USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 994 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 120 LYS NZ :NH3+ -170:sc= 0.00295 (180deg=0) USER MOD Set 1.2: A 122 HIS : no HE2:sc= -2.51! X(o=-2.5!,f=-2.1) USER MOD Set 2.1: A 73 HIS : no HE2:sc= -1.72! C(o=-1.4!,f=-5.3!) USER MOD Set 2.2: A 85 SER OG : rot -131:sc= 0.342 USER MOD Set 3.1: A 81 THR OG1 : rot 47:sc= 0.26 USER MOD Set 3.2: A 104 LYS NZ :NH3+ 169:sc= 0.199 (180deg=0) USER MOD Set 4.1: A 67 TYR OH : rot -31:sc= 0.833 USER MOD Set 4.2: A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 55 LYS NZ :NH3+ -154:sc= 0.636 (180deg=0.385) USER MOD Set 5.2: A 82 TYR OH : rot 163:sc= -4.33! USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 100:sc= -2.65! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.286 X(o=-0.29,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 40 LYS NZ :NH3+ 149:sc= -0.315 (180deg=-1.4!) USER MOD Single : A 41 CYS SG : rot 60:sc= -0.176 USER MOD Single : A 53 THR OG1 : rot 0:sc= -5.63! USER MOD Single : A 56 LYS NZ :NH3+ -162:sc= -0.0553 (180deg=-0.455) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 HIS :FLIP no HD1:sc= -4.24! C(o=-6.3!,f=-4.2!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.167 X(o=-0.17,f=-0.019) USER MOD Single : A 80 HIS : no HE2:sc= -0.149 X(o=-0.15,f=-0.43) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 112:sc= 0.661 USER MOD Single : A 93 SER OG : rot 31:sc= 0.0356 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot 30:sc= -0.0227 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 113 THR OG1 : rot 162:sc= 0.376 USER MOD Single : A 116 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0128) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot -103:sc= 1.16 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.0389 X(o=-0.039,f=-0.12) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 TYR OH : rot 123:sc= -2.8! USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -8.138 -1.291 18.551 1.00 0.00 N ATOM 9 CA VAL A 3 -6.796 -1.527 17.949 1.00 0.00 C ATOM 10 C VAL A 3 -6.479 -0.410 16.954 1.00 0.00 C ATOM 11 O VAL A 3 -7.326 0.017 16.196 1.00 0.00 O ATOM 12 CB VAL A 3 -6.789 -2.872 17.219 1.00 0.00 C ATOM 13 CG1 VAL A 3 -7.635 -2.768 15.949 1.00 0.00 C ATOM 14 CG2 VAL A 3 -5.352 -3.237 16.843 1.00 0.00 C ATOM 0 HA VAL A 3 -6.044 -1.538 18.738 1.00 0.00 H new ATOM 0 HB VAL A 3 -7.204 -3.642 17.870 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -7.630 -3.726 15.429 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.659 -2.505 16.214 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -7.220 -1.999 15.297 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -5.344 -4.195 16.323 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.940 -2.467 16.191 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.747 -3.310 17.747 1.00 0.00 H new ATOM 24 N TYR A 4 -5.264 0.064 16.950 1.00 0.00 N ATOM 25 CA TYR A 4 -4.893 1.151 16.003 1.00 0.00 C ATOM 26 C TYR A 4 -3.902 0.609 14.971 1.00 0.00 C ATOM 27 O TYR A 4 -3.214 -0.364 15.207 1.00 0.00 O ATOM 28 CB TYR A 4 -4.244 2.303 16.773 1.00 0.00 C ATOM 29 CG TYR A 4 -5.224 2.847 17.785 1.00 0.00 C ATOM 30 CD1 TYR A 4 -6.215 3.752 17.383 1.00 0.00 C ATOM 31 CD2 TYR A 4 -5.140 2.450 19.124 1.00 0.00 C ATOM 32 CE1 TYR A 4 -7.122 4.257 18.320 1.00 0.00 C ATOM 33 CE2 TYR A 4 -6.048 2.955 20.063 1.00 0.00 C ATOM 34 CZ TYR A 4 -7.038 3.859 19.660 1.00 0.00 C ATOM 35 OH TYR A 4 -7.934 4.358 20.585 1.00 0.00 O ATOM 0 H TYR A 4 -4.513 -0.255 17.562 1.00 0.00 H new ATOM 0 HA TYR A 4 -5.788 1.512 15.497 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -3.341 1.956 17.275 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -3.942 3.091 16.083 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -6.278 4.060 16.350 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -4.375 1.754 19.434 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -7.887 4.954 18.010 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -5.985 2.648 21.096 1.00 0.00 H new ATOM 0 HH TYR A 4 -7.738 3.980 21.468 1.00 0.00 H new ATOM 45 N THR A 5 -3.823 1.232 13.829 1.00 0.00 N ATOM 46 CA THR A 5 -2.877 0.756 12.782 1.00 0.00 C ATOM 47 C THR A 5 -1.554 1.515 12.913 1.00 0.00 C ATOM 48 O THR A 5 -1.530 2.688 13.228 1.00 0.00 O ATOM 49 CB THR A 5 -3.478 1.009 11.398 1.00 0.00 C ATOM 50 OG1 THR A 5 -4.753 0.388 11.317 1.00 0.00 O ATOM 51 CG2 THR A 5 -2.556 0.427 10.327 1.00 0.00 C ATOM 0 H THR A 5 -4.374 2.052 13.575 1.00 0.00 H new ATOM 0 HA THR A 5 -2.699 -0.312 12.908 1.00 0.00 H new ATOM 0 HB THR A 5 -3.585 2.082 11.238 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.140 0.550 10.432 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.984 0.607 9.341 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.578 0.904 10.391 1.00 0.00 H new ATOM 0 HG23 THR A 5 -2.447 -0.646 10.485 1.00 0.00 H new ATOM 59 N TYR A 6 -0.454 0.856 12.675 1.00 0.00 N ATOM 60 CA TYR A 6 0.864 1.543 12.790 1.00 0.00 C ATOM 61 C TYR A 6 1.613 1.448 11.460 1.00 0.00 C ATOM 62 O TYR A 6 1.628 0.416 10.817 1.00 0.00 O ATOM 63 CB TYR A 6 1.691 0.876 13.891 1.00 0.00 C ATOM 64 CG TYR A 6 2.987 1.629 14.074 1.00 0.00 C ATOM 65 CD1 TYR A 6 3.037 2.739 14.927 1.00 0.00 C ATOM 66 CD2 TYR A 6 4.139 1.217 13.394 1.00 0.00 C ATOM 67 CE1 TYR A 6 4.240 3.436 15.098 1.00 0.00 C ATOM 68 CE2 TYR A 6 5.341 1.915 13.565 1.00 0.00 C ATOM 69 CZ TYR A 6 5.391 3.024 14.418 1.00 0.00 C ATOM 70 OH TYR A 6 6.575 3.712 14.586 1.00 0.00 O ATOM 0 H TYR A 6 -0.410 -0.127 12.406 1.00 0.00 H new ATOM 0 HA TYR A 6 0.704 2.592 13.039 1.00 0.00 H new ATOM 0 HB2 TYR A 6 1.130 0.864 14.825 1.00 0.00 H new ATOM 0 HB3 TYR A 6 1.895 -0.162 13.629 1.00 0.00 H new ATOM 0 HD1 TYR A 6 2.149 3.057 15.452 1.00 0.00 H new ATOM 0 HD2 TYR A 6 4.101 0.361 12.737 1.00 0.00 H new ATOM 0 HE1 TYR A 6 4.279 4.292 15.755 1.00 0.00 H new ATOM 0 HE2 TYR A 6 6.229 1.598 13.039 1.00 0.00 H new ATOM 0 HH TYR A 6 7.276 3.294 14.043 1.00 0.00 H new ATOM 80 N GLU A 7 2.238 2.514 11.044 1.00 0.00 N ATOM 81 CA GLU A 7 2.990 2.486 9.758 1.00 0.00 C ATOM 82 C GLU A 7 4.490 2.543 10.049 1.00 0.00 C ATOM 83 O GLU A 7 4.931 3.231 10.949 1.00 0.00 O ATOM 84 CB GLU A 7 2.590 3.693 8.906 1.00 0.00 C ATOM 85 CG GLU A 7 3.316 3.629 7.561 1.00 0.00 C ATOM 86 CD GLU A 7 2.938 4.852 6.721 1.00 0.00 C ATOM 87 OE1 GLU A 