.227 -12.598 5.318 1.00 0.00 N ATOM 851 CA ASP A 50 -0.103 -13.000 3.956 1.00 0.00 C ATOM 852 C ASP A 50 0.246 -11.892 2.961 1.00 0.00 C ATOM 853 O ASP A 50 -0.023 -12.013 1.767 1.00 0.00 O ATOM 854 CB ASP A 50 -1.588 -13.349 3.850 1.00 0.00 C ATOM 855 CG ASP A 50 -2.000 -14.429 4.831 1.00 0.00 C ATOM 856 OD1 ASP A 50 -1.601 -15.594 4.632 1.00 0.00 O ATOM 857 OD2 ASP A 50 -2.721 -14.107 5.799 1.00 0.00 O ATOM 0 H ASP A 50 -0.484 -12.022 5.768 1.00 0.00 H new ATOM 0 HA ASP A 50 0.488 -13.883 3.711 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.183 -12.453 4.029 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.809 -13.680 2.835 1.00 0.00 H new ATOM 862 N GLY A 51 0.856 -10.815 3.460 1.00 0.00 N ATOM 863 CA GLY A 51 1.243 -9.709 2.603 1.00 0.00 C ATOM 864 C GLY A 51 0.073 -9.070 1.883 1.00 0.00 C ATOM 865 O GLY A 51 0.222 -8.582 0.765 1.00 0.00 O ATOM 0 H GLY A 51 1.088 -10.692 4.446 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.748 -8.952 3.204 1.00 0.00 H new ATOM 0 HA3 GLY A 51 1.964 -10.064 1.866 1.00 0.00 H new ATOM 869 N ARG A 52 -1.090 -9.069 2.520 1.00 0.00 N ATOM 870 CA ARG A 52 -2.281 -8.478 1.928 1.00 0.00 C ATOM 871 C ARG A 52 -3.232 -7.937 2.982 1.00 0.00 C ATOM 872 O ARG A 52 -3.618 -8.642 3.914 1.00 0.00 O ATOM 873 CB ARG A 52 -3.003 -9.503 1.066 1.00 0.00 C ATOM 874 CG ARG A 52 -2.422 -9.595 -0.323 1.00 0.00 C ATOM 875 CD ARG A 52 -1.958 -11.005 -0.640 1.00 0.00 C ATOM 876 NE ARG A 52 -3.063 -11.865 -1.056 1.00 0.00 N ATOM 877 CZ ARG A 52 -2.905 -13.018 -1.703 1.00 0.00 C ATOM 878 NH1 ARG A 52 -1.688 -13.450 -2.013 1.00 0.00 N ATOM 879 NH2 ARG A 52 -3.964 -13.739 -2.042 1.00 0.00 N ATOM 0 H ARG A 52 -1.234 -9.471 3.446 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.955 -7.641 1.310 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -2.949 -10.480 1.545 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.058 -9.239 0.999 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -3.170 -9.284 -1.053 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.583 -8.906 -0.414 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.208 -10.971 -1.430 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.476 -11.434 0.238 1.00 0.00 H new ATOM 0 HE ARG A 52 -4.013 -11.564 -0.838 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -0.870 -12.898 -1.755 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.571 -14.334 -2.509 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -4.901 -13.411 -1.807 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.842 -14.622 -2.538 1.00 0.00 H new ATOM 893 N SER A 53 -3.620 -6.685 2.806 1.00 0.00 N ATOM 894 CA SER A 53 -4.550 -6.032 3.719 1.00 0.00 C ATOM 895 C SER A 53 -5.472 -5.078 2.963 1.00 0.00 C ATOM 896 O SER A 53 -5.218 -4.728 1.807 1.00 0.00 O ATOM 897 CB SER A 53 -3.801 -5.282 4.820 1.00 0.00 C ATOM 898 OG SER A 53 -4.436 -5.449 6.076 1.00 0.00 O ATOM 0 H SER A 53 -3.305 -6.096 2.035 1.00 0.00 H new ATOM 0 HA SER A 53 -5.159 -6.807 4.185 1.00 0.00 H new ATOM 0 HB2 SER A 53 -2.775 -5.644 4.877 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.751 -4.222 4.573 1.00 0.00 H new ATOM 0 HG SER A 53 -3.879 -6.013 6.652 1.00 0.00 H new ATOM 904 N GLU A 54 -6.533 -4.652 3.633 1.00 0.00 N ATOM 905 CA GLU A 54 -7.495 -3.726 3.049 1.00 0.00 C ATOM 906 C GLU A 54 -7.713 -2.552 3.991 1.00 0.00 C ATOM 907 O GLU A 54 -8.374 -2.685 5.021 1.00 0.00 O ATOM 908 CB GLU A 54 -8.821 -4.435 2.765 1.00 0.00 C ATOM 909 CG GLU A 54 -9.280 -4.304 1.322 1.00 0.00 C ATOM 910 CD GLU A 54 -10.525 -5.118 1.030 1.00 0.00 C ATOM 911 OE1 GLU A 54 -11.531 -4.942 1.748 1.00 0.00 O ATOM 912 OE2 GLU A 54 -10.493 -5.931 0.083 1.00 0.00 O ATOM 0 H GLU A 54 -6.751 -4.935 4.588 1.00 0.00 H new ATOM 0 HA GLU A 54 -7.099 -3.356 2.104 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -8.719 -5.492 3.011 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -9.590 -4.027 3.421 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -9.476 -3.255 1.101 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -8.477 -4.625 0.659 1.00 0.00 H new ATOM 919 N ILE A 55 -7.133 -1.409 3.649 1.00 0.00 N ATOM 920 CA ILE A 55 -7.246 -0.223 4.487 1.00 0.00 C ATOM 921 C ILE A 55 -8.065 0.871 3.816 1.00 0.00 C ATOM 922 O ILE A 55 -7.965 1.092 2.609 1.00 0.00 O ATOM 923 CB ILE A 55 -5.860 0.352 4.844 1.00 0.00 C ATOM 924 CG1 ILE A 55 -4.798 -0.752 4.862 1.00 0.00 C ATOM 925 CG2 ILE A 55 -5.913 1.061 6.189 1.00 0.00 C ATOM 926 CD1 ILE A 55 -5.066 -1.835 5.884 1.00 0.00 C ATOM 0 H ILE A 55 -6.582 -1.278 2.801 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.754 -0.544 5.396 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.583 1.076 4.078 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -4.740 -1.205 3.872 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.825 -0.305 5.066 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -4.928 1.462 6.428 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -6.635 1.876 6.142 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -6.214 0.354 6.962 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.273 -2.582 5.839 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -5.094 -1.395 6.881 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.024 -2.309 5.669 1.00 0.00 H new ATOM 938 N ALA A 56 -8.855 1.569 4.622 1.00 0.00 N ATOM 939 CA ALA A 56 -9.676 2.667 4.134 1.00 0.00 C ATOM 940 C ALA A 56 -8.888 3.967 4.217 1.00 0.00 C ATOM 941 O ALA A 56 -7.967 4.085 5.024 1.00 0.00 O ATOM 942 CB ALA A 56 -10.965 2.766 4.936 1.00 0.00 C ATOM 0 H ALA A 56 -8.944 1.392 5.623 1.00 0.00 H new ATOM 0 HA ALA A 56 -9.942 2.480 3.094 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -11.567 3.592 4.557 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -11.525 1.836 4.841 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.728 2.941 5.985 1.00 0.00 H new ATOM 948 N PHE A 57 -9.230 4.931 3.375 1.00 0.00 N ATOM 949 CA PHE A 57 -8.515 6.199 3.367 1.00 0.00 C ATOM 950 C PHE A 57 -9.421 7.325 3.864 1.00 0.00 C ATOM 951 O PHE A 57 -10.504 7.544 3.322 1.00 0.00 O ATOM 952 CB PHE A 57 -8.025 6.492 1.947 1.00 0.00 C ATOM 953 CG PHE A 57 -6.726 7.245 1.884 1.00 0.00 C ATOM 954 CD1 PHE A 57 -6.238 7.928 2.988 1.00 0.00 C ATOM 955 CD2 PHE A 57 -5.979 7.248 0.717 1.00 0.00 C ATOM 956 CE1 PHE A 57 -5.034 8.598 2.926 1.00 0.00 C ATOM 957 CE2 PHE A 57 -4.774 7.914 0.650 1.00 0.00 C ATOM 958 CZ PHE A 57 -4.300 8.593 1.756 1.00 0.00 C ATOM 0 H PHE A 57 -9.988 4.862 2.696 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.658 6.135 4.037 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.911 5.549 1.413 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.790 7.065 1.422 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.807 7.935 3.906 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.346 6.721 -0.152 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.665 9.127 3.793 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -4.201 7.905 -0.266 1.00 0.00 H new ATOM 0 HZ PHE A 57 -3.358 9.119 1.706 1.00 0.00 H new ATOM 968 N VAL A 58 -8.979 8.032 4.905 1.00 0.00 N ATOM 969 CA VAL A 58 -9.766 9.125 5.473 1.00 0.00 C ATOM 970 C VAL A 58 -9.684 10.382 4.612 1.00 0.00 C ATOM 971 O VAL A 58 -10.571 11.234 4.662 1.00 0.00 O ATOM 972 CB VAL A 58 -9.311 9.471 6.904 1.00 0.00 C ATOM 973 CG1 VAL A 58 -10.303 10.418 7.564 1.00 0.00 C ATOM 974 CG2 VAL A 58 -9.134 8.208 7.736 1.00 0.00 C ATOM 0 H VAL A 58 -8.086 7.868 5.369 1.00 0.00 H new ATOM 0 HA VAL A 58 -10.798 8.775 5.501 1.00 0.00 H new ATOM 0 HB VAL A 58 -8.345 9.973 6.844 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -9.966 10.652 8.574 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -10.371 11.337 6.982 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -11.284 9.944 7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.813 8.477 8.742 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -10.081 7.672 7.789 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.381 7.570 7.273 1.00 0.00 H new ATOM 984 N ALA A 59 -8.617 10.495 3.824 1.00 0.00 N ATOM 985 CA ALA A 59 -8.419 11.652 2.952 1.00 0.00 C ATOM 986 C ALA A 59 -9.712 12.045 2.241 1.00 0.00 C ATOM 987 O ALA A 59 -10.155 13.190 2.324 1.00 0.00 O ATOM 988 CB ALA A 59 -7.327 11.363 1.935 1.00 0.00 C ATOM 0 H ALA A 59 -7.874 9.798 3.771 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.113 12.492 3.576 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -7.189 12.232 1.292 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -6.394 11.145 2.455 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -7.613 10.504 1.328 1.00 0.00 H new ATOM 994 N THR A 60 -10.312 11.086 1.544 1.00 0.00 N ATOM 995 CA THR A 60 -11.555 11.330 0.823 1.00 0.00 C ATOM 996 C THR A 60 -12.510 10.143 0.953 1.00 0.00 C ATOM 997 O THR A 60 -13.473 10.021 0.196 1.00 0.00 O ATOM 998 CB THR A 60 -11.264 11.618 -0.654 1.00 0.00 C ATOM 999 OG1 THR A 60 -12.444 11.516 -1.430 1.00 0.00 O ATOM 1000 CG2 THR A 60 -10.235 10.685 -1.258 1.00 0.00 C ATOM 0 H THR A 60 -9.957 10.133 1.463 1.00 0.00 H new ATOM 0 HA THR A 60 -12.037 12.202 1.266 1.00 0.00 H new ATOM 0 HB THR A 60 -10.866 12.632 -0.674 1.00 0.00 H new ATOM 0 HG1 THR A 60 -13.001 10.788 -1.084 1.00 0.00 H new ATOM 0 HG21 THR A 60 -10.078 10.945 -2.305 1.00 0.00 H new ATOM 0 HG22 THR A 60 -9.295 10.780 -0.715 1.00 0.00 H new ATOM 0 HG23 THR A 60 -10.591 9.657 -1.190 1.00 0.00 H new ATOM 1008 N GLY A 61 -12.241 9.270 1.922 1.00 0.00 N ATOM 1009 CA GLY A 61 -13.088 8.112 2.132 1.00 0.00 C ATOM 1010 C GLY A 61 -13.034 7.136 0.974 1.00 0.00 C ATOM 1011 O GLY A 61 -14.054 6.852 0.344 1.00 0.00 O ATOM 0 H GLY A 61 -11.452 9.346 2.564 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.782 7.603 3.046 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -14.117 8.440 2.279 1.00 0.00 H new ATOM 1015 N THR A 62 -11.843 6.621 0.690 1.00 0.00 N ATOM 1016 CA THR A 62 -11.660 5.672 -0.401 1.00 0.00 C ATOM 1017 C THR A 62 -11.090 4.353 0.109 1.00 0.00 C ATOM 1018 O THR A 62 -10.065 4.331 0.792 1.00 0.00 O ATOM 1019 CB THR A 62 -10.736 6.262 -1.469 1.00 0.00 C ATOM 1020 OG1 THR A 62 -10.486 5.316 -2.493 1.00 0.00 O ATOM 1021 CG2 THR A 62 -9.397 6.713 -0.925 1.00 0.00 C ATOM 0 H THR A 62 -10.989 6.845 1.201 1.00 0.00 H new ATOM 0 HA THR A 62 -12.637 5.475 -0.843 1.00 0.00 H new ATOM 0 HB THR A 62 -11.264 7.134 -1.855 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.895 5.712 -3.167 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.793 7.120 -1.736 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.552 7.481 -0.167 