7 2.228 5.701 7.233 1.00 0.00 O ATOM 88 OE2 GLU A 7 3.366 4.916 5.580 1.00 0.00 O ATOM 0 H GLU A 7 2.261 3.405 11.540 1.00 0.00 H new ATOM 0 HA GLU A 7 2.756 1.568 9.218 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.511 3.700 8.749 1.00 0.00 H new ATOM 0 HB3 GLU A 7 2.843 4.618 9.425 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.394 3.601 7.718 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.047 2.714 7.033 1.00 0.00 H new ATOM 95 N ASN A 8 5.280 1.825 9.300 1.00 0.00 N ATOM 96 CA ASN A 8 6.750 1.842 9.542 1.00 0.00 C ATOM 97 C ASN A 8 7.482 2.154 8.235 1.00 0.00 C ATOM 98 O ASN A 8 7.241 1.540 7.214 1.00 0.00 O ATOM 99 CB ASN A 8 7.197 0.475 10.063 1.00 0.00 C ATOM 100 CG ASN A 8 8.626 0.575 10.599 1.00 0.00 C ATOM 101 OD1 ASN A 8 8.879 1.274 11.560 1.00 0.00 O ATOM 102 ND2 ASN A 8 9.578 -0.099 10.014 1.00 0.00 N ATOM 0 H ASN A 8 4.972 1.228 8.532 1.00 0.00 H new ATOM 0 HA ASN A 8 6.986 2.608 10.281 1.00 0.00 H new ATOM 0 HB2 ASN A 8 6.525 0.137 10.851 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.148 -0.264 9.264 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.534 -0.039 10.364 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.366 -0.686 9.207 1.00 0.00 H new ATOM 109 N GLU A 9 8.377 3.103 8.260 1.00 0.00 N ATOM 110 CA GLU A 9 9.129 3.453 7.022 1.00 0.00 C ATOM 111 C GLU A 9 10.526 2.833 7.085 1.00 0.00 C ATOM 112 O GLU A 9 11.269 3.049 8.022 1.00 0.00 O ATOM 113 CB GLU A 9 9.251 4.974 6.910 1.00 0.00 C ATOM 114 CG GLU A 9 7.855 5.602 6.922 1.00 0.00 C ATOM 115 CD GLU A 9 7.978 7.119 6.770 1.00 0.00 C ATOM 116 OE1 GLU A 9 9.086 7.618 6.874 1.00 0.00 O ATOM 117 OE2 GLU A 9 6.960 7.757 6.551 1.00 0.00 O ATOM 0 H GLU A 9 8.620 3.652 9.085 1.00 0.00 H new ATOM 0 HA GLU A 9 8.597 3.068 6.152 1.00 0.00 H new ATOM 0 HB2 GLU A 9 9.843 5.364 7.738 1.00 0.00 H new ATOM 0 HB3 GLU A 9 9.773 5.241 5.991 1.00 0.00 H new ATOM 0 HG2 GLU A 9 7.253 5.192 6.111 1.00 0.00 H new ATOM 0 HG3 GLU A 9 7.343 5.359 7.853 1.00 0.00 H new ATOM 124 N PHE A 10 10.889 2.062 6.098 1.00 0.00 N ATOM 125 CA PHE A 10 12.237 1.430 6.107 1.00 0.00 C ATOM 126 C PHE A 10 12.866 1.547 4.717 1.00 0.00 C ATOM 127 O PHE A 10 12.278 1.166 3.725 1.00 0.00 O ATOM 128 CB PHE A 10 12.104 -0.047 6.484 1.00 0.00 C ATOM 129 CG PHE A 10 13.437 -0.736 6.311 1.00 0.00 C ATOM 130 CD1 PHE A 10 13.779 -1.296 5.075 1.00 0.00 C ATOM 131 CD2 PHE A 10 14.329 -0.815 7.386 1.00 0.00 C ATOM 132 CE1 PHE A 10 15.014 -1.935 4.913 1.00 0.00 C ATOM 133 CE2 PHE A 10 15.565 -1.453 7.225 1.00 0.00 C ATOM 134 CZ PHE A 10 15.907 -2.014 5.988 1.00 0.00 C ATOM 0 H PHE A 10 10.311 1.843 5.287 1.00 0.00 H new ATOM 0 HA PHE A 10 12.871 1.936 6.835 1.00 0.00 H new ATOM 0 HB2 PHE A 10 11.766 -0.140 7.516 1.00 0.00 H new ATOM 0 HB3 PHE A 10 11.351 -0.526 5.858 1.00 0.00 H new ATOM 0 HD1 PHE A 10 13.090 -1.235 4.246 1.00 0.00 H new ATOM 0 HD2 PHE A 10 14.064 -0.384 8.340 1.00 0.00 H new ATOM 0 HE1 PHE A 10 15.278 -2.367 3.959 1.00 0.00 H new ATOM 0 HE2 PHE A 10 16.254 -1.512 8.054 1.00 0.00 H new ATOM 0 HZ PHE A 10 16.860 -2.507 5.864 1.00 0.00 H new ATOM 144 N THR A 11 14.059 2.069 4.638 1.00 0.00 N ATOM 145 CA THR A 11 14.725 2.207 3.313 1.00 0.00 C ATOM 146 C THR A 11 15.544 0.946 3.025 1.00 0.00 C ATOM 147 O THR A 11 15.958 0.247 3.929 1.00 0.00 O ATOM 148 CB THR A 11 15.653 3.425 3.331 1.00 0.00 C ATOM 149 OG1 THR A 11 16.829 3.111 4.064 1.00 0.00 O ATOM 150 CG2 THR A 11 14.938 4.604 3.993 1.00 0.00 C ATOM 0 H THR A 11 14.601 2.406 5.434 1.00 0.00 H new ATOM 0 HA THR A 11 13.971 2.339 2.537 1.00 0.00 H new ATOM 0 HB THR A 11 15.921 3.693 2.309 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.425 3.889 4.075 1.00 0.00 H new ATOM 0 HG21 THR A 11 15.599 5.470 4.005 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.036 4.844 3.431 1.00 0.00 H new ATOM 0 HG23 THR A 11 14.669 4.339 5.015 1.00 0.00 H new ATOM 158 N SER A 12 15.776 0.645 1.777 1.00 0.00 N ATOM 159 CA SER A 12 16.563 -0.575 1.444 1.00 0.00 C ATOM 160 C SER A 12 17.335 -0.353 0.142 1.00 0.00 C ATOM 161 O SER A 12 17.099 0.595 -0.580 1.00 0.00 O ATOM 162 CB SER A 12 15.614 -1.763 1.276 1.00 0.00 C ATOM 163 OG SER A 12 14.782 -1.547 0.145 1.00 0.00 O ATOM 0 H SER A 12 15.456 1.189 0.976 1.00 0.00 H new ATOM 0 HA SER A 12 17.267 -0.780 2.250 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.185 -2.683 1.151 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.005 -1.885 2.171 1.00 0.00 H new ATOM 0 HG SER A 12 15.132 -2.051 -0.619 1.00 0.00 H new ATOM 169 N ASP A 13 18.257 -1.226 -0.163 1.00 0.00 N ATOM 170 CA ASP A 13 19.046 -1.075 -1.418 1.00 0.00 C ATOM 171 C ASP A 13 18.198 -1.524 -2.610 1.00 0.00 C ATOM 172 O ASP A 13 17.034 -1.843 -2.468 1.00 0.00 O ATOM 173 CB ASP A 13 20.307 -1.937 -1.334 1.00 0.00 C ATOM 174 CG ASP A 13 21.336 -1.250 -0.434 1.00 0.00 C ATOM 175 OD1 ASP A 13 21.109 -0.106 -0.075 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.333 -1.879 -0.119 1.00 0.00 O ATOM 0 H ASP A 13 18.498 -2.039 0.404 1.00 0.00 H new ATOM 0 HA ASP A 13 19.329 -0.030 -1.547 1.00 0.00 H new ATOM 0 HB2 ASP A 13 20.061 -2.922 -0.937 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.723 -2.089 -2.330 1.00 0.00 H new ATOM 181 N ILE A 14 18.770 -1.547 -3.783 1.00 0.00 N ATOM 182 CA ILE A 14 17.996 -1.973 -4.984 1.00 0.00 C ATOM 183 C ILE A 14 16.848 -0.990 -5.225 1.00 0.00 C ATOM 184 O ILE A 14 16.241 -0.494 -4.298 1.00 0.00 O ATOM 185 CB ILE A 14 17.428 -3.377 -4.757 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.578 -4.372 -4.586 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.578 -3.781 -5.963 1.00 0.00 C ATOM 188 CD1 ILE A 14 18.248 -5.343 -3.450 1.00 0.00 C ATOM 0 H ILE A 14 19.741 -1.289 -3.962 1.00 0.00 H new ATOM 0 HA ILE A 14 18.653 -1.985 -5.853 1.00 0.00 H new ATOM 0 HB ILE A 14 16.811 -3.380 -3.859 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.738 -4.922 -5.513 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.504 -3.840 -4.367 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.172 -4.780 -5.804 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.759 -3.072 -6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.196 -3.779 -6.861 1.00 0.00 H new ATOM 0 HD11 ILE A 14 19.067 -6.052 -3.328 1.00 0.00 H new ATOM 0 HD12 ILE A 14 18.109 -4.786 -2.524 1.00 0.00 H new ATOM 0 HD13 ILE A 14 17.332 -5.884 -3.688 1.00 0.00 H new ATOM 200 N PRO A 15 16.552 -0.702 -6.502 1.00 0.00 N ATOM 201 CA PRO A 15 15.480 0.229 -6.873 1.00 0.00 C ATOM 202 C PRO A 15 14.088 -0.348 -6.583 1.00 0.00 C ATOM 203 O PRO A 15 13.864 -1.540 -6.663 1.00 0.00 O ATOM 204 CB PRO A 15 15.675 0.421 -8.377 1.00 0.00 C ATOM 205 CG PRO A 15 16.377 -0.813 -8.829 1.00 0.00 C ATOM 206 CD PRO A 15 17.240 -1.257 -7.681 1.00 0.00 C ATOM 0 HA PRO A 15 15.532 1.157 -6.304 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.720 0.542 -8.888 1.00 0.00 H new ATOM 0 HB3 PRO A 15 16.265 1.312 -8.589 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.661 -1.589 -9.100 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.981 -0.614 -9.714 1.00 0.00 H new ATOM 0 HD2 PRO A 15 17.312 -2.343 -7.630 1.00 0.00 H new ATOM 0 HD3 PRO A 15 18.256 -0.874 -7.771 1.00 0.00 H new ATOM 214 N ALA A 16 13.158 0.499 -6.236 1.00 0.00 N ATOM 215 CA ALA A 16 11.775 0.035 -5.924 1.00 0.00 C ATOM 216 C ALA A 16 11.311 -1.049 -6.909 1.00 0.00 C ATOM 217 O ALA A 16 10.816 -2.082 -6.503 1.00 0.00 O ATOM 218 CB ALA A 16 10.818 1.226 -6.001 1.00 0.00 C ATOM 0 H ALA A 16 13.299 1.506 -6.154 1.00 0.00 H new ATOM 0 HA ALA A 16 11.776 -0.393 -4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.805 0.894 -5.774 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.122 1.984 -5.279 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.845 1.650 -7.005 1.00 0.00 H new ATOM 224 N PRO A 17 11.442 -0.808 -8.226 1.00 0.00 N ATOM 225 CA PRO A 17 11.000 -1.770 -9.250 1.00 0.00 C ATOM 226 C PRO A 17 11.779 -3.090 -9.209 1.00 0.00 C ATOM 227 O PRO A 17 11.198 -4.156 -9.191 1.00 0.00 O ATOM 228 CB PRO A 17 11.257 -1.034 -10.567 1.00 0.00 C ATOM 229 CG PRO A 17 12.323 -0.047 -10.235 1.00 0.00 C ATOM 230 CD PRO A 17 12.031 0.402 -8.834 1.00 0.00 C ATOM 0 HA PRO A 17 9.960 -2.061 -9.102 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.580 -1.720 -11.350 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.356 -0.539 -10.929 1.00 0.00 H new ATOM 0 HG2 PRO A 17 13.312 -0.500 -10.304 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.308 0.794 -10.928 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.934 0.719 -8.313 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.339 1.244 -8.814 1.00 0.00 H new ATOM 238 N LYS A 18 13.082 -3.039 -9.196 1.00 0.00 N ATOM 239 CA LYS A 18 13.866 -4.308 -9.160 1.00 0.00 C ATOM 240 C LYS A 18 13.545 -5.074 -7.874 1.00 0.00 C ATOM 241 O LYS A 18 13.473 -6.287 -7.866 1.00 0.00 O ATOM 242 CB LYS A 18 15.363 -3.994 -9.211 1.00 0.00 C ATOM 243 CG LYS A 18 15.706 -3.378 -10.570 1.00 0.00 C ATOM 244 CD LYS A 18 17.219 -3.171 -10.675 1.00 0.00 C ATOM 245 CE LYS A 18 17.546 -2.480 -12.001 1.00 0.00 C ATOM 246 NZ LYS A 18 18.880 -2.933 -12.485 1.00 0.00 N ATOM 0 H LYS A 18 13.635 -2.182 -9.209 1.00 0.00 H new ATOM 0 HA LYS A 18 13.598 -4.919 -10.022 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.629 -3.305 -8.409 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.942 -4.904 -9.055 1.00 0.00 H new ATOM 0 HG2 LYS A 18 15.362 -4.030 -11.373 1.00 0.00 H new ATOM 0 HG3 LYS A 18 15.190 -2.425 -10.689 1.00 0.00 H new ATOM 0 HD2 LYS A 18 17.573 -2.567 -9.840 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.734 -4.130 -10.615 1.00 0.00 H new ATOM 0 HE2 LYS A 18 16.781 -2.712 -12.742 1.00 0.00 H new ATOM 0 HE3 LYS A 18 17.544 -1.398 -11.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 19.101 -2.463 -13.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 19.606 -2.690 -11.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 18.866 -3.963 -12.627 1.00 0.00 H new ATOM 260 N LEU A 19 13.353 -4.380 -6.786 1.00 0.00 N ATOM 261 CA LEU A 19 13.040 -5.072 -5.503 1.00 0.00 C ATOM 262 C LEU A 19 11.550 -5.428 -5.450 1.00 0.00 C ATOM 263 O LEU A 19 11.146 -6.342 -4.760 1.00 0.00 O ATOM 264 CB LEU A 19 13.383 -4.153 -4.330 1.00 0.00 C ATOM 265 CG LEU A 19 13.148 -4.897 -3.013 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.894 -6.233 -3.044 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.664 -4.051 -1.847 1.00 0.00 C ATOM 0 H LEU A 19 13.399 -3.363 -6.730 1.00 0.00 H new ATOM 0 HA LEU A 19 13.630 -5.986 -5.438 1.00 0.00 H new ATOM 0 HB2 LEU A 19 14.422 -3.831 -4.398 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.768 -3.254 -4.367 1.00 0.00 H new ATOM 0 HG LEU A 19 12.081 -5.078 -2.884 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.728 -6.764 -2.107 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.525 -6.836 -3.874 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.961 -6.051 -3.174 1.00 0.00 H new ATOM 0 HD21 LEU A 19 13.496 -4.582 -0.910 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.731 -3.868 -1.974 1.00 0.00 H new ATOM 0 HD23 LEU A 19 13.133 -3.099 -1.825 1.00 0.00 H new ATOM 279 N PHE A 20 10.729 -4.709 -6.167 1.00 0.00 N ATOM 280 CA PHE A 20 9.265 -5.000 -6.147 1.00 0.00 C ATOM 281 C PHE A 20 8.980 -6.289 -6.924 1.00 0.00 C ATOM 282 O PHE A 20 8.094 -7.047 -6.582 1.00 0.00 O ATOM 283 CB PHE A 20 8.510 -3.837 -6.794 1.00 0.00 C ATOM 284 CG PHE A 20 7.032 -4.151 -6.843 1.00 0.00 C ATOM 285 CD1 PHE A 20 6.204 -3.793 -5.772 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.490 -4.795 -7.963 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.834 -4.080 -5.820 1.00 0.00 C ATOM 288 CE2 PHE A 20 5.119 -5.081 -8.010 1.00 0.00 C ATOM 289 CZ PHE A 20 4.292 -4.724 -6.939 1.00 0.00 C ATOM 0 H PHE A 20 11.008 -3.932 -6.766 1.00 0.00 H new ATOM 0 HA PHE A 20 8.936 -5.124 -5.115 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.678 -2.922 -6.227 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.888 -3.662 -7.801 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.622 -3.296 -4.909 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.128 -5.071 -8.789 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.195 -3.805 -4.994 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.700 -5.577 -8.873 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.236 -4.945 -6.976 1.00 0.00 H new ATOM 299 N LYS A 21 9.719 -6.542 -7.969 1.00 0.00 N ATOM 300 CA LYS A 21 9.481 -7.778 -8.767 1.00 0.00 C ATOM 301 C LYS A 21 9.842 -9.009 -7.934 1.00 0.00 C ATOM 302 O LYS A 21 9.107 -9.975 -7.892 1.00 0.00 O ATOM 303 CB LYS A 21 10.343 -7.742 -10.031 1.00 0.00 C ATOM 304 CG LYS A 21 9.911 -6.562 -10.903 1.00 0.00 C ATOM 305 CD LYS A 21 10.750 -6.538 -12.183 1.00 0.00 C ATOM 306 CE LYS A 21 10.398 -5.293 -12.999 1.00 0.00 C ATOM 307 NZ LYS A 21 11.605 -4.429 -13.133 1.00 0.00 N ATOM 0 H LYS A 21 10.477 -5.947 -8.305 1.00 0.00 H new ATOM 0 HA LYS A 21 8.429 -7.831 -9.046 1.00 0.00 H new ATOM 0 HB2 LYS A 21 11.396 -7.646 -9.765 1.00 0.00 H new ATOM 0 HB3 LYS A 21 10.238 -8.676 -10.584 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.853 -6.648 -11.151 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.036 -5.627 -10.356 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.811 -6.535 -11.935 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.562 -7.436 -12.771 1.00 0.00 H new ATOM 0 HE2 LYS A 21 10.033 -5.582 -13.985 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.595 -4.741 -12.