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.880 5.863 -0.480 1.00 0.00 H new ATOM 1029 N ASN A 63 -11.754 3.253 -0.233 1.00 0.00 N ATOM 1030 CA ASN A 63 -11.304 1.930 0.184 1.00 0.00 C ATOM 1031 C ASN A 63 -10.170 1.458 -0.716 1.00 0.00 C ATOM 1032 O ASN A 63 -10.233 1.611 -1.936 1.00 0.00 O ATOM 1033 CB ASN A 63 -12.462 0.931 0.140 1.00 0.00 C ATOM 1034 CG ASN A 63 -12.247 -0.244 1.072 1.00 0.00 C ATOM 1035 OD1 ASN A 63 -12.431 -0.132 2.284 1.00 0.00 O ATOM 1036 ND2 ASN A 63 -11.856 -1.381 0.510 1.00 0.00 N ATOM 0 H ASN A 63 -12.604 3.252 -0.797 1.00 0.00 H new ATOM 0 HA ASN A 63 -10.941 1.993 1.210 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.388 1.440 0.409 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -12.584 0.565 -0.879 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -11.696 -2.207 1.087 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -11.716 -1.429 -0.499 1.00 0.00 H new ATOM 1043 N LEU A 64 -9.124 0.902 -0.115 1.00 0.00 N ATOM 1044 CA LEU A 64 -7.977 0.436 -0.883 1.00 0.00 C ATOM 1045 C LEU A 64 -7.521 -0.954 -0.454 1.00 0.00 C ATOM 1046 O LEU A 64 -7.149 -1.174 0.700 1.00 0.00 O ATOM 1047 CB LEU A 64 -6.815 1.420 -0.738 1.00 0.00 C ATOM 1048 CG LEU A 64 -7.193 2.897 -0.872 1.00 0.00 C ATOM 1049 CD1 LEU A 64 -6.378 3.748 0.089 1.00 0.00 C ATOM 1050 CD2 LEU A 64 -6.991 3.369 -2.306 1.00 0.00 C ATOM 0 H LEU A 64 -9.047 0.764 0.893 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.290 0.377 -1.925 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.350 1.267 0.236 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.063 1.184 -1.491 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.247 3.007 -0.617 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -6.662 4.795 -0.022 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -6.570 3.426 1.113 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -5.317 3.634 -0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -7.264 4.421 -2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -5.945 3.244 -2.586 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.619 2.780 -2.975 1.00 0.00 H new ATOM 1062 N SER A 65 -7.517 -1.878 -1.409 1.00 0.00 N ATOM 1063 CA SER A 65 -7.066 -3.241 -1.163 1.00 0.00 C ATOM 1064 C SER A 65 -5.692 -3.419 -1.793 1.00 0.00 C ATOM 1065 O SER A 65 -5.564 -3.447 -3.017 1.00 0.00 O ATOM 1066 CB SER A 65 -8.054 -4.251 -1.751 1.00 0.00 C ATOM 1067 OG SER A 65 -9.389 -3.912 -1.419 1.00 0.00 O ATOM 0 H SER A 65 -7.823 -1.705 -2.366 1.00 0.00 H new ATOM 0 HA SER A 65 -7.008 -3.417 -0.089 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.943 -4.284 -2.835 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.825 -5.249 -1.376 1.00 0.00 H new ATOM 0 HG SER A 65 -10.000 -4.572 -1.808 1.00 0.00 H new ATOM 1073 N LEU A 66 -4.658 -3.493 -0.962 1.00 0.00 N ATOM 1074 CA LEU A 66 -3.298 -3.614 -1.472 1.00 0.00 C ATOM 1075 C LEU A 66 -2.639 -4.929 -1.084 1.00 0.00 C ATOM 1076 O LEU A 66 -2.927 -5.506 -0.035 1.00 0.00 O ATOM 1077 CB LEU A 66 -2.444 -2.451 -0.968 1.00 0.00 C ATOM 1078 CG LEU A 66 -3.096 -1.070 -1.080 1.00 0.00 C ATOM 1079 CD1 LEU A 66 -3.649 -0.629 0.267 1.00 0.00 C ATOM 1080 CD2 LEU A 66 -2.096 -0.053 -1.607 1.00 0.00 C ATOM 0 H LEU A 66 -4.734 -3.472 0.055 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.367 -3.590 -2.560 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.191 -2.632 0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.508 -2.440 -1.526 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.925 -1.135 -1.785 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.108 0.354 0.167 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.397 -1.346 0.606 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.839 -0.579 0.994 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.575 0.923 -1.681 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.247 0.010 -0.926 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.748 -0.362 -2.593 1.00 0.00 H new ATOM 1092 N GLN A 67 -1.724 -5.372 -1.939 1.00 0.00 N ATOM 1093 CA GLN A 67 -0.973 -6.596 -1.707 1.00 0.00 C ATOM 1094 C GLN A 67 0.505 -6.256 -1.568 1.00 0.00 C ATOM 1095 O GLN A 67 1.179 -5.954 -2.552 1.00 0.00 O ATOM 1096 CB GLN A 67 -1.184 -7.583 -2.858 1.00 0.00 C ATOM 1097 CG GLN A 67 -0.834 -7.011 -4.222 1.00 0.00 C ATOM 1098 CD GLN A 67 -2.027 -6.951 -5.156 1.00 0.00 C ATOM 1099 OE1 GLN A 67 -2.665 -7.966 -5.432 1.00 0.00 O ATOM 1100 NE2 GLN A 67 -2.334 -5.756 -5.647 1.00 0.00 N ATOM 0 H GLN A 67 -1.484 -4.894 -2.808 1.00 0.00 H new ATOM 0 HA GLN A 67 -1.327 -7.066 -0.789 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -0.578 -8.471 -2.679 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -2.226 -7.904 -2.864 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -0.425 -6.008 -4.097 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -0.052 -7.619 -4.677 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.777 -4.941 -5.391 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -3.127 -5.653 -6.280 1.00 0.00 H new ATOM 1109 N PHE A 68 0.999 -6.286 -0.338 1.00 0.00 N ATOM 1110 CA PHE A 68 2.394 -5.957 -0.069 1.00 0.00 C ATOM 1111 C PHE A 68 3.254 -7.175 0.242 1.00 0.00 C ATOM 1112 O PHE A 68 2.960 -7.976 1.129 1.00 0.00 O ATOM 1113 CB PHE A 68 2.512 -4.905 1.039 1.00 0.00 C ATOM 1114 CG PHE A 68 1.280 -4.737 1.881 1.00 0.00 C ATOM 1115 CD1 PHE A 68 0.743 -5.788 2.615 1.00 0.00 C ATOM 1116 CD2 PHE A 68 0.657 -3.503 1.930 1.00 0.00 C ATOM 1117 CE1 PHE A 68 -0.392 -5.598 3.380 1.00 0.00 C ATOM 1118 CE2 PHE A 68 -0.474 -3.312 2.689 1.00 0.00 C ATOM 1119 CZ PHE A 68 -0.999 -4.357 3.415 1.00 0.00 C ATOM 0 H PHE A 68 0.456 -6.534 0.489 1.00 0.00 H new ATOM 0 HA PHE A 68 2.786 -5.535 -0.994 1.00 0.00 H new ATOM 0 HB2 PHE A 68 3.345 -5.174 1.688 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.758 -3.945 0.585 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.216 -6.759 2.587 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.064 -2.678 1.364 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.804 -6.418 3.950 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.950 -2.343 2.715 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.886 -4.207 4.012 1.00 0.00 H new ATOM 1129 N PHE A 69 4.337 -7.268 -0.518 1.00 0.00 N ATOM 1130 CA PHE A 69 5.325 -8.335 -0.402 1.00 0.00 C ATOM 1131 C PHE A 69 6.641 -7.876 -1.024 1.00 0.00 C ATOM 1132 O PHE A 69 6.636 -7.143 -2.012 1.00 0.00 O ATOM 1133 CB PHE A 69 4.850 -9.603 -1.112 1.00 0.00 C ATOM 1134 CG PHE A 69 4.079 -10.554 -0.243 1.00 0.00 C ATOM 1135 CD1 PHE A 69 4.475 -10.810 1.063 1.00 0.00 C ATOM 1136 CD2 PHE A 69 2.965 -11.205 -0.742 1.00 0.00 C ATOM 1137 CE1 PHE A 69 3.768 -11.703 1.848 1.00 0.00 C ATOM 1138 CE2 PHE A 69 2.256 -12.093 0.040 1.00 0.00 C ATOM 1139 CZ PHE A 69 2.659 -12.344 1.336 1.00 0.00 C ATOM 0 H PHE A 69 4.559 -6.591 -1.248 1.00 0.00 H new ATOM 0 HA PHE A 69 5.465 -8.560 0.655 1.00 0.00 H new ATOM 0 HB2 PHE A 69 4.226 -9.317 -1.959 1.00 0.00 H new ATOM 0 HB3 PHE A 69 5.718 -10.124 -1.517 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.341 -10.308 1.469 1.00 0.00 H new ATOM 0 HD2 PHE A 69 2.646 -11.016 -1.756 1.00 0.00 H new ATOM 0 HE1 PHE A 69 4.084 -11.898 2.862 1.00 0.00 H new ATOM 0 HE2 PHE A 69 1.386 -12.592 -0.362 1.00 0.00 H new ATOM 0 HZ PHE A 69 2.107 -13.041 1.948 1.00 0.00 H new ATOM 1149 N PRO A 70 7.787 -8.303 -0.476 1.00 0.00 N ATOM 1150 CA PRO A 70 9.092 -7.919 -1.017 1.00 0.00 C ATOM 1151 C PRO A 70 9.176 -8.146 -2.524 1.00 0.00 C ATOM 1152 O PRO A 70 9.177 -9.283 -2.993 1.00 0.00 O ATOM 1153 CB PRO A 70 10.067 -8.835 -0.276 1.00 0.00 C ATOM 1154 CG PRO A 70 9.377 -9.165 1.005 1.00 0.00 C ATOM 1155 CD PRO A 70 7.905 -9.192 0.694 1.00 0.00 C ATOM 0 HA PRO A 70 9.301 -6.858 -0.877 1.00 0.00 H new ATOM 0 HB2 PRO A 70 10.282 -9.734 -0.853 1.00 0.00 H new ATOM 0 HB3 PRO A 70 11.020 -8.337 -0.096 1.00 0.00 H new ATOM 0 HG2 PRO A 70 9.711 -10.128 1.390 1.00 0.00 H new ATOM 0 HG3 PRO A 70 9.600 -8.421 1.770 1.00 0.00 H new ATOM 0 HD2 PRO A 70 7.560 -10.201 0.468 1.00 0.00 H new ATOM 0 HD3 PRO A 70 7.310 -8.832 1.534 1.00 0.00 H new ATOM 1163 N ALA A 71 9.233 -7.051 -3.277 1.00 0.00 N ATOM 1164 CA ALA A 71 9.305 -7.117 -4.734 1.00 0.00 C ATOM 1165 C ALA A 71 10.449 -8.009 -5.210 1.00 0.00 C ATOM 1166 O ALA A 71 10.431 -8.504 -6.338 1.00 0.00 O ATOM 1167 CB ALA A 71 9.449 -5.720 -5.317 1.00 0.00 C ATOM 0 H ALA A 71 9.231 -6.103 -2.900 1.00 0.00 H new ATOM 0 HA ALA A 71 8.375 -7.561 -5.088 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.502 -5.783 -6.404 1.00 0.00 H new ATOM 0 HB2 ALA A 71 8.589 -5.115 -5.030 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.360 -5.259 -4.936 1.00 0.00 H new ATOM 1173 N SER A 72 11.446 -8.212 -4.353 1.00 0.00 N ATOM 1174 CA SER A 72 12.593 -9.043 -4.702 1.00 0.00 C ATOM 1175 C SER A 72 12.379 -10.494 -4.272 1.00 0.00 C ATOM 1176 O SER A 72 13.307 -11.154 -3.803 1.00 0.00 O ATOM 1177 CB SER A 72 13.864 -8.490 -4.056 1.00 0.00 C ATOM 1178 OG SER A 72 13.636 -8.135 -2.703 1.00 0.00 O ATOM 0 H SER A 72 11.482 -7.814 -3.415 1.00 0.00 H new ATOM 0 HA SER A 72 12.702 -9.022 -5.786 1.00 0.00 H new ATOM 0 HB2 SER A 72 14.657 -9.235 -4.111 1.00 0.00 H new ATOM 0 HB3 SER A 72 14.208 -7.617 -4.611 1.00 0.00 H new ATOM 0 HG SER A 72 14.464 -7.786 -2.312 1.00 0.00 H new ATOM 1184 N TRP A 73 11.154 -10.986 -4.438 1.00 0.00 N ATOM 1185 CA TRP A 73 10.825 -12.359 -4.069 1.00 0.00 C ATOM 1186 C TRP A 73 10.223 -13.109 -5.254 1.00 0.00 C ATOM 1187 O TRP A 73 9.401 -12.567 -5.991 1.00 0.00 O ATOM 1188 CB TRP A 73 9.845 -12.376 -2.895 1.00 0.00 C ATOM 1189 CG TRP A 73 10.517 -12.394 -1.556 1.00 0.00 C ATOM 1190 CD1 TRP A 73 11.655 -11.726 -1.200 1.00 0.00 C ATOM 1191 CD2 TRP A 73 10.094 -13.114 -0.393 1.00 0.00 C ATOM 1192 NE1 TRP A 73 11.964 -11.988 0.113 1.00 0.00 N ATOM 1193 CE2 TRP A 73 11.021 -12.838 0.631 1.00 0.00 C ATOM 1194 CE3 TRP A 73 9.021 -13.966 -0.117 1.00 0.00 C ATOM 1195 CZ2 TRP A 73 10.906 -13.383 1.907 1.00 0.00 C ATOM 1196 CZ3 TRP A 73 8.908 -14.507 1.150 1.00 0.00 C ATOM 1197 CH2 TRP A 73 9.846 -14.213 2.149 1.00 0.00 C ATOM 0 H TRP A 73 10.374 -10.455 -4.825 1.00 0.00 H new ATOM 0 HA TRP A 73 11.747 -12.858 -3.771 1.00 0.00 H new ATOM 0 HB2 TRP A 73 9.200 -11.499 -2.957 1.00 0.00 H new ATOM 0 HB3 TRP A 73 9.202 -13.252 -2.982 1.00 0.00 H new ATOM 0 HD1 TRP A 73 12.228 -11.086 -1.855 1.00 0.00 H new ATOM 0 HE1 TRP A 73 12.765 -11.611 0.620 1.00 0.00 H new ATOM 0 HE3 TRP A 73 8.293 -14.198 -0.880 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 11.628 -13.158 2.678 