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 11.366 -3.582 -13.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.934 -4.143 -12.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.359 -4.958 -13.616 1.00 0.00 H new ATOM 321 N ALA A 22 10.966 -8.986 -7.273 1.00 0.00 N ATOM 322 CA ALA A 22 11.367 -10.162 -6.447 1.00 0.00 C ATOM 323 C ALA A 22 10.612 -10.137 -5.117 1.00 0.00 C ATOM 324 O ALA A 22 10.364 -11.163 -4.515 1.00 0.00 O ATOM 325 CB ALA A 22 12.873 -10.107 -6.182 1.00 0.00 C ATOM 0 H ALA A 22 11.624 -8.206 -7.268 1.00 0.00 H new ATOM 0 HA ALA A 22 11.125 -11.080 -6.981 1.00 0.00 H new ATOM 0 HB1 ALA A 22 13.168 -10.965 -5.579 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.410 -10.128 -7.130 1.00 0.00 H new ATOM 0 HB3 ALA A 22 13.115 -9.188 -5.648 1.00 0.00 H new ATOM 331 N PHE A 23 10.245 -8.975 -4.652 1.00 0.00 N ATOM 332 CA PHE A 23 9.507 -8.888 -3.360 1.00 0.00 C ATOM 333 C PHE A 23 8.050 -9.302 -3.577 1.00 0.00 C ATOM 334 O PHE A 23 7.327 -9.579 -2.641 1.00 0.00 O ATOM 335 CB PHE A 23 9.554 -7.450 -2.841 1.00 0.00 C ATOM 336 CG PHE A 23 8.784 -7.355 -1.545 1.00 0.00 C ATOM 337 CD1 PHE A 23 7.409 -7.089 -1.565 1.00 0.00 C ATOM 338 CD2 PHE A 23 9.444 -7.533 -0.323 1.00 0.00 C ATOM 339 CE1 PHE A 23 6.695 -7.000 -0.365 1.00 0.00 C ATOM 340 CE2 PHE A 23 8.730 -7.445 0.877 1.00 0.00 C ATOM 341 CZ PHE A 23 7.356 -7.178 0.858 1.00 0.00 C ATOM 0 H PHE A 23 10.424 -8.082 -5.111 1.00 0.00 H new ATOM 0 HA PHE A 23 9.971 -9.553 -2.632 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.588 -7.142 -2.685 1.00 0.00 H new ATOM 0 HB3 PHE A 23 9.128 -6.772 -3.580 1.00 0.00 H new ATOM 0 HD1 PHE A 23 6.899 -6.952 -2.507 1.00 0.00 H new ATOM 0 HD2 PHE A 23 10.504 -7.738 -0.307 1.00 0.00 H new ATOM 0 HE1 PHE A 23 5.635 -6.794 -0.381 1.00 0.00 H new ATOM 0 HE2 PHE A 23 9.240 -7.583 1.819 1.00 0.00 H new ATOM 0 HZ PHE A 23 6.806 -7.109 1.785 1.00 0.00 H new ATOM 351 N VAL A 24 7.612 -9.343 -4.806 1.00 0.00 N ATOM 352 CA VAL A 24 6.202 -9.736 -5.079 1.00 0.00 C ATOM 353 C VAL A 24 6.177 -10.988 -5.958 1.00 0.00 C ATOM 354 O VAL A 24 5.551 -11.975 -5.630 1.00 0.00 O ATOM 355 CB VAL A 24 5.487 -8.592 -5.799 1.00 0.00 C ATOM 356 CG1 VAL A 24 4.013 -8.952 -5.995 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.595 -7.316 -4.959 1.00 0.00 C ATOM 0 H VAL A 24 8.169 -9.122 -5.631 1.00 0.00 H new ATOM 0 HA VAL A 24 5.696 -9.948 -4.137 1.00 0.00 H new ATOM 0 HB VAL A 24 5.951 -8.428 -6.772 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.504 -8.136 -6.508 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.937 -9.860 -6.593 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.546 -9.117 -5.024 1.00 0.00 H new ATOM 0 HG21 VAL A 24 5.086 -6.499 -5.471 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.131 -7.480 -3.986 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.645 -7.059 -4.821 1.00 0.00 H new ATOM 367 N LEU A 25 6.851 -10.954 -7.076 1.00 0.00 N ATOM 368 CA LEU A 25 6.861 -12.145 -7.974 1.00 0.00 C ATOM 369 C LEU A 25 7.620 -13.289 -7.298 1.00 0.00 C ATOM 370 O LEU A 25 7.224 -14.435 -7.369 1.00 0.00 O ATOM 371 CB LEU A 25 7.548 -11.787 -9.293 1.00 0.00 C ATOM 372 CG LEU A 25 6.897 -10.535 -9.887 1.00 0.00 C ATOM 373 CD1 LEU A 25 7.515 -10.240 -11.255 1.00 0.00 C ATOM 374 CD2 LEU A 25 5.393 -10.769 -10.048 1.00 0.00 C ATOM 0 H LEU A 25 7.394 -10.156 -7.406 1.00 0.00 H new ATOM 0 HA LEU A 25 5.835 -12.456 -8.172 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.611 -11.612 -9.126 1.00 0.00 H new ATOM 0 HB3 LEU A 25 7.468 -12.618 -9.994 1.00 0.00 H new ATOM 0 HG LEU A 25 7.064 -9.688 -9.221 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.052 -9.349 -11.679 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.586 -10.074 -11.142 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.347 -11.087 -11.920 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.929 -9.878 -10.471 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.226 -11.616 -10.714 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.951 -10.980 -9.074 1.00 0.00 H new ATOM 386 N ASP A 26 8.708 -12.988 -6.642 1.00 0.00 N ATOM 387 CA ASP A 26 9.487 -14.061 -5.962 1.00 0.00 C ATOM 388 C ASP A 26 9.163 -14.056 -4.467 1.00 0.00 C ATOM 389 O ASP A 26 9.820 -14.702 -3.679 1.00 0.00 O ATOM 390 CB ASP A 26 10.983 -13.813 -6.163 1.00 0.00 C ATOM 391 CG ASP A 26 11.321 -13.905 -7.652 1.00 0.00 C ATOM 392 OD1 ASP A 26 10.495 -14.406 -8.397 1.00 0.00 O ATOM 393 OD2 ASP A 26 12.401 -13.473 -8.022 1.00 0.00 O ATOM 0 H ASP A 26 9.090 -12.047 -6.548 1.00 0.00 H new ATOM 0 HA ASP A 26 9.221 -15.029 -6.388 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.254 -12.830 -5.778 1.00 0.00 H new ATOM 0 HB3 ASP A 26 11.562 -14.546 -5.602 1.00 0.00 H new ATOM 398 N ALA A 27 8.154 -13.329 -4.072 1.00 0.00 N ATOM 399 CA ALA A 27 7.788 -13.281 -2.629 1.00 0.00 C ATOM 400 C ALA A 27 7.198 -14.628 -2.203 1.00 0.00 C ATOM 401 O ALA A 27 7.340 -15.049 -1.072 1.00 0.00 O ATOM 402 CB ALA A 27 6.752 -12.178 -2.402 1.00 0.00 C ATOM 0 H ALA A 27 7.567 -12.766 -4.687 1.00 0.00 H new ATOM 0 HA ALA A 27 8.679 -13.072 -2.037 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.484 -12.142 -1.346 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.171 -11.218 -2.702 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.862 -12.387 -2.996 1.00 0.00 H new ATOM 408 N ASP A 28 6.532 -15.305 -3.097 1.00 0.00 N ATOM 409 CA ASP A 28 5.928 -16.621 -2.741 1.00 0.00 C ATOM 410 C ASP A 28 7.034 -17.651 -2.502 1.00 0.00 C ATOM 411 O ASP A 28 6.832 -18.650 -1.840 1.00 