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 8.083 -15.167 1.374 1.00 0.00 H new ATOM 0 HH2 TRP A 73 9.730 -14.651 3.130 1.00 0.00 H new ATOM 1208 N GLN A 74 10.638 -14.360 -5.430 1.00 0.00 N ATOM 1209 CA GLN A 74 10.138 -15.185 -6.523 1.00 0.00 C ATOM 1210 C GLN A 74 9.671 -16.542 -6.009 1.00 0.00 C ATOM 1211 O GLN A 74 10.408 -17.527 -6.068 1.00 0.00 O ATOM 1212 CB GLN A 74 11.223 -15.373 -7.587 1.00 0.00 C ATOM 1213 CG GLN A 74 11.133 -14.373 -8.729 1.00 0.00 C ATOM 1214 CD GLN A 74 11.939 -14.800 -9.940 1.00 0.00 C ATOM 1215 OE1 GLN A 74 12.790 -14.055 -10.428 1.00 0.00 O ATOM 1216 NE2 GLN A 74 11.675 -16.005 -10.434 1.00 0.00 N ATOM 0 H GLN A 74 11.319 -14.824 -4.829 1.00 0.00 H new ATOM 0 HA GLN A 74 9.286 -14.674 -6.971 1.00 0.00 H new ATOM 0 HB2 GLN A 74 12.202 -15.287 -7.115 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.152 -16.382 -7.992 1.00 0.00 H new ATOM 0 HG2 GLN A 74 10.089 -14.248 -9.017 1.00 0.00 H new ATOM 0 HG3 GLN A 74 11.487 -13.401 -8.385 1.00 0.00 H new ATOM 0 HE21 GLN A 74 10.962 -16.590 -9.998 1.00 0.00 H new ATOM 0 HE22 GLN A 74 12.186 -16.345 -11.249 1.00 0.00 H new ATOM 1225 N GLY A 75 8.442 -16.588 -5.506 1.00 0.00 N ATOM 1226 CA GLY A 75 7.898 -17.830 -4.989 1.00 0.00 C ATOM 1227 C GLY A 75 8.647 -18.325 -3.767 1.00 0.00 C ATOM 1228 O GLY A 75 9.363 -19.326 -3.832 1.00 0.00 O ATOM 0 H GLY A 75 7.813 -15.787 -5.447 1.00 0.00 H new ATOM 0 HA2 GLY A 75 6.848 -17.685 -4.734 1.00 0.00 H new ATOM 0 HA3 GLY A 75 7.935 -18.592 -5.768 1.00 0.00 H new ATOM 1232 N GLU A 76 8.485 -17.623 -2.650 1.00 0.00 N ATOM 1233 CA GLU A 76 9.152 -17.995 -1.409 1.00 0.00 C ATOM 1234 C GLU A 76 8.154 -18.080 -0.257 1.00 0.00 C ATOM 1235 O GLU A 76 8.382 -17.528 0.820 1.00 0.00 O ATOM 1236 CB GLU A 76 10.252 -16.985 -1.075 1.00 0.00 C ATOM 1237 CG GLU A 76 11.536 -17.202 -1.858 1.00 0.00 C ATOM 1238 CD GLU A 76 12.754 -16.642 -1.150 1.00 0.00 C ATOM 1239 OE1 GLU A 76 12.734 -15.445 -0.793 1.00 0.00 O ATOM 1240 OE2 GLU A 76 13.727 -17.399 -0.953 1.00 0.00 O ATOM 0 H GLU A 76 7.897 -16.793 -2.580 1.00 0.00 H new ATOM 0 HA GLU A 76 9.601 -18.978 -1.548 1.00 0.00 H new ATOM 0 HB2 GLU A 76 9.882 -15.979 -1.272 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.473 -17.040 -0.009 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.678 -18.269 -2.027 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.443 -16.734 -2.838 1.00 0.00 H new ATOM 1247 N GLN A 77 7.047 -18.776 -0.491 1.00 0.00 N ATOM 1248 CA GLN A 77 6.013 -18.935 0.526 1.00 0.00 C ATOM 1249 C GLN A 77 6.578 -19.599 1.779 1.00 0.00 C ATOM 1250 O GLN A 77 6.082 -19.384 2.886 1.00 0.00 O ATOM 1251 CB GLN A 77 4.850 -19.763 -0.024 1.00 0.00 C ATOM 1252 CG GLN A 77 5.291 -21.020 -0.755 1.00 0.00 C ATOM 1253 CD GLN A 77 4.150 -21.992 -0.983 1.00 0.00 C ATOM 1254 OE1 GLN A 77 3.816 -22.319 -2.122 1.00 0.00 O ATOM 1255 NE2 GLN A 77 3.543 -22.459 0.102 1.00 0.00 N ATOM 0 H GLN A 77 6.842 -19.239 -1.376 1.00 0.00 H new ATOM 0 HA GLN A 77 5.649 -17.944 0.795 1.00 0.00 H new ATOM 0 HB2 GLN A 77 4.193 -20.043 0.799 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.264 -19.144 -0.703 1.00 0.00 H new ATOM 0 HG2 GLN A 77 5.726 -20.744 -1.716 1.00 0.00 H new ATOM 0 HG3 GLN A 77 6.075 -21.514 -0.181 1.00 0.00 H new ATOM 0 HE21 GLN A 77 3.852 -22.161 1.027 1.00 0.00 H new ATOM 0 HE22 GLN A 77 2.768 -23.115 0.010 1.00 0.00 H new ATOM 1264 N ARG A 78 7.617 -20.410 1.597 1.00 0.00 N ATOM 1265 CA ARG A 78 8.251 -21.109 2.710 1.00 0.00 C ATOM 1266 C ARG A 78 8.608 -20.142 3.834 1.00 0.00 C ATOM 1267 O ARG A 78 8.239 -20.351 4.989 1.00 0.00 O ATOM 1268 CB ARG A 78 9.513 -21.836 2.238 1.00 0.00 C ATOM 1269 CG ARG A 78 9.345 -22.580 0.922 1.00 0.00 C ATOM 1270 CD ARG A 78 8.146 -23.516 0.951 1.00 0.00 C ATOM 1271 NE ARG A 78 8.538 -24.913 0.785 1.00 0.00 N ATOM 1272 CZ ARG A 78 7.702 -25.880 0.413 1.00 0.00 C ATOM 1273 NH1 ARG A 78 6.426 -25.606 0.167 1.00 0.00 N ATOM 1274 NH2 ARG A 78 8.142 -27.124 0.287 1.00 0.00 N ATOM 0 H ARG A 78 8.038 -20.599 0.687 1.00 0.00 H new ATOM 0 HA ARG A 78 7.537 -21.839 3.092 1.00 0.00 H new ATOM 0 HB2 ARG A 78 10.319 -21.110 2.132 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.820 -22.545 3.007 1.00 0.00 H new ATOM 0 HG2 ARG A 78 9.226 -21.862 0.111 1.00 0.00 H new ATOM 0 HG3 ARG A 78 10.248 -23.153 0.710 1.00 0.00 H new ATOM 0 HD2 ARG A 78 7.617 -23.398 1.897 1.00 0.00 H new ATOM 0 HD3 ARG A 78 7.450 -23.238 0.159 1.00 0.00 H new ATOM 0 HE ARG A 78 9.510 -25.163 0.965 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.082 -24.651 0.263 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.790 -26.351 -0.118 1.00 0.00 H new ATOM 0 HH21 ARG A 78 9.121 -27.340 0.475 1.00 0.00 H new ATOM 0 HH22 ARG A 78 7.502 -27.865 0.002 1.00 0.00 H new ATOM 1288 N GLN A 79 9.334 -19.086 3.485 1.00 0.00 N ATOM 1289 CA GLN A 79 9.750 -18.085 4.461 1.00 0.00 C ATOM 1290 C GLN A 79 8.658 -17.040 4.674 1.00 0.00 C ATOM 1291 O GLN A 79 7.766 -16.879 3.841 1.00 0.00 O ATOM 1292 CB GLN A 79 11.042 -17.405 4.007 1.00 0.00 C ATOM 1293 CG GLN A 79 12.291 -18.226 4.283 1.00 0.00 C ATOM 1294 CD GLN A 79 13.514 -17.363 4.525 1.00 0.00 C ATOM 1295 OE1 GLN A 79 13.483 -16.435 5.332 1.00 0.00 O ATOM 1296 NE2 GLN A 79 14.600 -17.667 3.824 1.00 0.00 N ATOM 0 H GLN A 79 9.647 -18.901 2.532 1.00 0.00 H new ATOM 0 HA GLN A 79 9.928 -18.593 5.409 1.00 0.00 H new ATOM 0 HB2 GLN A 79 10.980 -17.202 2.938 1.00 0.00 H new ATOM 0 HB3 GLN A 79 11.132 -16.442 4.510 1.00 0.00 H new ATOM 0 HG2 GLN A 79 12.120 -18.860 5.153 1.00 0.00 H new ATOM 0 HG3 GLN A 79 12.480 -18.889 3.438 1.00 0.00 H new ATOM 0 HE21 GLN A 79 14.580 -18.446 3.165 1.00 0.00 H new ATOM 0 HE22 GLN A 79 15.454 -17.122 3.944 1.00 0.00 H new ATOM 1305 N THR A 80 8.735 -16.337 5.799 1.00 0.00 N ATOM 1306 CA THR A 80 7.763 -15.315 6.132 1.00 0.00 C ATOM 1307 C THR A 80 8.110 -13.988 5.461 1.00 0.00 C ATOM 1308 O THR A 80 9.282 -13.667 5.273 1.00 0.00 O ATOM 1309 CB THR A 80 7.693 -15.131 7.650 1.00 0.00 C ATOM 1310 OG1 THR A 80 6.748 -14.134 7.992 1.00 0.00 O ATOM 1311 CG2 THR A 80 9.018 -14.738 8.266 1.00 0.00 C ATOM 0 H THR A 80 9.468 -16.462 6.497 1.00 0.00 H new ATOM 0 HA THR A 80 6.790 -15.639 5.764 1.00 0.00 H new ATOM 0 HB THR A 80 7.400 -16.104 8.045 1.00 0.00 H new ATOM 0 HG1 THR A 80 6.717 -14.033 8.966 1.00 0.00 H new ATOM 0 HG21 THR A 80 8.899 -14.624 9.343 1.00 0.00 H new ATOM 0 HG22 THR A 80 9.758 -15.512 8.063 1.00 0.00 H new ATOM 0 HG23 THR A 80 9.353 -13.794 7.836 1.00 0.00 H new ATOM 1319 N PRO A 81 7.087 -13.197 5.089 1.00 0.00 N ATOM 1320 CA PRO A 81 7.280 -11.901 4.435 1.00 0.00 C ATOM 1321 C PRO A 81 8.334 -11.047 5.128 1.00 0.00 C ATOM 1322 O PRO A 81 8.855 -11.413 6.182 1.00 0.00 O ATOM 1323 CB PRO A 81 5.904 -11.222 4.532 1.00 0.00 C ATOM 1324 CG PRO A 81 5.049 -12.129 5.359 1.00 0.00 C ATOM 1325 CD PRO A 81 5.663 -13.496 5.268 1.00 0.00 C ATOM 0 HA PRO A 81 7.635 -12.025 3.412 1.00 0.00 H new ATOM 0 HB2 PRO A 81 5.987 -10.238 4.993 1.00 0.00 H new ATOM 0 HB3 PRO A 81 5.472 -11.075 3.542 1.00 0.00 H new ATOM 0 HG2 PRO A 81 5.011 -11.789 6.394 1.00 0.00 H new ATOM 0 HG3 PRO A 81 4.024 -12.139 4.989 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.482 -14.082 6.169 1.00 0.00 H new ATOM 0 HD3 PRO A 81 5.260 -14.066 4.431 1.00 0.00 H new ATOM 1333 N SER A 82 8.641 -9.903 4.528 1.00 0.00 N ATOM 1334 CA SER A 82 9.632 -8.988 5.086 1.00 0.00 C ATOM 1335 C SER A 82 8.975 -7.690 5.543 1.00 0.00 C ATOM 1336 O SER A 82 7.908 -7.319 5.054 1.00 0.00 O ATOM 1337 CB SER A 82 10.720 -8.690 4.051 1.00 0.00 C ATOM 1338 OG SER A 82 12.009 -8.746 4.637 1.00 0.00 O ATOM 0 H SER A 82 8.219 -9.586 3.655 1.00 0.00 H new ATOM 0 HA SER A 82 10.088 -9.467 5.953 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.657 -9.409 3.234 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.556 -7.703 3.620 1.00 0.00 H new ATOM 0 HG SER A 82 12.687 -8.554 3.956 1.00 0.00 H new ATOM 1344 N ARG A 83 9.621 -6.998 6.480 1.00 0.00 N ATOM 1345 CA ARG A 83 9.094 -5.736 6.991 1.00 0.00 C ATOM 1346 C ARG A 83 9.202 -4.630 5.941 1.00 0.00 C ATOM 1347 O ARG A 83 8.662 -3.539 6.121 1.00 0.00 O ATOM 1348 CB ARG A 83 9.816 -5.321 8.278 1.00 0.00 C ATOM 1349 CG ARG A 83 10.233 -6.491 9.160 1.00 0.00 C ATOM 1350 CD ARG A 83 9.651 -6.372 10.561 1.00 0.00 C ATOM 1351 NE ARG A 83 9.149 -7.653 11.055 1.00 0.00 N ATOM 1352 CZ ARG A 83 9.915 -8.584 11.619 1.00 0.00 C ATOM 1353 NH1 ARG A 83 11.220 -8.386 11.759 1.00 0.00 N ATOM 1354 NH2 ARG A 83 9.375 -9.719 12.041 1.00 0.00 N ATOM 0 H ARG A 83 10.505 -7.288 6.898 1.00 0.00 H new ATOM 0 HA ARG A 83 8.039 -5.888 7.221 1.00 0.00 H new ATOM 0 HB2 ARG A 83 10.702 -4.744 8.015 1.00 0.00 H new ATOM 0 HB3 ARG A 83 9.165 -4.661 8.851 1.00 0.00 H new ATOM 0 HG2 ARG A 83 9.902 -7.425 8.706 1.00 0.00 H new ATOM 0 HG3 ARG A 83 11.321 -6.533 9.220 1.00 0.00 H new ATOM 0 HD2 ARG A 83 10.416 -5.996 11.241 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.841 -5.642 10.557 1.00 0.00 H new ATOM 0 HE ARG A 83 8.152 -7.845 10.962 1.00 0.00 H new ATOM 0 HH11 ARG A 83 11.642 -7.516 11.433 1.00 0.00 H new ATOM 0 HH12 ARG A 83 11.801 -9.104 12.192 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.373 -9.878 11.933 1.00 0.00 H new ATOM 0 HH22 ARG A 83 9.961 -10.433 12.473 1.00 0.00 H new ATOM 1368 N GLU A 84 9.889 -4.923 4.838 1.00 0.00 N ATOM 1369 CA GLU A 84 10.052 -3.960 3.755 1.00 0.00 C ATOM 1370 C GLU A 84 8.698 -3.523 3.218 1.00 0.00 C ATOM 1371 O GLU A 84 8.397 -2.332 3.153 1.00 0.00 O ATOM 1372 CB GLU A 84 10.890 -4.566 2.627 1.00 0.00 C ATOM 1373 CG GLU A 84 12.307 -4.921 3.047 1.00 0.00 C ATOM 1374 CD GLU A 84 13.008 -5.810 2.039 1.00 0.00 C ATOM 1375 OE1 GLU A 84 12.316 -6.593 1.354 1.00 0.00 O ATOM 1376 OE2 GLU A 84 14.250 -5.724 1.933 1.00 0.00 O ATOM 0 H GLU A 84 10.342 -5.822 4.673 1.00 0.00 H new ATOM 0 HA GLU A 84 10.569 -3.086 4.150 1.00 0.00 H new ATOM 0 HB2 GLU A 84 10.393 -5.463 2.258 1.00 0.00 H new ATOM 0 HB3 GLU A 84 10.932 -3.861 1.797 1.00 0.00 H new ATOM 0 HG2 GLU A 84 12.883 -4.005 3.181 1.00 0.00 H new ATOM 0 HG3 GLU A 84 12.280 -5.424 4.013 1.00 0.00 H new ATOM 1383 N TYR A 85 7.886 -4.497 2.829 1.00 0.00 N ATOM 1384 CA TYR A 85 6.565 -4.217 2.291 1.00 0.00 C ATOM 1385 C TYR A 85 5.486 -4.494 3.333 1.00 0.00 C ATOM 1386 O TYR A 85 4.389 -3.945 3.263 1.00 0.00 O ATOM 1387 CB TYR A 85 6.333 -5.036 1.023 1.00 0.00 C ATOM 1388 CG TYR A 85 7.135 -4.540 -0.163 1.00 0.00 C ATOM 1389 CD1 TYR A 85 8.445 -4.084 -0.011 1.00 0.00 C ATOM 1390 CD2 TYR A 85 6.583 -4.527 -1.437 1.00 0.00 C ATOM 1391 CE1 TYR A 85 9.172 -3.634 -1.096 1.00 0.00 C ATOM 1392 CE2 TYR A 85 7.307 -4.078 -2.526 1.00 0.00 C ATOM 1393 CZ TYR A 85 8.601 -3.634 -2.350 1.00 0.00 C ATOM 1394 OH TYR A 85 9.323 -3.186 -3.432 1.00 0.00 O ATOM 0 H TYR A 85 8.121 -5.488 2.877 1.00 0.00 H new ATOM 0 HA TYR A 85 6.508 -3.160 2.032 1.00 0.00 H new ATOM 0 HB2 TYR A 85 6.591 -6.077 1.218 1.00 0.00 H new ATOM 0 HB3 TYR A 85 5.273 -5.012 0.772 1.00 0.00 H new ATOM 0 HD1 TYR A 85 8.897 -4.083 0.970 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.570 -4.874 -1.580 1.00 0.00 H new ATOM 0 HE1 TYR A 85 10.185 -3.283 -0.962 1.00 0.00 H new ATOM 0 HE2 TYR A 85 6.861 -4.075 -3.510 1.00 0.00 H new ATOM 0 HH TYR A 85 10.276 -3.357 -3.283 1.00 0.00 H new ATOM 1404 N VAL A 86 5.817 -5.319 4.321 1.00 0.00 N ATOM 1405 CA VAL A 86 4.892 -5.628 5.400 1.00 0.00 C ATOM 1406 C VAL A 86 5.654 -5.798 6.702 1.00 0.00 C ATOM 1407 O VAL A 86 6.361 -6.785 6.900 1.00 0.00 O ATOM 1408 CB VAL A 86 4.059 -6.896 5.151 1.00 0.00 C ATOM 1409 CG1 VAL A 86 2.630 -6.532 4.787 1.00 0.00 C ATOM 1410 CG2 VAL A 86 4.685 -7.776 4.078 1.00 0.00 C ATOM 0 H VAL A 86 6.721 -5.785 4.395 1.00 0.00 H new ATOM 0 HA VAL A 86 4.200 -4.787 5.454 1.00 0.00 H new ATOM 0 HB VAL A 86 4.045 -7.471 6.077 1.00 0.00 H new ATOM 0 HG11 VAL A 86 2.055 -7.442 4.614 1.00 0.00 H new ATOM 0 HG12 VAL A 86 2.179 -5.968 5.603 1.00 0.00 H new ATOM 0 HG13 VAL A 86 2.629 -5.925 3.882 1.00 0.00 H new ATOM 0 HG21 VAL A 86 4.069 -8.663 3.929 1.00 0.00 H new ATOM 0 HG22 VAL A 86 4.751 -7.219 3.143 1.00 0.00 H new ATOM 0 HG23 VAL A 86 5.684 -8.077 4.392 1.00 0.00 H new ATOM 1420 N ASP A 87 5.498 -4.824 7.579 1.00 0.00 N ATOM 1421 CA ASP A 87 6.166 -4.829 8.872 1.00 0.00 C ATOM 1422 C ASP A 87 5.159 -4.982 10.001 1.00 0.00 C ATOM 1423 O ASP A 87 4.025 -4.512 9.903 1.00 0.00 O ATOM 1424 CB ASP A 87 6.961 -3.529 9.053 1.00 0.00 C ATOM 1425 CG ASP A 87 7.613 -3.418 10.420 1.00 0.00 C ATOM 1426 OD1 ASP A 87 6.882 -3.447 11.432 1.00 0.00 O ATOM 1427 OD2 ASP A 87 8.855 -3.295 10.480 1.00 0.00 O ATOM 0 H ASP A 87 4.907 -4.008 7.418 1.00 0.00 H new ATOM 0 HA ASP A 87 6.849 -5.678 8.904 1.00 0.00 H new ATOM 0 HB2 ASP A 87 7.731 -3.470 8.284 1.00 0.00 H new ATOM 0 HB3 ASP A 87 6.295 -2.679 8.904 1.00 0.00 H new ATOM 1432 N LEU A 88 5.581 -5.633 11.076 1.00 0.00 N ATOM 1433 CA LEU A 88 4.716 -5.835 12.225 1.00 0.00 C ATOM 1434 C LEU A 88 5.270 -5.110 13.445 1.00 0.00 C ATOM 1435 O LEU A 88 4.537 -4.429 14.160 1.00 0.00 O ATOM 1436 CB LEU A 88 4.554 -7.327 12.520 1.00 0.00 C ATOM 1437 CG LEU A 88 3.619 -8.072 11.566 1.00 0.00 C ATOM 1438 CD1 LEU A 88 2.186 -7.590 11.736 1.00 0.00 C ATOM 1439 CD2 LEU A 88 4.076 -7.890 10.127 1.00 0.00 C ATOM 0 H LEU A 88 6.516 -6.029 11.174 1.00 0.00 H new ATOM 0 HA LEU A 88 3.735 -5.421 11.992 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.536 -7.798 12.486 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.180 -7.443 13.537 1.00 0.00 H new ATOM 0 HG LEU A 88 3.654 -9.134 11.808 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.536 -8.132 11.049 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.861 -7.770 12.761 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.133 -6.523 11.520 1.00 0.00 H new ATOM 0 HD21 LEU A 88 3.401 -8.426 9.460 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.069 -6.830 9.874 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.086 -8.284 10.013 1.00 0.00 H new ATOM 1451 N GLU A 89 6.571 -5.257 13.672 1.00 0.00 N ATOM 1452 CA GLU A 89 7.223 -4.610 14.801 1.00 0.00 C ATOM 1453 C GLU A 89 8.594 -4.076 14.406 1.00 0.00 C ATOM 1454 O GLU A 89 9.396 -4.777 13.789 1.00 0.00 O ATOM 1455 CB GLU A 89 7.360 -5.589 15.966 1.00 0.00 C ATOM 1456 CG GLU A 89 8.181 -5.053 17.129 1.00 0.00 C ATOM 1457 CD GLU A 89 9.669 -5.266 16.940 1.00 0.00 C ATOM 1458 OE1 GLU A 89 10.097 -6.437 16.860 1.00 0.00 O ATOM 1459 OE2 GLU A 89 10.409 -4.262 16.872 1.00 0.00 O ATOM 0 H GLU A 89 7.193 -5.818 13.089 1.00 0.00 H new ATOM 0 HA GLU A 89 6.603 -3.769 15.113 1.00 0.00 H new ATOM 0 HB2 GLU A 89 6.365 -5.851 16.327 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.820 -6.508 15.603 1.00 0.00 H new ATOM 0 HG2 GLU A 89 7.983 -3.988 17.248 1.00 0.00 H new ATOM 0 HG3 GLU A 89 7.862 -5.542 18.050 1.00 0.00 H new ATOM 1466 N ARG A 90 8.853 -2.831 14.776 1.00 0.00 N ATOM 1467 CA ARG A 90 10.123 -2.185 14.479 1.00 0.00 C ATOM 1468 C ARG A 90 10.259 -0.893 15.275 1.00 0.00 C ATOM 1469 O ARG A 90 11.317 -0.601 15.830 1.00 0.00 O ATOM 1470 CB ARG A 90 10.249 -1.906 12.978 1.00 0.00 C ATOM 1471 CG ARG A 90 9.173 -0.985 12.431 1.00 0.00 C ATOM 1472 CD ARG A 90 9.558 0.475 12.594 1.00 0.00 C ATOM 1473 NE ARG A 90 10.168 1.023 11.381 1.00 0.00 N ATOM 1474 CZ ARG A 90 11.483 1.117 11.184 1.00 0.00 C ATOM 1475 NH1 ARG A 90 12.339 0.708 12.114 1.00 0.00 N ATOM 1476 NH2 ARG A 90 11.946 1.625 10.050 1.00 0.00 N ATOM 0 H ARG A 90 8.194 -2.243 15.287 1.00 0.00 H new ATOM 0 HA ARG A 90 10.929 -2.859 14.770 1.00 0.00 H new ATOM 0 HB2 ARG A 90 11.226 -1.464 12.781 1.00 0.00 H new ATOM 0 HB3 ARG A 90 10.212 -2.852 12.438 1.00 0.00 H new ATOM 0 HG2 ARG A 90 9.007 -1.203 11.376 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.232 -1.175 12.948 1.00 0.00 H new ATOM 0 HD2 ARG A 90 8.672 1.057 12.848 1.00 0.00 H new ATOM 0 HD3 ARG A 90 10.255 0.575 13.426 1.00 0.00 H new ATOM 0 HE ARG A 90 9.548 1.353 10.641 1.00 0.00 H new ATOM 0 HH11 ARG A 90 11.992 0.317 12.990 1.00 0.00 H new ATOM 0 HH12 ARG A 90 13.343 0.785 11.952 1.00 0.00 H new ATOM 0 HH21 ARG A 90 11.296 1.943 9.331 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.952 1.698 9.897 1.00 0.00 H new ATOM 1490 N GLU A 91 9.174 -0.124 15.332 1.00 0.00 N ATOM 1491 CA GLU A 91 9.170 1.132 16.070 1.00 0.00 C ATOM 1492 C GLU A 91 8.585 0.928 17.473 1.00 0.00 C ATOM 1493 O GLU A 91 9.232 0.324 18.329 1.00 0.00 O ATOM 1494 CB GLU A 91 8.393 2.202 15.292 1.00 0.00 C ATOM 1495 CG GLU A 91 8.356 3.554 15.987 1.00 0.00 C ATOM 1496 CD GLU A 91 9.289 4.564 15.350 1.00 0.00 C ATOM 1497 OE1 GLU A 91 8.982 5.035 14.234 1.00 0.00 O ATOM 1498 OE2 GLU A 91 10.328 4.885 15.964 1.00 0.00 O ATOM 0 H GLU A 91 8.290 -0.350 14.877 1.00 0.00 H new ATOM 0 HA GLU A 91 10.197 1.478 16.185 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.844 2.322 14.307 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.372 1.855 15.135 1.00 0.00 H new ATOM 0 HG2 GLU A 91 7.338 3.942 15.965 1.00 0.00 H new ATOM 0 HG3 GLU A 91 8.626 3.427 17.035 1.00 0.00 H new ATOM 1505 N ALA A 92 7.366 1.417 17.713 1.00 0.00 N ATOM 1506 CA ALA A 92 6.730 1.261 19.012 1.00 0.00 C ATOM 1507 C ALA A 92 5.353 1.918 19.043 1.00 0.00 C ATOM 1508 O ALA A 92 5.215 3.062 19.475 1.00 0.00 O ATOM 1509 CB ALA A 92 7.614 1.834 20.112 1.00 0.00 C ATOM 0 H ALA A 92 6.806 1.921 17.025 1.00 0.00 H new ATOM 0 HA ALA A 92 6.595 0.194 19.188 1.00 0.00 H new ATOM 0 HB1 ALA A 92 7.122 1.708 21.077 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.570 1.310 20.121 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.784 2.895 19.927 1.00 0.00 H new ATOM 1515 N GLY A 93 4.332 1.190 18.593 1.00 0.00 N ATOM 1516 CA GLY A 93 2.987 1.738 18.598 1.00 0.00 C ATOM 1517 C GLY A 93 2.117 1.215 17.471 1.00 0.00 C ATOM 1518 O GLY A 93 1.023 0.708 17.712 1.00 0.00 O ATOM 0 H GLY A 93 4.411 0.241 18.229 1.00 0.00 H new ATOM 0 HA2 GLY A 93 2.512 1.506 19.551 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.045 2.824 18.527 1.00 0.00 H new ATOM 1522 N LYS A 94 2.592 1.350 16.236 1.00 0.00 N ATOM 1523 CA LYS A 94 1.829 0.896 15.075 1.00 0.00 C ATOM 1524 C LYS A 94 2.724 0.150 14.090 1.00 0.00 C ATOM 1525 O LYS A 94 3.934 0.044 14.290 1.00 0.00 O ATOM 1526 CB LYS A 94 1.166 2.086 14.365 1.00 0.00 C ATOM 1527 CG LYS A 94 1.040 3.335 15.227 1.00 0.00 C ATOM 1528 CD LYS A 94 -0.070 3.195 16.256 1.00 0.00 C ATOM 1529 CE LYS A 94 0.239 3.979 17.521 1.00 0.00 C ATOM 1530 NZ LYS A 94 -0.952 4.100 18.405 1.00 0.00 N ATOM 0 H LYS A 94 3.496 1.767 16.013 1.00 0.00 H new ATOM 0 HA LYS A 94 1.056 0.215 15.433 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.743 2.330 13.473 1.00 0.00 H new ATOM 0 HB3 LYS A 94 0.173 1.787 14.030 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.986 3.524 15.735 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.841 4.198 14.591 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.009 3.547 15.829 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.207 2.142 16.504 1.00 0.00 H new ATOM 0 HE2 LYS A 94 1.046 3.487 18.065 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.595 4.974 17.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -0.699 4.641 19.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -1.714 4.592 17.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.277 3.152 18.682 1.00 0.00 H new ATOM 1544 N VAL A 95 2.117 -0.360 13.022 1.00 0.00 N ATOM 1545 CA VAL A 95 2.853 -1.091 11.995 1.00 0.00 C ATOM 1546 C VAL A 95 2.516 -0.547 10.608 1.00 0.00 C ATOM 1547 O VAL A 95 1.349 -0.329 10.296 1.00 0.00 O ATOM 1548 CB VAL A 95 2.552 -2.614 12.043 1.00 0.00 C ATOM 1549 CG1 VAL A 95 2.004 -3.017 13.404 1.00 0.00 C ATOM 1550 CG2 VAL A 95 1.581 -3.019 10.939 1.00 0.00 C ATOM 0 H VAL A 95 1.116 -0.280 12.845 1.00 0.00 H new ATOM 0 HA VAL A 95 3.915 -0.948 12.196 1.00 0.00 H new ATOM 0 HB VAL A 95 3.492 -3.141 11.880 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.801 -4.088 13.412 1.00 0.00 H new ATOM 0 HG12 VAL A 95 2.737 -2.781 14.176 1.00 0.00 H new ATOM 0 HG13 VAL A 95 1.081 -2.472 13.601 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.389 -4.090 10.998 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.644 -2.476 11.061 1.00 0.00 H new ATOM 0 HG23 VAL A 95 2.015 -2.781 9.968 1.00 0.00 H new ATOM 1560 N TYR A 96 3.536 -0.344 9.778 1.00 0.00 N ATOM 1561 CA TYR A 96 3.319 0.166 8.424 1.00 0.00 C ATOM 1562 C TYR A 96 3.812 -0.803 7.363 1.00 0.00 C ATOM 1563 O TYR A 96 4.751 -1.569 7.579 1.00 0.00 O ATOM 1564 CB TYR A 96 3.965 1.544 8.212 1.00 0.00 C ATOM 1565 CG TYR A 96 5.039 1.913 9.212 1.00 0.00 C ATOM 1566 CD1 TYR A 96 6.046 1.022 9.559 1.00 0.00 C ATOM 1567 CD2 TYR A 96 5.040 3.167 9.807 1.00 0.00 C ATOM 1568 CE1 TYR A 96 7.022 1.372 10.472 1.00 0.00 C ATOM 1569 CE2 TYR A 96 6.009 3.525 10.719 1.00 0.00 C ATOM 1570 CZ TYR A 96 6.999 2.625 11.050 1.00 0.00 C ATOM 1571 OH TYR A 96 7.969 2.978 11.960 1.00 0.00 O ATOM 0 H TYR A 96 4.512 -0.522 10.014 1.00 0.00 H new ATOM 0 HA TYR A 96 2.240 0.274 8.316 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.396 1.575 7.212 1.00 0.00 H new ATOM 0 HB3 TYR A 96 3.183 2.303 8.246 1.00 0.00 H new ATOM 0 HD1 TYR A 96 6.067 0.041 9.108 1.00 0.00 H new ATOM 0 