0.00 O ATOM 412 CB ASP A 28 5.029 -17.094 -3.884 1.00 0.00 C ATOM 413 CG ASP A 28 3.772 -16.223 -3.938 1.00 0.00 C ATOM 414 OD1 ASP A 28 3.541 -15.493 -2.988 1.00 0.00 O ATOM 415 OD2 ASP A 28 3.063 -16.301 -4.928 1.00 0.00 O ATOM 0 H ASP A 28 6.379 -15.004 -4.060 1.00 0.00 H new ATOM 0 HA ASP A 28 5.337 -16.512 -1.832 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.566 -17.036 -4.831 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.755 -18.139 -3.737 1.00 0.00 H new ATOM 420 N ASN A 29 8.203 -17.421 -3.035 1.00 0.00 N ATOM 421 CA ASN A 29 9.318 -18.390 -2.835 1.00 0.00 C ATOM 422 C ASN A 29 10.422 -17.733 -2.008 1.00 0.00 C ATOM 423 O ASN A 29 11.042 -18.358 -1.171 1.00 0.00 O ATOM 424 CB ASN A 29 9.880 -18.807 -4.195 1.00 0.00 C ATOM 425 CG ASN A 29 8.811 -19.571 -4.978 1.00 0.00 C ATOM 426 OD1 ASN A 29 8.566 -19.284 -6.133 1.00 0.00 O ATOM 427 ND2 ASN A 29 8.158 -20.539 -4.394 1.00 0.00 N ATOM 0 H ASN A 29 8.434 -16.604 -3.600 1.00 0.00 H new ATOM 0 HA ASN A 29 8.945 -19.269 -2.310 1.00 0.00 H new ATOM 0 HB2 ASN A 29 10.196 -17.927 -4.755 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.762 -19.432 -4.059 1.00 0.00 H new ATOM 0 HD21 ASN A 29 7.443 -21.054 -4.907 1.00 0.00 H new ATOM 0 HD22 ASN A 29 8.363 -20.780 -3.424 1.00 0.00 H new ATOM 434 N LEU A 30 10.671 -16.473 -2.235 1.00 0.00 N ATOM 435 CA LEU A 30 11.733 -15.768 -1.465 1.00 0.00 C ATOM 436 C LEU A 30 11.420 -15.850 0.030 1.00 0.00 C ATOM 437 O LEU A 30 12.303 -15.982 0.852 1.00 0.00 O ATOM 438 CB LEU A 30 11.786 -14.301 -1.896 1.00 0.00 C ATOM 439 CG LEU A 30 12.951 -13.604 -1.191 1.00 0.00 C ATOM 440 CD1 LEU A 30 14.274 -14.102 -1.776 1.00 0.00 C ATOM 441 CD2 LEU A 30 12.840 -12.092 -1.397 1.00 0.00 C ATOM 0 H LEU A 30 10.183 -15.900 -2.923 1.00 0.00 H new ATOM 0 HA LEU A 30 12.696 -16.239 -1.660 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.908 -14.233 -2.977 1.00 0.00 H new ATOM 0 HB3 LEU A 30 10.848 -13.804 -1.649 1.00 0.00 H new ATOM 0 HG LEU A 30 12.918 -13.830 -0.125 1.00 0.00 H new ATOM 0 HD11 LEU A 30 15.104 -13.605 -1.274 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.354 -15.179 -1.630 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.308 -13.877 -2.842 1.00 0.00 H new ATOM 0 HD21 LEU A 30 13.670 -11.595 -0.895 1.00 0.00 H new ATOM 0 HD22 LEU A 30 12.873 -11.867 -2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.898 -11.736 -0.980 1.00 0.00 H new ATOM 453 N ILE A 31 10.167 -15.772 0.390 1.00 0.00 N ATOM 454 CA ILE A 31 9.805 -15.845 1.832 1.00 0.00 C ATOM 455 C ILE A 31 10.371 -17.139 2.429 1.00 0.00 C ATOM 456 O ILE A 31 11.176 -17.108 3.337 1.00 0.00 O ATOM 457 CB ILE A 31 8.278 -15.812 1.978 1.00 0.00 C ATOM 458 CG1 ILE A 31 7.782 -14.375 1.797 1.00 0.00 C ATOM 459 CG2 ILE A 31 7.876 -16.314 3.367 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.366 -14.392 1.221 1.00 0.00 C ATOM 0 H ILE A 31 9.382 -15.661 -0.251 1.00 0.00 H new ATOM 0 HA ILE A 31 10.227 -14.993 2.365 1.00 0.00 H new ATOM 0 HB ILE A 31 7.832 -16.456 1.220 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.790 -13.853 2.754 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.450 -13.830 1.131 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.791 -16.288 3.463 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.227 -17.337 3.500 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.323 -15.675 4.128 1.00 0.00 H new ATOM 0 HD11 ILE A 31 6.013 -13.369 1.092 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.372 -14.898 0.256 1.00 0.00 H new ATOM 0 HD13 ILE A 31 5.702 -14.922 1.904 1.00 0.00 H new ATOM 472 N PRO A 32 9.947 -18.300 1.900 1.00 0.00 N ATOM 473 CA PRO A 32 10.422 -19.607 2.377 1.00 0.00 C ATOM 474 C PRO A 32 11.899 -19.830 2.033 1.00 0.00 C ATOM 475 O PRO A 32 12.524 -20.755 2.513 1.00 0.00 O ATOM 476 CB PRO A 32 9.554 -20.604 1.608 1.00 0.00 C ATOM 477 CG PRO A 32 9.142 -19.866 0.381 1.00 0.00 C ATOM 478 CD PRO A 32 8.973 -18.435 0.802 1.00 0.00 C ATOM 0 HA PRO A 32 10.347 -19.701 3.460 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.111 -21.508 1.360 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.689 -20.914 2.195 1.00 0.00 H new ATOM 0 HG2 PRO A 32 9.895 -19.957 -0.402 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.213 -20.267 -0.023 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.186 -17.745 -0.015 1.00 0.00 H new ATOM 0 HD3 PRO A 32 7.956 -18.229 1.136 1.00 0.00 H new ATOM 486 N LYS A 33 12.456 -18.992 1.203 1.00 0.00 N ATOM 487 CA LYS A 33 13.889 -19.158 0.825 1.00 0.00 C ATOM 488 C LYS A 33 14.781 -18.573 1.923 1.00 0.00 C ATOM 489 O LYS A 33 15.846 -19.084 2.207 1.00 0.00 O ATOM 490 CB LYS A 33 14.157 -18.427 -0.492 1.00 0.00 C ATOM 491 CG LYS A 33 13.796 -19.340 -1.666 1.00 0.00 C ATOM 492 CD LYS A 33 14.212 -18.671 -2.977 1.00 0.00 C ATOM 493 CE LYS A 33 13.493 -19.347 -4.147 1.00 0.00 C ATOM 494 NZ LYS A 33 14.495 -19.769 -5.167 1.00 0.00 N ATOM 0 H LYS A 33 11.982 -18.200 0.770 1.00 0.00 H new ATOM 0 HA LYS A 33 14.111 -20.218 0.705 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.570 -17.510 -0.537 1.00 0.00 H new ATOM 0 HB3 LYS A 33 15.206 -18.137 -0.552 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.298 -20.302 -1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 33 12.724 -19.538 -1.670 1.00 0.00 H new ATOM 0 HD2 LYS A 33 13.966 -17.609 -2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.292 -18.745 -3.108 1.00 0.00 H new ATOM 0 HE2 LYS A 33 12.932 -20.212 -3.793 1.00 0.00 H new ATOM 0 HE3 LYS A 33 12.773 -18.660 -4.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 14.008 -20.229 -5.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 15.011 -18.935 -5.