HD2 TYR A 96 4.267 3.876 9.550 1.00 0.00 H new ATOM 0 HE1 TYR A 96 7.799 0.669 10.732 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.993 4.505 11.172 1.00 0.00 H new ATOM 0 HH TYR A 96 7.808 3.893 12.271 1.00 0.00 H new ATOM 1581 N LEU A 97 3.155 -0.752 6.209 1.00 0.00 N ATOM 1582 CA LEU A 97 3.498 -1.610 5.088 1.00 0.00 C ATOM 1583 C LEU A 97 3.558 -0.809 3.793 1.00 0.00 C ATOM 1584 O LEU A 97 2.901 0.229 3.655 1.00 0.00 O ATOM 1585 CB LEU A 97 2.493 -2.767 4.949 1.00 0.00 C ATOM 1586 CG LEU A 97 1.041 -2.452 5.342 1.00 0.00 C ATOM 1587 CD1 LEU A 97 0.909 -2.180 6.834 1.00 0.00 C ATOM 1588 CD2 LEU A 97 0.512 -1.278 4.543 1.00 0.00 C ATOM 0 H LEU A 97 2.376 -0.119 6.028 1.00 0.00 H new ATOM 0 HA LEU A 97 4.484 -2.033 5.283 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.502 -3.107 3.913 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.841 -3.599 5.561 1.00 0.00 H new ATOM 0 HG LEU A 97 0.442 -3.333 5.110 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -0.132 -1.961 7.073 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.233 -3.057 7.394 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.531 -1.326 7.105 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.517 -1.072 4.837 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.127 -0.399 4.736 1.00 0.00 H new ATOM 0 HD23 LEU A 97 0.545 -1.517 3.480 1.00 0.00 H new ATOM 1600 N LYS A 98 4.358 -1.305 2.855 1.00 0.00 N ATOM 1601 CA LYS A 98 4.530 -0.668 1.557 1.00 0.00 C ATOM 1602 C LYS A 98 4.115 -1.629 0.449 1.00 0.00 C ATOM 1603 O LYS A 98 4.614 -2.751 0.372 1.00 0.00 O ATOM 1604 CB LYS A 98 5.990 -0.246 1.368 1.00 0.00 C ATOM 1605 CG LYS A 98 6.313 0.256 -0.031 1.00 0.00 C ATOM 1606 CD LYS A 98 7.242 -0.698 -0.765 1.00 0.00 C ATOM 1607 CE LYS A 98 8.702 -0.408 -0.450 1.00 0.00 C ATOM 1608 NZ LYS A 98 9.417 0.175 -1.619 1.00 0.00 N ATOM 0 H LYS A 98 4.904 -2.158 2.974 1.00 0.00 H new ATOM 0 HA LYS A 98 3.899 0.220 1.511 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.227 0.538 2.088 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.635 -1.094 1.596 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.390 0.375 -0.598 1.00 0.00 H new ATOM 0 HG3 LYS A 98 6.777 1.240 0.033 1.00 0.00 H new ATOM 0 HD2 LYS A 98 7.005 -1.725 -0.486 1.00 0.00 H new ATOM 0 HD3 LYS A 98 7.077 -0.614 -1.839 1.00 0.00 H new ATOM 0 HE2 LYS A 98 8.762 0.281 0.393 1.00 0.00 H new ATOM 0 HE3 LYS A 98 9.197 -1.329 -0.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 10.408 0.358 -1.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 9.382 -0.493 -2.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 8.960 1.068 -1.895 1.00 0.00 H new ATOM 1622 N ALA A 99 3.193 -1.193 -0.402 1.00 0.00 N ATOM 1623 CA ALA A 99 2.715 -2.033 -1.490 1.00 0.00 C ATOM 1624 C ALA A 99 2.797 -1.316 -2.836 1.00 0.00 C ATOM 1625 O ALA A 99 2.425 -0.146 -2.949 1.00 0.00 O ATOM 1626 CB ALA A 99 1.286 -2.480 -1.219 1.00 0.00 C ATOM 0 H ALA A 99 2.765 -0.268 -0.359 1.00 0.00 H new ATOM 0 HA ALA A 99 3.363 -2.908 -1.542 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.939 -3.108 -2.040 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.252 -3.047 -0.289 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.641 -1.605 -1.134 1.00 0.00 H new ATOM 1632 N PRO A 100 3.276 -2.016 -3.882 1.00 0.00 N ATOM 1633 CA PRO A 100 3.396 -1.460 -5.220 1.00 0.00 C ATOM 1634 C PRO A 100 2.141 -1.724 -6.046 1.00 0.00 C ATOM 1635 O PRO A 100 1.756 -2.874 -6.250 1.00 0.00 O ATOM 1636 CB PRO A 100 4.588 -2.229 -5.783 1.00 0.00 C ATOM 1637 CG PRO A 100 4.529 -3.573 -5.125 1.00 0.00 C ATOM 1638 CD PRO A 100 3.737 -3.415 -3.845 1.00 0.00 C ATOM 0 HA PRO A 100 3.523 -0.377 -5.230 1.00 0.00 H new ATOM 0 HB2 PRO A 100 4.524 -2.318 -6.867 1.00 0.00 H new ATOM 0 HB3 PRO A 100 5.526 -1.721 -5.560 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.055 -4.302 -5.782 1.00 0.00 H new ATOM 0 HG3 PRO A 100 5.533 -3.941 -4.913 1.00 0.00 H new ATOM 0 HD2 PRO A 100 2.899 -4.111 -3.806 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.354 -3.609 -2.967 1.00 0.00 H new ATOM 1646 N MET A 101 1.495 -0.656 -6.504 1.00 0.00 N ATOM 1647 CA MET A 101 0.272 -0.791 -7.287 1.00 0.00 C ATOM 1648 C MET A 101 0.329 0.042 -8.558 1.00 0.00 C ATOM 1649 O MET A 101 1.197 0.902 -8.714 1.00 0.00 O ATOM 1650 CB MET A 101 -0.939 -0.361 -6.456 1.00 0.00 C ATOM 1651 CG MET A 101 -1.447 -1.436 -5.512 1.00 0.00 C ATOM 1652 SD MET A 101 -3.248 -1.521 -5.456 1.00 0.00 S ATOM 1653 CE MET A 101 -3.642 0.040 -4.669 1.00 0.00 C ATOM 0 H MET A 101 1.796 0.306 -6.348 1.00 0.00 H new ATOM 0 HA MET A 101 0.175 -1.841 -7.565 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.675 0.523 -5.876 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.746 -0.071 -7.129 1.00 0.00 H new ATOM 0 HG2 MET A 101 -1.051 -2.403 -5.823 1.00 0.00 H new ATOM 0 HG3 MET A 101 -1.065 -1.243 -4.509 1.00 0.00 H new ATOM 0 HE1 MET A 101 -4.195 -0.146 -3.748 1.00 0.00 H new ATOM 0 HE2 MET A 101 -2.720 0.574 -4.437 1.00 0.00 H new ATOM 0 HE3 MET A 101 -4.251 0.643 -5.342 1.00 0.00 H new ATOM 1663 N ILE A 102 -0.616 -0.209 -9.454 1.00 0.00 N ATOM 1664 CA ILE A 102 -0.693 0.528 -10.704 1.00 0.00 C ATOM 1665 C ILE A 102 -1.841 1.529 -10.654 1.00 0.00 C ATOM 1666 O ILE A 102 -3.011 1.158 -10.754 1.00 0.00 O ATOM 1667 CB ILE A 102 -0.891 -0.417 -11.909 1.00 0.00 C ATOM 1668 CG1 ILE A 102 0.276 -1.404 -12.007 1.00 0.00 C ATOM 1669 CG2 ILE A 102 -1.031 0.380 -13.200 1.00 0.00 C ATOM 1670 CD1 ILE A 102 1.566 -0.776 -12.495 1.00 0.00 C ATOM 0 H ILE A 102 -1.340 -0.918 -9.337 1.00 0.00 H new ATOM 0 HA ILE A 102 0.252 1.055 -10.832 1.00 0.00 H new ATOM 0 HB ILE A 102 -1.811 -0.982 -11.758 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.447 -1.849 -11.027 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -0.001 -2.215 -12.681 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -1.170 -0.304 -14.037 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.893 1.043 -13.127 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -0.130 0.973 -13.361 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.347 -1.535 -12.539 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.413 -0.356 -13.489 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.868 0.015 -11.809 1.00 0.00 H new ATOM 1682 N LEU A 103 -1.494 2.800 -10.502 1.00 0.00 N ATOM 1683 CA LEU A 103 -2.487 3.865 -10.442 1.00 0.00 C ATOM 1684 C LEU A 103 -2.503 4.630 -11.755 1.00 0.00 C ATOM 1685 O LEU A 103 -1.489 4.709 -12.424 1.00 0.00 O ATOM 1686 CB LEU A 103 -2.192 4.815 -9.280 1.00 0.00 C ATOM 1687 CG LEU A 103 -2.745 4.374 -7.924 1.00 0.00 C ATOM 1688 CD1 LEU A 103 -2.486 5.438 -6.868 1.00 0.00 C ATOM 1689 CD2 LEU A 103 -4.233 4.075 -8.026 1.00 0.00 C ATOM 0 H LEU A 103 -0.529 3.120 -10.418 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.467 3.418 -10.277 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.112 4.933 -9.193 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.602 5.796 -9.520 1.00 0.00 H new ATOM 0 HG LEU A 103 -2.230 3.461 -7.625 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.887 5.105 -5.910 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.413 5.604 -6.774 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.973 6.368 -7.162 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -4.609 3.763 -7.052 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.763 4.971 -8.349 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -4.395 3.277 -8.750 1.00 0.00 H new ATOM 1701 N ASN A 104 -3.661 5.178 -12.118 1.00 0.00 N ATOM 1702 CA ASN A 104 -3.831 5.934 -13.371 1.00 0.00 C ATOM 1703 C ASN A 104 -2.557 5.983 -14.227 1.00 0.00 C ATOM 1704 O ASN A 104 -1.832 6.979 -14.224 1.00 0.00 O ATOM 1705 CB ASN A 104 -4.271 7.360 -13.048 1.00 0.00 C ATOM 1706 CG ASN A 104 -4.876 8.067 -14.244 1.00 0.00 C ATOM 1707 OD1 ASN A 104 -4.449 7.865 -15.381 1.00 0.00 O ATOM 1708 ND2 ASN A 104 -5.878 8.904 -13.994 1.00 0.00 N ATOM 0 H ASN A 104 -4.511 5.114 -11.557 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.589 5.411 -13.954 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -4.999 7.337 -12.237 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -3.413 7.929 -12.690 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -6.324 9.408 -14.760 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -6.201 9.042 -13.036 1.00 0.00 H new ATOM 1715 N GLY A 105 -2.307 4.900 -14.968 1.00 0.00 N ATOM 1716 CA GLY A 105 -1.137 4.818 -15.838 1.00 0.00 C ATOM 1717 C GLY A 105 0.127 5.376 -15.208 1.00 0.00 C ATOM 1718 O GLY A 105 0.768 6.262 -15.771 1.00 0.00 O ATOM 0 H GLY A 105 -2.900 4.070 -14.981 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -0.968 3.776 -16.110 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.342 5.359 -16.762 1.00 0.00 H new ATOM 1722 N VAL A 106 0.475 4.856 -14.037 1.00 0.00 N ATOM 1723 CA VAL A 106 1.651 5.296 -13.306 1.00 0.00 C ATOM 1724 C VAL A 106 2.014 4.272 -12.236 1.00 0.00 C ATOM 1725 O VAL A 106 1.145 3.566 -11.724 1.00 0.00 O ATOM 1726 CB VAL A 106 1.399 6.663 -12.627 1.00 0.00 C ATOM 1727 CG1 VAL A 106 2.475 6.976 -11.598 1.00 0.00 C ATOM 1728 CG2 VAL A 106 1.311 7.770 -13.664 1.00 0.00 C ATOM 0 H VAL A 106 -0.052 4.118 -13.570 1.00 0.00 H new ATOM 0 HA VAL A 106 2.471 5.397 -14.018 1.00 0.00 H new ATOM 0 HB VAL A 106 0.445 6.603 -12.104 1.00 0.00 H new ATOM 0 HG11 VAL A 106 2.269 7.943 -11.139 1.00 0.00 H new ATOM 0 HG12 VAL A 106 2.479 6.203 -10.829 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.449 7.007 -12.087 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.133 8.723 -13.165 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.246 7.821 -14.222 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.490 7.561 -14.350 1.00 0.00 H new ATOM 1738 N CYS A 107 3.291 4.208 -11.882 1.00 0.00 N ATOM 1739 CA CYS A 107 3.738 3.283 -10.851 1.00 0.00 C ATOM 1740 C CYS A 107 3.708 3.985 -9.502 1.00 0.00 C ATOM 1741 O CYS A 107 4.453 4.938 -9.273 1.00 0.00 O ATOM 1742 CB CYS A 107 5.145 2.764 -11.157 1.00 0.00 C ATOM 1743 SG CYS A 107 5.704 1.451 -10.048 1.00 0.00 S ATOM 0 H CYS A 107 4.030 4.781 -12.290 1.00 0.00 H new ATOM 0 HA CYS A 107 3.067 2.424 -10.827 1.00 0.00 H new ATOM 0 HB2 CYS A 107 5.169 2.394 -12.182 1.00 0.00 H new ATOM 0 HB3 CYS A 107 5.848 3.596 -11.101 1.00 0.00 H new ATOM 0 HG CYS A 107 5.754 0.326 -10.698 1.00 0.00 H new ATOM 1749 N VAL A 108 2.818 3.539 -8.625 1.00 0.00 N ATOM 1750 CA VAL A 108 2.670 4.162 -7.320 1.00 0.00 C ATOM 1751 C VAL A 108 2.971 3.200 -6.179 1.00 0.00 C ATOM 1752 O VAL A 108 2.749 1.993 -6.285 1.00 0.00 O ATOM 1753 CB VAL A 108 1.245 4.719 -7.149 1.00 0.00 C ATOM 1754 CG1 VAL A 108 0.955 5.759 -8.224 1.00 0.00 C ATOM 1755 CG2 VAL A 108 0.216 3.597 -7.197 1.00 0.00 C ATOM 0 H VAL A 108 2.191 2.752 -8.794 1.00 0.00 H new ATOM 0 HA VAL A 108 3.397 4.973 -7.277 1.00 0.00 H new ATOM 0 HB VAL A 108 1.176 5.198 -6.172 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.056 6.146 -8.093 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.670 6.577 -8.141 1.00 0.00 H new ATOM 0 HG13 VAL A 108 1.043 5.299 -9.208 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -0.783 4.014 -7.074 1.00 0.00 H new ATOM 0 HG22 VAL A 108 0.280 3.085 -8.157 1.00 0.00 H new ATOM 0 HG23 VAL A 108 0.414 2.887 -6.394 1.00 0.00 H new ATOM 1765 N ILE A 109 3.465 3.757 -5.079 1.00 0.00 N ATOM 1766 CA ILE A 109 3.788 2.977 -3.894 1.00 0.00 C ATOM 1767 C ILE A 109 3.030 3.523 -2.691 1.00 0.00 C ATOM 1768 O ILE A 109 3.365 4.586 -2.167 1.00 0.00 O ATOM 1769 CB ILE A 109 5.298 3.002 -3.589 1.00 0.00 C ATOM 1770 CG1 ILE A 109 6.109 2.842 -4.877 1.00 0.00 C ATOM 1771 CG2 ILE A 109 5.656 1.911 -2.593 1.00 0.00 C ATOM 1772 CD1 ILE A 109 5.769 1.589 -5.654 1.00 0.00 C ATOM 0 H ILE A 109 3.651 4.755 -4.985 1.00 0.00 H new ATOM 0 HA ILE A 109 3.493 1.946 -4.090 1.00 0.00 H new ATOM 0 HB ILE A 109 5.545 3.967 -3.147 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.941 3.711 -5.513 1.00 0.00 H new ATOM 0 HG13 ILE A 109 7.170 2.829 -4.629 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.726 1.942 -2.388 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.104 2.069 -1.666 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.394 0.938 -3.009 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.382 1.542 -6.554 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.964 0.713 -5.035 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.715 1.609 -5.933 1.00 0.00 H new ATOM 1784 N TRP A 110 2.001 2.803 -2.264 1.00 0.00 N ATOM 1785 CA TRP A 110 1.195 3.236 -1.131 1.00 0.00 C ATOM 1786 C TRP A 110 1.734 2.670 0.181 1.00 0.00 C ATOM 1787 O TRP A 110 1.853 1.457 0.346 1.00 0.00 O ATOM 1788 CB TRP A 110 -0.266 2.821 -1.328 1.00 0.00 C ATOM 1789 CG TRP A 110 -1.136 3.142 -0.152 1.00 0.00 C ATOM 1790 CD1 TRP A 110 -1.899 4.260 0.031 1.00 0.00 C ATOM 1791 CD2 TRP A 110 -1.324 2.332 1.008 1.00 0.00 C ATOM 1792 NE1 TRP A 110 -2.551 4.192 1.240 1.00 0.00 N ATOM 1793 CE2 TRP A 110 -2.213 3.015 1.859 1.00 0.00 C ATOM 1794 CE3 TRP A 110 -0.826 1.093 1.407 1.00 0.00 C ATOM 1795 CZ2 TRP A 110 -2.611 2.495 3.089 1.00 0.00 C ATOM 1796 CZ3 TRP A 110 -1.220 0.579 2.624 1.00 0.00 C ATOM 1797 CH2 TRP A 110 -2.104 1.276 3.454 1.00 0.00 C ATOM 0 H TRP A 110 1.706 1.921 -2.683 1.00 0.00 H new ATOM 0 HA TRP A 110 1.250 4.323 -1.076 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -0.663 3.321 -2.212 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -0.309 1.749 -1.522 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -1.979 5.077 -0.671 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -3.182 4.900 1.615 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -0.144 0.545 0.774 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -3.293 3.033 3.730 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -0.839 -0.380 2.943 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -2.392 0.845 4.401 1.00 0.00 H new ATOM 1808 N LYS A 111 2.053 3.566 1.109 1.00 0.00 N ATOM 1809 CA LYS A 111 2.575 3.174 2.414 1.00 0.00 C ATOM 1810 C LYS A 111 1.670 3.683 3.524 1.00 0.00 C ATOM 1811 O LYS A 111 1.041 4.730 3.386 1.00 0.00 O ATOM 1812 CB LYS A 111 3.983 3.729 2.613 1.00 0.00 C ATOM 1813 CG LYS A 111 5.058 2.913 1.922 1.00 0.00 C ATOM 1814 CD LYS A 111 5.649 3.662 0.736 1.00 0.00 C ATOM 1815 CE LYS A 111 6.836 4.516 1.152 1.00 0.00 C ATOM 1816 NZ LYS A 111 7.829 4.662 0.053 1.00 0.00 N ATOM 0 H LYS A 111 1.959 4.574 0.981 1.00 0.00 H new ATOM 0 HA LYS A 111 2.610 2.085 2.452 1.00 0.00 H new ATOM 0 HB2 LYS A 111 4.018 4.752 2.239 1.00 0.00 H new ATOM 0 HB3 LYS A 111 4.200 3.772 3.680 1.00 0.00 H new ATOM 0 HG2 LYS A 111 5.848 2.674 2.633 1.00 0.00 H new ATOM 0 HG3 LYS A 111 4.637 1.967 1.583 1.00 0.00 H new ATOM 0 HD2 LYS A 111 5.962 2.949 -0.027 1.00 0.00 H new ATOM 0 HD3 LYS A 111 4.884 4.295 0.286 1.00 0.00 H new ATOM 0 HE2 LYS A 111 6.485 5.502 1.457 1.00 0.00 H new ATOM 0 HE3 LYS A 111 7.319 4.067 2.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 8.771 4.389 0.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 7.560 4.048 -0.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.850 5.652 -0.266 1.00 0.00 H new ATOM 1830 N GLY A 112 1.607 2.948 4.627 1.00 0.00 N ATOM 1831 CA GLY A 112 0.765 3.378 5.733 1.00 0.00 C ATOM 1832 C GLY A 112 0.826 2.453 6.929 1.00 0.00 C ATOM 1833 O GLY A 112 1.024 1.248 6.780 1.00 0.00 O ATOM 0 H GLY A 112 2.114 2.076 4.778 1.00 0.00 H new ATOM 0 HA2 GLY A 112 1.066 4.379 6.041 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -0.267 3.447 5.389 1.00 0.00 H new ATOM 1837 N TRP A 113 0.644 3.019 8.123 1.00 0.00 N ATOM 1838 CA TRP A 113 0.672 2.228 9.348 1.00 0.00 C ATOM 1839 C TRP A 113 -0.713 2.117 9.969 1.00 0.00 C ATOM 1840 O TRP A 113 -1.593 2.938 9.710 1.00 0.00 O ATOM 1841 CB TRP A 113 1.663 2.809 10.364 1.00 0.00 C ATOM 1842 CG TRP A 113 1.443 4.257 10.675 1.00 0.00 C ATOM 1843 CD1 TRP A 113 2.101 5.322 10.131 1.00 0.00 C ATOM 1844 CD2 TRP A 113 0.514 4.797 11.619 1.00 0.00 C ATOM 1845 NE1 TRP A 113 1.627 6.494 10.671 1.00 0.00 N ATOM 1846 CE2 TRP A 113 0.652 6.196 11.588 1.00 0.00 C ATOM 1847 CE3 TRP A 113 -0.426 4.231 12.484 1.00 0.00 C ATOM 1848 CZ2 TRP A 113 -0.114 7.038 12.391 1.00 0.00 C ATOM 1849 CZ3 TRP A 113 -1.184 5.067 13.280 1.00 0.00 C ATOM 1850 CH2 TRP A 113 -1.025 6.457 13.229 1.00 0.00 C ATOM 0 H TRP A 113 0.477 4.015 8.265 1.00 0.00 H new ATOM 0 HA TRP A 113 1.006 1.227 9.076 1.00 0.00 H new ATOM 0 HB2 TRP A 113 1.596 2.236 11.289 1.00 0.00 H new ATOM 0 HB3 TRP A 113 2.676 2.681 9.982 1.00 0.00 H new ATOM 0 HD1 TRP A 113 2.880 5.254 9.386 1.00 0.00 H new ATOM 0 HE1 TRP A 113 1.948 7.432 10.429 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -0.557 3.160 12.529 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 0.007 8.111 12.353 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.912 4.641 13.954 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -1.634 7.083 13.864 1.00 0.00 H new ATOM 1861 N ILE A 114 -0.886 1.089 10.796 1.00 0.00 N ATOM 1862 CA ILE A 114 -2.152 0.840 11.474 1.00 0.00 C ATOM 1863 C ILE A 114 -1.945 0.765 12.978 1.00 0.00 C ATOM 1864 O ILE A 114 -0.974 0.170 13.446 1.00 0.00 O ATOM 1865 CB ILE A 114 -2.795 -0.492 11.026 1.00 0.00 C ATOM 1866 CG1 ILE A 114 -2.898 -0.574 9.503 1.00 0.00 C ATOM 1867 CG2 ILE A 114 -4.166 -0.659 11.665 1.00 0.00 C ATOM 1868 CD1 ILE A 114 -3.709 0.546 8.887 1.00 0.00 C ATOM 0 H ILE A 114 -0.157 0.410 11.013 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.810 1.668 11.212 1.00 0.00 H new ATOM 0 HB ILE A 114 -2.151 -1.306 11.360 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.894 -0.560 9.078 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -3.347 -1.529 9.229 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -4.606 -1.602 11.340 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.064 -0.661 12.750 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -4.811 0.166 11.363 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -3.738 0.421 7.805 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -4.724 0.520 9.283 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -3.249 1.504 9.130 1.00 0.00 H new ATOM 1880 N ASP A 115 -2.871 1.340 13.735 1.00 0.00 N ATOM 1881 CA ASP A 115 -2.775 1.296 15.183 1.00 0.00 C ATOM 1882 C ASP A 115 -3.418 0.008 15.695 1.00 0.00 C ATOM 1883 O ASP A 115 -4.537 -0.340 15.308 1.00 0.00 O ATOM 1884 CB ASP A 115 -3.404 2.549 15.817 1.00 0.00 C ATOM 1885 CG ASP A 115 -4.889 2.416 16.092 1.00 0.00 C ATOM 1886 OD1 ASP A 115 -5.286 1.421 16.723 1.00 0.00 O ATOM 1887 OD2 ASP A 115 -5.654 3.315 15.685 1.00 0.00 O ATOM 0 H ASP A 115 -3.686 1.836 13.374 1.00 0.00 H new ATOM 0 HA ASP A 115 -1.725 1.294 15.476 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -2.889 2.769 16.752 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -3.241 3.400 15.156 1.00 0.00 H new ATOM 1892 N LEU A 116 -2.682 -0.713 16.531 1.00 0.00 N ATOM 1893 CA LEU A 116 -3.141 -1.992 17.066 1.00 0.00 C ATOM 1894 C LEU A 116 -4.146 -1.841 18.211 1.00 0.00 C ATOM 1895 O LEU A 116 -4.417 -2.806 18.926 1.00 0.00 O ATOM 1896 CB LEU A 116 -1.935 -2.802 17.538 1.00 0.00 C ATOM 1897 CG LEU A 116 -0.725 -2.765 16.594 1.00 0.00 C ATOM 1898 CD1 LEU A 116 0.571 -2.612 17.379 1.00 0.00 C ATOM 1899 CD2 LEU A 116 -0.687 -4.014 15.721 1.00 0.00 C ATOM 0 H LEU A 116 -1.757 -0.432 16.856 1.00 0.00 H new ATOM 0 HA LEU A 116 -3.663 -2.510 16.261 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.627 -2.432 18.516 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -2.242 -3.839 17.672 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.827 -1.897 15.943 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.414 -2.588 16.688 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.543 -1.684 17.950 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.685 -3.454 18.061 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.178 -3.969 15.059 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.614 -4.898 16.354 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -1.598 -4.069 15.125 1.00 0.00 H new ATOM 1911 N HIS A 117 -4.704 -0.648 18.384 1.00 0.00 N ATOM 1912 CA HIS A 117 -5.680 -0.420 19.445 1.00 0.00 C ATOM 1913 C HIS A 117 -7.031 -0.019 18.859 1.00 0.00 C ATOM 1914 O HIS A 117 -8.038 -0.699 19.057 1.00 0.00 O ATOM 1915 CB HIS A 117 -5.186 0.668 20.402 1.00 0.00 C ATOM 1916 CG HIS A 117 -3.714 0.612 20.670 1.00 0.00 C ATOM 1917 ND1 HIS A 117 -2.656 0.798 19.845 1.00 0.00 N flip ATOM 1918 CD2 HIS A 117 -3.184 0.338 21.913 1.00 0.00 C flip ATOM 1919 CE1 HIS A 117 -1.519 0.633 20.598 1.00 0.00 C flip ATOM 1920 NE2 HIS A 117 -1.864 0.357 21.842 1.00 0.00 N flip ATOM 0 H HIS A 117 -4.500 0.170 17.809 1.00 0.00 H new ATOM 0 HA HIS A 117 -5.801 -1.351 19.998 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -5.434 1.645 19.986 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -5.722 0.579 21.347 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -3.758 0.139 22.806 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -0.506 0.716 20.232 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -1.222 0.187 22.616 1.00 0.00 H new ATOM 1929 