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 15.166 -20.438 -4.739 1.00 0.00 H new ATOM 508 N ILE A 34 14.357 -17.505 2.540 1.00 0.00 N ATOM 509 CA ILE A 34 15.185 -16.892 3.617 1.00 0.00 C ATOM 510 C ILE A 34 15.119 -17.765 4.872 1.00 0.00 C ATOM 511 O ILE A 34 16.057 -17.834 5.641 1.00 0.00 O ATOM 512 CB ILE A 34 14.652 -15.494 3.939 1.00 0.00 C ATOM 513 CG1 ILE A 34 14.750 -14.611 2.694 1.00 0.00 C ATOM 514 CG2 ILE A 34 15.485 -14.879 5.066 1.00 0.00 C ATOM 515 CD1 ILE A 34 14.088 -13.260 2.974 1.00 0.00 C ATOM 0 H ILE A 34 13.475 -17.031 2.346 1.00 0.00 H new ATOM 0 HA ILE A 34 16.219 -16.817 3.281 1.00 0.00 H new ATOM 0 HB ILE A 34 13.611 -15.566 4.253 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.795 -14.466 2.419 1.00 0.00 H new ATOM 0 HG13 ILE A 34 14.263 -15.099 1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.106 -13.883 5.296 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.416 -15.508 5.954 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.526 -14.808 4.752 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.157 -12.630 2.087 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.039 -13.414 3.228 1.00 0.00 H new ATOM 0 HD13 ILE A 34 14.595 -12.772 3.806 1.00 0.00 H new ATOM 527 N ALA A 35 14.018 -18.432 5.086 1.00 0.00 N ATOM 528 CA ALA A 35 13.895 -19.299 6.291 1.00 0.00 C ATOM 529 C ALA A 35 13.229 -20.619 5.902 1.00 0.00 C ATOM 530 O ALA A 35 12.112 -20.899 6.293 1.00 0.00 O ATOM 531 CB ALA A 35 13.043 -18.588 7.344 1.00 0.00 C ATOM 0 H ALA A 35 13.199 -18.414 4.479 1.00 0.00 H new ATOM 0 HA ALA A 35 14.886 -19.499 6.699 1.00 0.00 H new ATOM 0 HB1 ALA A 35 12.952 -19.221 8.227 1.00 0.00 H new ATOM 0 HB2 ALA A 35 13.517 -17.646 7.620 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.052 -18.389 6.936 1.00 0.00 H new ATOM 537 N PRO A 36 13.933 -21.448 5.117 1.00 0.00 N ATOM 538 CA PRO A 36 13.416 -22.746 4.670 1.00 0.00 C ATOM 539 C PRO A 36 13.331 -23.746 5.825 1.00 0.00 C ATOM 540 O PRO A 36 12.474 -24.606 5.853 1.00 0.00 O ATOM 541 CB PRO A 36 14.452 -23.212 3.648 1.00 0.00 C ATOM 542 CG PRO A 36 15.708 -22.509 4.039 1.00 0.00 C ATOM 543 CD PRO A 36 15.289 -21.182 4.605 1.00 0.00 C ATOM 0 HA PRO A 36 12.407 -22.670 4.265 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.578 -24.294 3.676 1.00 0.00 H new ATOM 0 HB3 PRO A 36 14.152 -22.953 2.633 1.00 0.00 H new ATOM 0 HG2 PRO A 36 16.264 -23.088 4.776 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.363 -22.375 3.178 1.00 0.00 H new ATOM 0 HD2 PRO A 36 15.961 -20.852 5.397 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.286 -20.402 3.844 1.00 0.00 H new ATOM 551 N GLN A 37 14.214 -23.637 6.780 1.00 0.00 N ATOM 552 CA GLN A 37 14.184 -24.578 7.933 1.00 0.00 C ATOM 553 C GLN A 37 12.988 -24.245 8.829 1.00 0.00 C ATOM 554 O GLN A 37 12.433 -25.103 9.485 1.00 0.00 O ATOM 555 CB GLN A 37 15.480 -24.442 8.735 1.00 0.00 C ATOM 556 CG GLN A 37 16.646 -24.995 7.913 1.00 0.00 C ATOM 557 CD GLN A 37 17.941 -24.881 8.719 1.00 0.00 C ATOM 558 OE1 GLN A 37 18.007 -24.144 9.683 1.00 0.00 O ATOM 559 NE2 GLN A 37 18.980 -25.584 8.363 1.00 0.00 N ATOM 0 H GLN A 37 14.955 -22.936 6.811 1.00 0.00 H new ATOM 0 HA GLN A 37 14.090 -25.601 7.568 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.659 -23.396 8.983 1.00 0.00 H new ATOM 0 HB3 GLN A 37 15.396 -24.983 9.677 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.459 -26.037 7.652 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.738 -24.444 6.977 1.00 0.00 H new ATOM 0 HE21 GLN A 37 18.924 -26.203 7.554 1.00 0.00 H new ATOM 0 HE22 GLN A 37 19.848 -25.515 8.894 1.00 0.00 H new ATOM 568 N ALA A 38 12.586 -23.002 8.858 1.00 0.00 N ATOM 569 CA ALA A 38 11.426 -22.616 9.708 1.00 0.00 C ATOM 570 C ALA A 38 10.132 -23.108 9.056 1.00 0.00 C ATOM 571 O ALA A 38 9.246 -23.613 9.716 1.00 0.00 O ATOM 572 CB ALA A 38 11.380 -21.091 9.843 1.00 0.00 C ATOM 0 H ALA A 38 13.011 -22.240 8.330 1.00 0.00 H new ATOM 0 HA ALA A 38 11.531 -23.067 10.695 1.00 0.00 H new ATOM 0 HB1 ALA A 38 10.531 -20.806 10.465 1.00 0.00 H new ATOM 0 HB2 ALA A 38 12.303 -20.739 10.304 1.00 0.00 H new ATOM 0 HB3 ALA A 38 11.273 -20.641 8.856 1.00 0.00 H new ATOM 578 N VAL A 39 10.017 -22.966 7.764 1.00 0.00 N ATOM 579 CA VAL A 39 8.783 -23.427 7.071 1.00 0.00 C ATOM 580 C VAL A 39 9.167 -24.323 5.893 1.00 0.00 C ATOM 581 O VAL A 39 10.208 -24.160 5.290 1.00 0.00 O ATOM 582 CB VAL A 39 8.004 -22.215 6.555 1.00 0.00 C ATOM 583 CG1 VAL A 39 8.919 -21.356 5.681 1.00 0.00 C ATOM 584 CG2 VAL A 39 6.808 -22.690 5.727 1.00 0.00 C ATOM 0 H VAL A 39 10.725 -22.550 7.159 1.00 0.00 H new ATOM 0 HA VAL A 39 8.162 -23.988 7.769 1.00 0.00 H new ATOM 0 HB VAL A 39 7.649 -21.626 7.400 1.00 0.00 H new ATOM 0 HG11 VAL A 39 8.365 -20.492 5.313 1.00 0.00 H new ATOM 0 HG12 VAL A 39 9.771 -21.016 6.270 1.00 0.00 H new ATOM 0 HG13 VAL A 39 9.274 -21.946 4.836 1.00 0.00 H new ATOM 0 HG21 VAL A 39 6.254 -21.826 5.360 1.00 0.00 H new ATOM 0 HG22 VAL A 39 7.162 -23.280 4.882 1.00 0.00 H new ATOM 0 HG23 VAL A 39 6.155 -23.302 6.349 1.00 0.00 H new ATOM 594 N LYS A 40 8.334 -25.272 5.562 1.00 0.00 N ATOM 595 CA LYS A 40 8.654 -26.178 4.423 1.00 0.00 C ATOM 596 C LYS A 40 8.515 -25.415 3.106 1.00 0.00 C ATOM 597 O LYS A 40 9.405 -25.415 2.279 1.00 0.00 O ATOM 598 CB LYS A 40 7.683 -27.358 4.423 1.00 0.00 C ATOM 599 CG LYS A 40 7.914 -28.214 5.668 1.00 0.00 C ATOM 600 CD LYS A 40 6.928 -29.382 5.661 1.00 0.00 C ATOM 601 CE LYS A 40 7.571 -30.589 4.977 1.00 0.00 C ATOM 602 NZ LYS A 40 8.783 -31.004 5.737 1.00 0.00 N ATOM 0 H LYS A 40 7.447 -25.459 6.030 1.00 0.00 H new ATOM 0 HA LYS A 40 9.676 -26.542 4.529 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.655 -26.996 4.404 1.00 0.00 H new ATOM 0 HB3 LYS A 40 7.826 -27.959 3.525 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.938 -28.586 5.684 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.779 -27.613 6.568 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.644 -29.638 6.682 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.015 -29.098 5.138 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.860 -31.414 4.927 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.840 -30.338 3.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 8.916 -32.031 5.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 9.617 -30.512 5.