N ARG A 118 -7.035 1.093 18.138 1.00 0.00 N ATOM 1930 CA ARG A 118 -8.246 1.613 17.511 1.00 0.00 C ATOM 1931 C ARG A 118 -8.459 1.026 16.114 1.00 0.00 C ATOM 1932 O ARG A 118 -9.561 1.106 15.573 1.00 0.00 O ATOM 1933 CB ARG A 118 -8.190 3.144 17.425 1.00 0.00 C ATOM 1934 CG ARG A 118 -7.154 3.779 18.342 1.00 0.00 C ATOM 1935 CD ARG A 118 -7.291 5.293 18.375 1.00 0.00 C ATOM 1936 NE ARG A 118 -6.007 5.964 18.193 1.00 0.00 N ATOM 1937 CZ ARG A 118 -5.882 7.240 17.836 1.00 0.00 C ATOM 1938 NH1 ARG A 118 -6.959 7.984 17.621 1.00 0.00 N ATOM 1939 NH2 ARG A 118 -4.677 7.774 17.692 1.00 0.00 N ATOM 0 H ARG A 118 -6.204 1.660 17.970 1.00 0.00 H new ATOM 0 HA ARG A 118 -9.088 1.314 18.136 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -7.974 3.432 16.396 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -9.173 3.547 17.670 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -7.266 3.381 19.350 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -6.153 3.511 18.003 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -7.980 5.611 17.593 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -7.727 5.597 19.327 1.00 0.00 H new ATOM 0 HE ARG A 118 -5.156 5.423 18.349 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -7.889 7.579 17.729 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -6.857 8.961 17.348 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -3.845 7.207 17.855 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -4.582 8.752 17.418 1.00 0.00 H new ATOM 1953 N LEU A 119 -7.405 0.444 15.529 1.00 0.00 N ATOM 1954 CA LEU A 119 -7.491 -0.149 14.188 1.00 0.00 C ATOM 1955 C LEU A 119 -7.487 0.923 13.100 1.00 0.00 C ATOM 1956 O LEU A 119 -7.970 0.707 11.984 1.00 0.00 O ATOM 1957 CB LEU A 119 -8.745 -1.010 14.060 1.00 0.00 C ATOM 1958 CG LEU A 119 -8.891 -2.129 15.103 1.00 0.00 C ATOM 1959 CD1 LEU A 119 -9.852 -3.200 14.605 1.00 0.00 C ATOM 1960 CD2 LEU A 119 -7.536 -2.744 15.440 1.00 0.00 C ATOM 0 H LEU A 119 -6.484 0.371 15.962 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.610 -0.776 14.053 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.618 -0.361 14.125 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.756 -1.460 13.067 1.00 0.00 H new ATOM 0 HG LEU A 119 -9.299 -1.690 16.013 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -9.943 -3.985 15.356 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.830 -2.755 14.424 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -9.471 -3.628 13.678 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -7.669 -3.533 16.180 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -7.093 -3.164 14.537 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.878 -1.975 15.844 1.00 0.00 H new ATOM 1972 N ASP A 120 -6.926 2.073 13.435 1.00 0.00 N ATOM 1973 CA ASP A 120 -6.829 3.191 12.504 1.00 0.00 C ATOM 1974 C ASP A 120 -5.407 3.741 12.499 1.00 0.00 C ATOM 1975 O ASP A 120 -4.716 3.690 13.515 1.00 0.00 O ATOM 1976 CB ASP A 120 -7.820 4.293 12.885 1.00 0.00 C ATOM 1977 CG ASP A 120 -9.257 3.905 12.599 1.00 0.00 C ATOM 1978 OD1 ASP A 120 -9.530 2.693 12.467 1.00 0.00 O ATOM 1979 OD2 ASP A 120 -10.110 4.812 12.506 1.00 0.00 O ATOM 0 H ASP A 120 -6.526 2.260 14.354 1.00 0.00 H new ATOM 0 HA ASP A 120 -7.076 2.836 11.504 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -7.713 4.523 13.945 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -7.576 5.202 12.336 1.00 0.00 H new ATOM 1984 N GLY A 121 -4.962 4.258 11.361 1.00 0.00 N ATOM 1985 CA GLY A 121 -3.615 4.790 11.288 1.00 0.00 C ATOM 1986 C GLY A 121 -3.461 5.916 10.289 1.00 0.00 C ATOM 1987 O GLY A 121 -4.324 6.788 10.184 1.00 0.00 O ATOM 0 H GLY A 121 -5.501 4.318 10.497 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -3.321 5.148 12.275 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -2.929 3.985 11.024 1.00 0.00 H new ATOM 1991 N MET A 122 -2.348 5.903 9.560 1.00 0.00 N ATOM 1992 CA MET A 122 -2.069 6.938 8.570 1.00 0.00 C ATOM 1993 C MET A 122 -1.392 6.349 7.335 1.00 0.00 C ATOM 1994 O MET A 122 -0.420 5.601 7.445 1.00 0.00 O ATOM 1995 CB MET A 122 -1.186 8.028 9.182 1.00 0.00 C ATOM 1996 CG MET A 122 -0.800 9.125 8.203 1.00 0.00 C ATOM 1997 SD MET A 122 -0.283 10.643 9.027 1.00 0.00 S ATOM 1998 CE MET A 122 -1.862 11.286 9.575 1.00 0.00 C ATOM 0 H MET A 122 -1.625 5.187 9.637 1.00 0.00 H new ATOM 0 HA MET A 122 -3.018 7.376 8.262 1.00 0.00 H new ATOM 0 HB2 MET A 122 -1.710 8.475 10.027 1.00 0.00 H new ATOM 0 HB3 MET A 122 -0.279 7.569 9.576 1.00 0.00 H new ATOM 0 HG2 MET A 122 0.009 8.769 7.565 1.00 0.00 H new ATOM 0 HG3 MET A 122 -1.648 9.340 7.552 1.00 0.00 H new ATOM 0 HE1 MET A 122 -1.765 11.675 10.589 1.00 0.00 H new ATOM 0 HE2 MET A 122 -2.180 12.087 8.908 1.00 0.00 H new ATOM 0 HE3 MET A 122 -2.604 10.488 9.563 1.00 0.00 H new ATOM 2008 N GLY A 123 -1.908 6.698 6.162 1.00 0.00 N ATOM 2009 CA GLY A 123 -1.341 6.203 4.922 1.00 0.00 C ATOM 2010 C GLY A 123 -0.795 7.319 4.055 1.00 0.00 C ATOM 2011 O GLY A 123 -0.797 8.482 4.460 1.00 0.00 O ATOM 0 H GLY A 123 -2.711 7.317 6.048 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.542 5.496 5.147 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -2.104 5.656 4.369 1.00 0.00 H new ATOM 2015 N CYS A 124 -0.325 6.969 2.862 1.00 0.00 N ATOM 2016 CA CYS A 124 0.230 7.954 1.941 1.00 0.00 C ATOM 2017 C CYS A 124 0.670 7.300 0.636 1.00 0.00 C ATOM 2018 O CYS A 124 1.003 6.115 0.604 1.00 0.00 O ATOM 2019 CB CYS A 124 1.421 8.669 2.585 1.00 0.00 C ATOM 2020 SG CYS A 124 2.865 7.613 2.854 1.00 0.00 S ATOM 0 H CYS A 124 -0.317 6.011 2.511 1.00 0.00 H new ATOM 0 HA CYS A 124 -0.551 8.680 1.717 1.00 0.00 H new ATOM 0 HB2 CYS A 124 1.712 9.508 1.953 1.00 0.00 H new ATOM 0 HB3 CYS A 124 1.106 9.085 3.542 1.00 0.00 H new ATOM 0 HG CYS A 124 2.474 6.397 3.094 1.00 0.00 H new ATOM 2026 N LEU A 125 0.684 8.085 -0.436 1.00 0.00 N ATOM 2027 CA LEU A 125 1.101 7.587 -1.743 1.00 0.00 C ATOM 2028 C LEU A 125 2.485 8.129 -2.093 1.00 0.00 C ATOM 2029 O LEU A 125 2.841 9.238 -1.701 1.00 0.00 O ATOM 2030 CB LEU A 125 0.085 7.982 -2.818 1.00 0.00 C ATOM 2031 CG LEU A 125 -1.204 7.159 -2.833 1.00 0.00 C ATOM 2032 CD1 LEU A 125 -2.099 7.589 -3.985 1.00 0.00 C ATOM 2033 CD2 LEU A 125 -0.887 5.675 -2.928 1.00 0.00 C ATOM 0 H LEU A 125 0.412 9.068 -0.426 1.00 0.00 H new ATOM 0 HA LEU A 125 1.150 6.499 -1.702 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -0.175 9.032 -2.681 1.00 0.00 H new ATOM 0 HB3 LEU A 125 0.562 7.897 -3.794 1.00 0.00 H new ATOM 0 HG LEU A 125 -1.737 7.338 -1.899 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.011 6.992 -3.979 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.354 8.643 -3.874 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -1.574 7.440 -4.929 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -1.816 5.104 -2.937 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -0.332 5.480 -3.845 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -0.286 5.376 -2.069 1.00 0.00 H new ATOM 2045 N GLU A 126 3.270 7.340 -2.820 1.00 0.00 N ATOM 2046 CA GLU A 126 4.614 7.752 -3.203 1.00 0.00 C ATOM 2047 C GLU A 126 5.035 7.109 -4.520 1.00 0.00 C ATOM 2048 O GLU A 126 5.151 5.887 -4.615 1.00 0.00 O ATOM 2049 CB GLU A 126 5.613 7.392 -2.100 1.00 0.00 C ATOM 2050 CG GLU A 126 6.126 8.598 -1.329 1.00 0.00 C ATOM 2051 CD GLU A 126 7.479 8.352 -0.691 1.00 0.00 C ATOM 2052 OE1 GLU A 126 8.183 7.419 -1.133 1.00 0.00 O ATOM 2053 OE2 GLU A 126 7.836 9.092 0.250 1.00 0.00 O ATOM 0 H GLU A 126 2.999 6.415 -3.154 1.00 0.00 H new ATOM 0 HA GLU A 126 4.607 8.833 -3.341 1.00 0.00 H new ATOM 0 HB2 GLU A 126 5.139 6.700 -1.404 1.00 0.00 H new ATOM 0 HB3 GLU A 126 6.459 6.868 -2.544 1.00 0.00 H new ATOM 0 HG2 GLU A 126 6.196 9.452 -2.003 1.00 0.00 H new ATOM 0 HG3 GLU A 126 5.406 8.862 -0.554 1.00 0.00 H new ATOM 2060 N PHE A 127 5.266 7.937 -5.529 1.00 0.00 N ATOM 2061 CA PHE A 127 5.675 7.476 -6.831 1.00 0.00 C ATOM 2062 C PHE A 127 6.843 6.501 -6.765 1.00 0.00 C ATOM 2063 O PHE A 127 7.606 6.481 -5.799 1.00 0.00 O ATOM 2064 CB PHE A 127 6.088 8.680 -7.656 1.00 0.00 C ATOM 2065 CG PHE A 127 6.191 8.370 -9.099 1.00 0.00 C ATOM 2066 CD1 PHE A 127 7.348 7.837 -9.621 1.00 0.00 C ATOM 2067 CD2 PHE A 127 5.123 8.604 -9.921 1.00 0.00 C ATOM 2068 CE1 PHE A 127 7.440 7.537 -10.963 1.00 0.00 C ATOM 2069 CE2 PHE A 127 5.198 8.311 -11.271 1.00 0.00 C ATOM 2070 CZ PHE A 127 6.363 7.774 -11.793 1.00 0.00 C ATOM 0 H PHE A 127 5.172 8.950 -5.458 1.00 0.00 H new ATOM 0 HA PHE A 127 4.834 6.948 -7.280 1.00 0.00 H new ATOM 0 HB2 PHE A 127 5.364 9.482 -7.511 1.00 0.00 H new ATOM 0 HB3 PHE A 127 7.049 9.050 -7.298 1.00 0.00 H new ATOM 0 HD1 PHE A 127 8.192 7.652 -8.973 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.214 9.021 -9.513 1.00 0.00 H new ATOM 0 HE1 PHE A 127 8.351 7.118 -11.364 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.352 8.500 -11.915 1.00 0.00 H new ATOM 0 HZ PHE A 127 6.429 7.542 -12.846 1.00 0.00 H new ATOM 2080 N ASP A 128 6.990 5.720 -7.828 1.00 0.00 N ATOM 2081 CA ASP A 128 8.080 4.766 -7.939 1.00 0.00 C ATOM 2082 C ASP A 128 8.747 4.918 -9.301 1.00 0.00 C ATOM 2083 O ASP A 128 8.234 4.438 -10.311 1.00 0.00 O ATOM 2084 CB ASP A 128 7.565 3.335 -7.758 1.00 0.00 C ATOM 2085 CG ASP A 128 8.421 2.531 -6.799 1.00 0.00 C ATOM 2086 OD1 ASP A 128 8.994 3.134 -5.868 1.00 0.00 O ATOM 2087 OD2 ASP A 128 8.520 1.299 -6.981 1.00 0.00 O ATOM 0 H ASP A 128 6.361 5.731 -8.631 1.00 0.00 H new ATOM 0 HA ASP A 128 8.809 4.966 -7.154 1.00 0.00 H new ATOM 0 HB2 ASP A 128 6.540 3.364 -7.389 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.541 2.835 -8.726 1.00 0.00 H new ATOM 2092 N GLU A 129 9.886 5.600 -9.322 1.00 0.00 N ATOM 2093 CA GLU A 129 10.615 5.828 -10.564 1.00 0.00 C ATOM 2094 C GLU A 129 11.595 4.691 -10.851 1.00 0.00 C ATOM 2095 O GLU A 129 12.406 4.781 -11.772 1.00 0.00 O ATOM 2096 CB GLU A 129 11.356 7.166 -10.505 1.00 0.00 C ATOM 2097 CG GLU A 129 10.437 8.381 -10.566 1.00 0.00 C ATOM 2098 CD GLU A 129 11.204 9.689 -10.593 1.00 0.00 C ATOM 2099 OE1 GLU A 129 12.143 9.810 -11.408 1.00 0.00 O ATOM 2100 OE2 GLU A 129 10.866 10.593 -9.799 1.00 0.00 O ATOM 0 H GLU A 129 10.324 6.004 -8.494 1.00 0.00 H new ATOM 0 HA GLU A 129 9.891 5.858 -11.378 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.938 7.208 -9.584 1.00 0.00 H new ATOM 0 HB3 GLU A 129 12.064 7.216 -11.332 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.809 8.313 -11.455 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.771 8.372 -9.703 1.00 0.00 H new ATOM 2107 N GLU A 130 11.508 3.617 -10.067 1.00 0.00 N ATOM 2108 CA GLU A 130 12.380 2.463 -10.253 1.00 0.00 C ATOM 2109 C GLU A 130 11.812 1.540 -11.324 1.00 0.00 C ATOM 2110 O GLU A 130 12.477 1.233 -12.314 1.00 0.00 O ATOM 2111 CB GLU A 130 12.543 1.700 -8.936 1.00 0.00 C ATOM 2112 CG GLU A 130 13.407 2.424 -7.918 1.00 0.00 C ATOM 2113 CD GLU A 130 14.886 2.147 -8.106 1.00 0.00 C ATOM 2114 OE1 GLU A 130 15.380 2.312 -9.241 1.00 0.00 O ATOM 2115 OE2 GLU A 130 15.550 1.768 -7.119 1.00 0.00 O ATOM 0 H GLU A 130 10.843 3.524 -9.299 1.00 0.00 H new ATOM 0 HA GLU A 130 13.359 2.817 -10.576 1.00 0.00 H new ATOM 0 HB2 GLU A 130 11.558 1.523 -8.504 1.00 0.00 H new ATOM 0 HB3 GLU A 130 12.981 0.723 -9.143 1.00 0.00 H new ATOM 0 HG2 GLU A 130 13.230 3.497 -7.994 1.00 0.00 H new ATOM 0 HG3 GLU A 130 13.109 2.122 -6.914 1.00 0.00 H new ATOM 2122 N ARG A 131 10.572 1.107 -11.120 1.00 0.00 N ATOM 2123 CA ARG A 131 9.899 0.226 -12.068 1.00 0.00 C ATOM 2124 C ARG A 131 9.302 1.033 -13.215 1.00 0.00 C ATOM 2125 O ARG A 131 9.320 0.603 -14.368 1.00 0.00 O ATOM 2126 CB ARG A 131 8.798 -0.567 -11.364 1.00 0.00 C ATOM 2127 CG ARG A 131 8.495 -1.904 -12.019 1.00 0.00 C ATOM 2128 CD ARG A 131 9.576 -2.930 -11.723 1.00 0.00 C ATOM 2129 NE ARG A 131 9.040 -4.288 -11.669 1.00 0.00 N ATOM 2130 CZ ARG A 131 9.781 -5.385 -11.816 1.00 0.00 C ATOM 2131 NH1 ARG A 131 11.088 -5.290 -12.024 1.00 0.00 N ATOM 2132 NH2 ARG A 131 9.212 -6.581 -11.755 1.00 0.00 N ATOM 0 H ARG A 131 10.011 1.353 -10.304 1.00 0.00 H new ATOM 0 HA ARG A 131 10.635 -0.469 -12.473 1.00 0.00 H new ATOM 0 HB2 ARG A 131 9.091 -0.738 -10.328 1.00 0.00 H new ATOM 0 HB3 ARG A 131 7.888 0.032 -11.343 1.00 0.00 H new ATOM 0 HG2 ARG A 131 7.534 -2.275 -11.663 1.00 0.00 H new ATOM 0 HG3 ARG A 131 8.406 -1.770 -13.097 1.00 0.00 H new ATOM 0 HD2 ARG A 131 10.348 -2.875 -12.490 1.00 0.00 H new ATOM 0 HD3 ARG A 131 10.053 -2.690 -10.773 1.00 0.00 H new ATOM 0 HE ARG A 131 8.039 -4.403 -11.509 1.00 0.00 H new ATOM 0 HH11 ARG A 131 11.531 -4.373 -12.072 1.00 0.00 H new ATOM 0 HH12 ARG A 131 11.649 -6.134 -12.136 1.00 0.00 H new ATOM 0 HH21 ARG A 131 8.208 -6.660 -11.596 1.00 0.00 H new ATOM 0 HH22 ARG A 131 9.779 -7.422 -11.867 1.00 0.00 H new ATOM 2146 N ALA A 132 8.770 2.205 -12.882 1.00 0.00 N ATOM 2147 CA ALA A 132 8.157 3.083 -13.873 1.00 0.00 C ATOM 2148 C ALA A 132 9.103 3.358 -15.039 1.00 0.00 C ATOM 2149 O ALA A 132 8.697 3.328 -16.200 1.00 0.00 O ATOM 2150 CB ALA A 132 7.730 4.391 -13.223 1.00 0.00 C ATOM 0 H ALA A 132 8.751 2.570 -11.930 1.00 0.00 H new ATOM 0 HA ALA A 132 7.278 2.576 -14.270 1.00 0.00 H new ATOM 0 HB1 ALA A 132 7.274 5.038 -13.972 1.00 0.00 H new ATOM 0 HB2 ALA A 132 7.008 4.186 -12.433 1.00 0.00 H new ATOM 0 HB3 ALA A 132 8.602 4.888 -12.797 1.00 0.00 H new ATOM 2156 N GLN A 133 10.365 3.630 -14.721 1.00 0.00 N ATOM 2157 CA GLN A 133 11.364 3.915 -15.746 1.00 0.00 C ATOM 2158 C GLN A 133 11.588 2.703 -16.645 1.00 0.00 C ATOM 2159 O GLN A 133 11.793 2.844 -17.850 1.00 0.00 O ATOM 2160 CB GLN A 133 12.685 4.338 -15.099 1.00 0.00 C ATOM 2161 CG GLN A 133 13.288 3.275 -14.196 1.00 0.00 C ATOM 2162 CD GLN A 133 14.714 3.594 -13.792 1.00 0.00 C ATOM 2163 OE1 GLN A 133 15.613 2.763 -13.932 1.00 0.00 O ATOM 2164 NE2 GLN A 133 14.930 4.804 -13.288 1.00 0.00 N ATOM 0 H GLN A 133 10.720 3.659 -13.765 1.00 0.00 H new ATOM 0 HA GLN A 133 10.991 4.734 -16.361 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.401 4.586 -15.883 1.00 0.00 H new ATOM 0 HB3 GLN A 133 12.521 5.246 -14.518 1.00 0.00 H new ATOM 0 HG2 GLN A 133 12.675 3.174 -13.301 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.266 2.313 -14.708 1.00 0.00 H new ATOM 0 HE21 GLN A 133 14.156 5.461 -13.190 1.00 0.00 H new ATOM 0 HE22 GLN A 133 15.870 5.076 -12.999 1.00 0.00 H new ATOM 2173 N GLN A 134 11.550 1.513 -16.054 1.00 0.00 N ATOM 2174 CA GLN A 134 11.750 0.283 -16.811 1.00 0.00 C ATOM 2175 C GLN A 134 10.639 0.090 -17.831 1.00 0.00 C ATOM 2176 O GLN A 134 10.883 -0.385 -18.940 1.00 0.00 O ATOM 2177 CB GLN A 134 11.821 -0.921 -15.871 1.00 0.00 C ATOM 2178 CG GLN A 134 13.236 -1.276 -15.442 1.00 0.00 C ATOM 2179 CD GLN A 134 13.278 -1.986 -14.104 1.00 0.00 C ATOM 2180 OE1 GLN A 134 13.084 -3.199 -14.025 1.00 0.00 O ATOM 2181 NE2 GLN A 134 13.533 -1.231 -13.041 1.00 0.00 N ATOM 0 H GLN A 134 11.383 1.375 -15.057 1.00 0.00 H new ATOM 0 HA GLN A 134 12.697 0.365 -17.345 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.222 -0.714 -14.984 1.00 0.00 H new ATOM 0 HB3 GLN A 134 11.373 -1.783 -16.364 1.00 0.00 H new ATOM 0 HG2 GLN A 134 13.693 -1.911 -16.201 1.00 0.00 H new ATOM 0 HG3 GLN A 134 13.834 -0.366 -15.385 1.00 0.00 H new ATOM 0 HE21 GLN A 134 13.688 -0.229 -13.152 1.00 0.00 H new ATOM 0 HE22 GLN A 134 13.574 -1.653 -12.113 1.00 0.00 H new ATOM 2190 N GLU A 135 9.420 0.477 -17.465 1.00 0.00 N ATOM 2191 CA GLU A 135 8.287 0.358 -18.377 1.00 0.00 C ATOM 2192 C GLU A 135 8.662 0.971 -19.716 1.00 0.00 C ATOM 2193 O GLU A 135 8.299 0.462 -20.776 1.00 0.00 O ATOM 2194 CB GLU A 135 7.046 1.052 -17.809 1.00 0.00 C ATOM 2195 CG GLU A 135 6.861 0.853 -16.313 1.00 0.00 C ATOM 2196 CD GLU A 135 6.947 -0.605 -15.902 1.00 0.00 C ATOM 2197 OE1 GLU A 135 8.025 -1.210 -16.081 1.00 0.00 O ATOM 2198 OE2 GLU A 135 5.937 -1.141 -15.399 1.00 0.00 O ATOM 0 H GLU A 135 9.193 0.872 -16.552 1.00 0.00 H new ATOM 0 HA GLU A 135 8.048 -0.698 -18.506 1.00 0.00 H new ATOM 0 HB2 GLU A 135 7.111 2.120 -18.019 1.00 0.00 H new ATOM 0 HB3 GLU A 135 6.163 0.678 -18.328 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.621 1.423 -15.778 1.00 0.00 H new ATOM 0 HG3 GLU A 135 5.893 1.254 -16.014 1.00 0.00 H new ATOM 2205 N ASP A 136 9.421 2.058 -19.648 1.00 0.00 N ATOM 2206 CA ASP A 136 9.886 2.739 -20.835 1.00 0.00 C ATOM 2207 C ASP A 136 10.944 1.896 -21.536 1.00 0.00 C ATOM 2208 O ASP A 136 10.991 1.837 -22.764 1.00 0.00 O ATOM 2209 CB ASP A 136 10.457 4.112 -20.477 1.00 0.00 C ATOM 2210 CG ASP A 136 9.401 5.200 -20.497 1.00 0.00 C ATOM 2211 OD1 ASP A 136 8.897 5.517 -21.594 1.00 0.00 O ATOM 2212 OD2 ASP A 136 9.077 5.733 -19.415 1.00 0.00 O ATOM 0 H ASP A 136 9.726 2.484 -18.773 1.00 0.00 H new ATOM 0 HA ASP A 136 9.041 2.883 -21.509 1.00 0.00 H new ATOM 0 HB2 ASP A 136 10.910 4.067 -19.487 1.00 0.00 H new ATOM 0 HB3 ASP A 136 11.251 4.367 -21.179 1.00 0.00 H new ATOM 2217 N ALA A 137 11.792 1.238 -20.743 1.00 0.00 N ATOM 2218 CA ALA A 137 12.840 0.397 -21.288 1.00 0.00 C ATOM 2219 C ALA A 137 12.251 -0.838 -21.959 1.00 0.00 C ATOM 2220 O ALA A 137 12.609 -1.179 -23.085 1.00 0.00 O ATOM 2221 CB ALA A 137 13.817 -0.005 -20.195 1.00 0.00 C ATOM 0 H ALA A 137 11.767 1.276 -19.724 1.00 0.00 H new ATOM 0 HA ALA A 137 13.379 0.968 -22.044 1.00 0.00 H new ATOM 0 HB1 ALA A 137 14.598 -0.636 -20.619 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.267 0.889 -19.763 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.287 -0.556 -19.418 1.00 0.00 H new ATOM 2227 N LEU A 138 11.347 -1.511 -21.253 1.00 0.00 N ATOM 2228 CA LEU A 138 10.710 -2.708 -21.768 1.00 0.00 C ATOM 2229 C LEU A 138 9.757 -2.374 -22.905 1.00 0.00 C ATOM 2230 O LEU A 138 9.665 -3.110 -23.888 1.00 0.00 O ATOM 2231 CB LEU A 138 9.963 -3.438 -20.648 1.00 0.00 C ATOM 2232 CG LEU A 138 10.813 -3.798 -19.424 1.00 0.00 C ATOM 2233 CD1 LEU A 138 10.393 -5.148 -18.861 1.00 0.00 C ATOM 2234 CD2 LEU A 138 12.294 -3.804 -19.780 1.00 0.00 C ATOM 0 H LEU A 138 11.041 -1.242 -20.318 1.00 0.00 H new ATOM 0 HA LEU A 138 11.489 -3.363 -22.159 1.00 0.00 H new ATOM 0 HB2 LEU A 138 9.131 -2.815 -20.322 1.00 0.00 H new ATOM 0 HB3 LEU A 138 9.535 -4.354 -21.055 1.00 0.00 H new ATOM 0 HG LEU A 138 10.649 -3.039 -18.659 1.00 0.00 H new ATOM 0 HD11 LEU A 138 11.007 -5.387 -17.993 1.00 0.00 H new ATOM 0 HD12 LEU A 138 9.345 -5.108 -18.564 1.00 0.00 H new ATOM 0 HD13 LEU A 138 10.526 -5.917 -19.622 1.00 0.00 H new ATOM 0 HD21 LEU A 138 12.879 -4.062 -18.897 1.00 0.00 H new ATOM 0 HD22 LEU A 138 12.477 -4.539 -20.564 1.00 0.00 H new ATOM 0 HD23 LEU A 138 12.587 -2.816 -20.134 1.00 0.00 H new ATOM 2246 N ALA A 139 9.056 -1.256 -22.773 1.00 0.00 N ATOM 2247 CA ALA A 139 8.125 -0.828 -23.794 1.00 0.00 C ATOM 2248 C ALA A 139 8.875 -0.376 -25.038 1.00 0.00 C ATOM 2249 O ALA A 139 8.311 -0.315 -26.130 1.00 0.00 O ATOM 2250 CB ALA A 139 7.236 0.290 -23.272 1.00 0.00 C ATOM 0 H ALA A 139 9.118 -0.633 -21.968 1.00 0.00 H new ATOM 0 HA ALA A 139 7.491 -1.674 -24.060 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.542 0.599 -24.054 1.00 0.00 H new ATOM 0 HB2 ALA A 139 6.674 -0.065 -22.408 1.00 0.00 H new ATOM 0 HB3 ALA A 139 7.853 1.139 -22.979 1.00 0.00 H new ATOM 2256 N GLN A 140 10.151 -0.046 -24.860 1.00 0.00 N ATOM 2257 CA GLN A 140 10.979 0.412 -25.941 1.00 0.00 C ATOM 2258 C GLN A 140 12.315 -0.325 -25.957 1.00 0.00 C ATOM 2259 O GLN A 140 13.207 -0.031 -25.162 1.00 0.00 O ATOM 2260 CB GLN A 140 11.207 1.908 -25.776 1.00 0.00 C ATOM 2261 CG GLN A 140 9.975 2.657 -25.288 1.00 0.00 C ATOM 2262 CD GLN A 140 10.281 4.088 -24.890 1.00 0.00 C ATOM 2263 OE1 GLN A 140 11.299 4.651 -25.292 1.00 0.00 O ATOM 2264 NE2 GLN A 140 9.399 4.682 -24.094 1.00 0.00 N ATOM 0 H GLN A 140 10.627 -0.093 -23.959 1.00 0.00 H new ATOM 0 HA GLN A 140 10.479 0.210 -26.888 1.00 0.00 H new ATOM 0 HB2 GLN A 140 12.023 2.068 -25.071 1.00 0.00 H new ATOM 0 HB3 GLN A 140 11.523 2.327 -26.731 1.00 0.00 H new ATOM 0 HG2 GLN A 140 9.219 2.656 -26.073 1.00 0.00 H new ATOM 0 HG3 GLN A 140 9.548 2.130 -24.435 1.00 0.00 H new ATOM 0 HE21 GLN A 140 8.569 4.176 -23.785 1.00 0.00 H new ATOM 0 HE22 GLN A 140 9.552 5.644 -23.791 1.00 0.00 H new ATOM 2273 N GLN A 141 12.449 -1.278 -26.872 1.00 0.00 N ATOM 2274 CA GLN A 141 13.679 -2.054 -26.995 1.00 0.00 C ATOM 2275 C GLN A 141 14.453 -1.651 -28.245 1.00 0.00 C ATOM 2276 O GLN A 141 15.485 -2.293 -28.533 1.00 0.00 O ATOM 2277 CB GLN A 141 13.359 -3.549 -27.038 1.00 0.00 C ATOM 2278 CG GLN A 141 12.743 -4.077 -25.753 1.00 0.00 C ATOM 2279 CD GLN A 141 11.746 -5.191 -26.000 1.00 0.00 C ATOM 2280 OE1 GLN A 141 12.009 -6.117 -26.768 1.00 0.00 O ATOM 2281 NE2 GLN A 141 10.592 -5.108 -25.349 1.00 0.00 N ATOM 2282 OXT GLN A 141 14.022 -0.697 -28.926 1.00 0.00 O ATOM 0 H GLN A 141 11.721 -1.533 -27.540 1.00 0.00 H new ATOM 0 HA GLN A 141 14.300 -1.847 -26.123 1.00 0.00 H new ATOM 0 HB2 GLN A 141 12.675 -3.742 -27.865 1.00 0.00 H new ATOM 0 HB3 GLN A 141 14.275 -4.102 -27.246 1.00 0.00 H new ATOM 0 HG2 GLN A 141 13.534 -4.441 -25.098 1.00 0.00 H new ATOM 0 HG3 GLN A 141 12.247 -3.260 -25.230 1.00 0.00 H new ATOM 0 HE21 GLN A 141 10.416 -4.323 -24.722 1.00 0.00 H new ATOM 0 HE22 GLN A 141 9.882 -5.829 -25.476 1.00 0.00 H new TER 2291 GLN A 141