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 8.664 -30.759 6.741 1.00 0.00 H new ATOM 616 N CYS A 41 7.400 -24.770 2.901 1.00 0.00 N ATOM 617 CA CYS A 41 7.200 -24.015 1.634 1.00 0.00 C ATOM 618 C CYS A 41 5.849 -23.297 1.680 1.00 0.00 C ATOM 619 O CYS A 41 4.886 -23.802 2.220 1.00 0.00 O ATOM 620 CB CYS A 41 7.221 -24.992 0.458 1.00 0.00 C ATOM 621 SG CYS A 41 8.663 -24.654 -0.582 1.00 0.00 S ATOM 0 H CYS A 41 6.619 -24.734 3.556 1.00 0.00 H new ATOM 0 HA CYS A 41 7.996 -23.281 1.512 1.00 0.00 H new ATOM 0 HB2 CYS A 41 7.256 -26.018 0.824 1.00 0.00 H new ATOM 0 HB3 CYS A 41 6.306 -24.893 -0.127 1.00 0.00 H new ATOM 0 HG CYS A 41 9.748 -24.805 0.118 1.00 0.00 H new ATOM 627 N ALA A 42 5.771 -22.123 1.117 1.00 0.00 N ATOM 628 CA ALA A 42 4.481 -21.377 1.130 1.00 0.00 C ATOM 629 C ALA A 42 3.694 -21.691 -0.143 1.00 0.00 C ATOM 630 O ALA A 42 4.151 -21.448 -1.243 1.00 0.00 O ATOM 631 CB ALA A 42 4.762 -19.875 1.200 1.00 0.00 C ATOM 0 H ALA A 42 6.543 -21.648 0.649 1.00 0.00 H new ATOM 0 HA ALA A 42 3.897 -21.679 1.999 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.819 -19.328 1.210 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.320 -19.651 2.109 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.347 -19.573 0.331 1.00 0.00 H new ATOM 637 N GLU A 43 2.513 -22.231 -0.006 1.00 0.00 N ATOM 638 CA GLU A 43 1.698 -22.560 -1.209 1.00 0.00 C ATOM 639 C GLU A 43 0.458 -21.664 -1.245 1.00 0.00 C ATOM 640 O GLU A 43 0.016 -21.160 -0.232 1.00 0.00 O ATOM 641 CB GLU A 43 1.266 -24.026 -1.147 1.00 0.00 C ATOM 642 CG GLU A 43 2.504 -24.919 -1.039 1.00 0.00 C ATOM 643 CD GLU A 43 2.071 -26.385 -0.985 1.00 0.00 C ATOM 644 OE1 GLU A 43 0.885 -26.628 -0.836 1.00 0.00 O ATOM 645 OE2 GLU A 43 2.934 -27.241 -1.095 1.00 0.00 O ATOM 0 H GLU A 43 2.078 -22.458 0.888 1.00 0.00 H new ATOM 0 HA GLU A 43 2.293 -22.394 -2.107 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.612 -24.188 -0.290 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.694 -24.286 -2.038 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.161 -24.754 -1.893 1.00 0.00 H new ATOM 0 HG3 GLU A 43 3.073 -24.663 -0.145 1.00 0.00 H new ATOM 652 N ILE A 44 -0.105 -21.460 -2.405 1.00 0.00 N ATOM 653 CA ILE A 44 -1.316 -20.596 -2.503 1.00 0.00 C ATOM 654 C ILE A 44 -2.547 -21.469 -2.753 1.00 0.00 C ATOM 655 O ILE A 44 -2.536 -22.351 -3.587 1.00 0.00 O ATOM 656 CB ILE A 44 -1.148 -19.610 -3.659 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.210 -18.914 -3.548 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.259 -18.562 -3.600 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.227 -18.026 -2.304 1.00 0.00 C ATOM 0 H ILE A 44 0.221 -21.854 -3.288 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.444 -20.045 -1.571 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.203 -20.150 -4.604 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.007 -19.655 -3.490 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.397 -18.314 -4.439 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.140 -17.859 -4.424 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.228 -19.054 -3.680 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.202 -18.025 -2.653 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.194 -17.530 -2.224 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.560 -17.276 -2.382 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.059 -18.638 -1.418 1.00 0.00 H new ATOM 671 N LEU A 45 -3.610 -21.226 -2.037 1.00 0.00 N ATOM 672 CA LEU A 45 -4.841 -22.039 -2.234 1.00 0.00 C ATOM 673 C LEU A 45 -5.586 -21.546 -3.477 1.00 0.00 C ATOM 674 O LEU A 45 -6.140 -22.322 -4.228 1.00 0.00 O ATOM 675 CB LEU A 45 -5.747 -21.898 -1.008 1.00 0.00 C ATOM 676 CG LEU A 45 -6.971 -22.800 -1.170 1.00 0.00 C ATOM 677 CD1 LEU A 45 -6.572 -24.254 -0.912 1.00 0.00 C ATOM 678 CD2 LEU A 45 -8.049 -22.381 -0.169 1.00 0.00 C ATOM 0 H LEU A 45 -3.679 -20.500 -1.324 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.567 -23.086 -2.366 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.200 -22.169 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.060 -20.860 -0.892 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.360 -22.705 -2.184 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -7.445 -24.897 -1.028 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.804 -24.553 -1.626 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.182 -24.350 0.101 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -8.922 -23.024 -0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -7.660 -22.475 0.845 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.334 -21.345 -0.354 1.00 0.00 H new ATOM 690 N GLU A 46 -5.602 -20.259 -3.699 1.00 0.00 N ATOM 691 CA GLU A 46 -6.313 -19.718 -4.894 1.00 0.00 C ATOM 692 C GLU A 46 -5.773 -18.324 -5.223 1.00 0.00 C ATOM 693 O GLU A 46 -5.621 -17.487 -4.356 1.00 0.00 O ATOM 694 CB GLU A 46 -7.811 -19.626 -4.598 1.00 0.00 C ATOM 695 CG GLU A 46 -8.418 -21.031 -4.592 1.00 0.00 C ATOM 696 CD GLU A 46 -8.030 -21.760 -5.879 1.00 0.00 C ATOM 697 OE1 GLU A 46 -7.783 -21.087 -6.866 1.00 0.00 O ATOM 698 OE2 GLU A 46 -7.984 -22.979 -5.855 1.00 0.00 O ATOM 0 H GLU A 46 -5.155 -19.560 -3.106 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.150 -20.381 -5.744 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.973 -19.144 -3.634 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.304 -19.009 -5.349 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -8.063 -21.588 -3.725 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.503 -20.969 -4.509 1.00 0.00 H new ATOM 705 N GLY A 47 -5.484 -18.067 -6.470 1.00 0.00 N ATOM 706 CA GLY A 47 -4.956 -16.726 -6.852 1.00 0.00 C ATOM 707 C GLY A 47 -3.452 -16.826 -7.112 1.00 0.00 C ATOM 708 O GLY A 47 -2.913 -16.155 -7.970 1.00 0.00 O ATOM 0 H GLY A 47 -5.591 -18.727 -7.240 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.467 -16.363 -7.744 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -5.152 -16.006 -6.057 1.00 0.00 H new ATOM 712 N ASP A 48 -2.771 -17.661 -6.377 1.00 0.00 N ATOM 713 CA ASP A 48 -1.302 -17.810 -6.575 1.00 0.00 C ATOM 714 C ASP A 48 -0.632 -16.433 -6.543 1.00 0.00 C ATOM 715 O ASP A 48 0.044 -16.039 -7.472 1.00 0.00 O ATOM 716 CB ASP A 48 -1.031 -18.476 -7.924 1.00 0.00 C ATOM 717 CG ASP A 48 -1.987 -19.656 -8.111 1.00 0.00 C ATOM 718 OD1 ASP A 48 -2.444 -20.187 -7.111 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.246 -20.009 -9.250 1.00 0.00 O ATOM 0 H ASP A 48 -3.170 -18.249 -5.645 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.894 -18.428 -5.775 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.164 -17.755 -8.731 1.00 0.00 H new ATOM 0 HB3 ASP A 48 0.002 -18.820 -7.971 1.00 0.00 H new ATOM 724 N GLY A 49 -0.810 -15.702 -5.476 1.00 0.00 N ATOM 725 CA GLY A 49 -0.178 -14.355 -5.382 1.00 0.00 C ATOM 726 C GLY A 49 -1.011 -13.337 -6.165 1.00 0.00 C ATOM 727 O GLY A 49 -0.484 -12.429 -6.776 1.00 0.00 O ATOM 0 H GLY A 49 -1.365 -15.979 -4.666 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.102 -14.051 -4.338 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.837 -14.391 -5.778 1.00 0.00 H new ATOM 731 N GLY A 50 -2.308 -13.478 -6.148 1.00 0.00 N ATOM 732 CA GLY A 50 -3.171 -12.514 -6.888 1.00 0.00 C ATOM 733 C GLY A 50 -4.078 -11.781 -5.897 1.00 0.00 C ATOM 734 O GLY A 50 -3.897 -11.866 -4.699 1.00 0.00 O ATOM 0 H GLY A 50 -2.807 -14.218 -5.654 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.554 -11.798 -7.431 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.773 -13.041 -7.628 1.00 0.00 H new ATOM 738 N PRO A 51 -5.076 -11.048 -6.414 1.00 0.00 N ATOM 739 CA PRO A 51 -6.021 -10.297 -5.578 1.00 0.00 C ATOM 740 C PRO A 51 -6.945 -11.234 -4.797 1.00 0.00 C ATOM 741 O PRO A 51 -7.487 -12.177 -5.337 1.00 0.00 O ATOM 742 CB PRO A 51 -6.827 -9.483 -6.591 1.00 0.00 C ATOM 743 CG PRO A 51 -6.723 -10.258 -7.860 1.00 0.00 C ATOM 744 CD PRO A 51 -5.363 -10.895 -7.851 1.00 0.00 C ATOM 0 HA PRO A 51 -5.516 -9.684 -4.831 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -7.865 -9.374 -6.277 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.421 -8.478 -6.705 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.506 -11.013 -7.920 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.842 -9.606 -8.725 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.364 -11.855 -8.366 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.621 -10.268 -8.346 1.00 0.00 H new ATOM 752 N GLY A 52 -7.122 -10.991 -3.527 1.00 0.00 N ATOM 753 CA GLY A 52 -8.003 -11.878 -2.718 1.00 0.00 C ATOM 754 C GLY A 52 -7.428 -13.295 -2.736 1.00 0.00 C ATOM 755 O GLY A 52 -8.120 -14.263 -2.492 1.00 0.00 O ATOM 0 H GLY A 52 -6.695 -10.218 -3.016 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.070 -11.511 -1.694 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.015 -11.876 -3.124 1.00 0.00 H new ATOM 759 N THR A 53 -6.163 -13.421 -3.031 1.00 0.00 N ATOM 760 CA THR A 53 -5.530 -14.769 -3.074 1.00 0.00 C ATOM 761 C THR A 53 -5.348 -15.300 -1.651 1.00 0.00 C ATOM 762 O THR A 53 -5.112 -14.552 -0.723 1.00 0.00 O ATOM 763 CB THR A 53 -4.164 -14.665 -3.758 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.346 -14.312 -5.122 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.441 -16.008 -3.670 1.00 0.00 C ATOM 0 H THR A 53 -5.538 -12.644 -3.245 1.00 0.00 H new ATOM 0 HA THR A 53 -6.170 -15.452 -3.633 1.00 0.00 H new ATOM 0 HB THR A 53 -3.566 -13.902 -3.260 1.00 0.00 H new ATOM 0 HG1 THR A 53 -5.303 -14.218 -5.311 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.469 -15.931 -4.158 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.301 -16.278 -2.623 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.036 -16.775 -4.166 1.00 0.00 H new ATOM 773 N ILE A 54 -5.454 -16.589 -1.474 1.00 0.00 N ATOM 774 CA ILE A 54 -5.284 -17.172 -0.113 1.00 0.00 C ATOM 775 C ILE A 54 -3.933 -17.885 -0.036 1.00 0.00 C ATOM 776 O ILE A 54 -3.548 -18.605 -0.935 1.00 0.00 O ATOM 777 CB ILE A 54 -6.407 -18.175 0.156 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.760 -17.505 -0.090 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.328 -18.651 1.608 1.00 0.00 C ATOM 780 CD1 ILE A 54 -7.800 -16.156 0.631 1.00 0.00 C ATOM 0 H ILE A 54 -5.651 -17.263 -2.213 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.322 -16.378 0.633 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.299 -19.029 -0.512 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.918 -17.363 -1.159 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -8.566 -18.145 0.269 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.128 -19.366 1.801 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.364 -19.129 1.782 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.435 -17.797 2.277 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.764 -15.678 0.456 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -7.661 -16.311 1.701 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -7.004 -15.516 0.251 1.00 0.00 H new ATOM 792 N LYS A 55 -3.208 -17.691 1.032 1.00 0.00 N ATOM 793 CA LYS A 55 -1.882 -18.358 1.161 1.00 0.00 C ATOM 794 C LYS A 55 -1.909 -19.334 2.338 1.00 0.00 C ATOM 795 O LYS A 55 -2.515 -19.076 3.359 1.00 0.00 O ATOM 796 CB LYS A 55 -0.801 -17.303 1.402 1.00 0.00 C ATOM 797 CG LYS A 55 -0.855 -16.251 0.294 1.00 0.00 C ATOM 798 CD LYS A 55 0.369 -15.340 0.400 1.00 0.00 C ATOM 799 CE LYS A 55 0.373 -14.351 -0.767 1.00 0.00 C ATOM 800 NZ LYS A 55 1.778 -14.093 -1.193 1.00 0.00 N ATOM 0 H LYS A 55 -3.476 -17.100 1.819 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.663 -18.903 0.243 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.950 -16.831 2.373 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.182 -17.773 1.423 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.878 -16.736 -0.682 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.769 -15.663 0.380 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.353 -14.801 1.347 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.281 -15.936 0.388 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.203 -14.753 -1.600 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.105 -13.418 -0.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.839 -13.155 -1.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.404 -14.123 -0.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.073 -14.820 -1.875 1.00 0.00 H new ATOM 814 N LYS A 56 -1.249 -20.452 2.206 1.00 0.00 N ATOM 815 CA LYS A 56 -1.227 -21.444 3.317 1.00 0.00 C ATOM 816 C LYS A 56 0.221 -21.848 3.600 1.00 0.00 C ATOM 817 O LYS A 56 0.964 -22.193 2.702 1.00 0.00 O ATOM 818 CB LYS A 56 -2.033 -22.682 2.914 1.00 0.00 C ATOM 819 CG LYS A 56 -2.194 -23.602 4.125 1.00 0.00 C ATOM 820 CD LYS A 56 -2.979 -24.850 3.717 1.00 0.00 C ATOM 821 CE LYS A 56 -3.221 -25.725 4.948 1.00 0.00 C ATOM 822 NZ LYS A 56 -1.912 -26.164 5.509 1.00 0.00 N ATOM 0 H LYS A 56 -0.723 -20.721 1.375 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.667 -21.003 4.211 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -3.012 -22.385 2.537 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.527 -23.211 2.106 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.215 -23.885 4.512 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.714 -23.078 4.927 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.930 -24.564 3.268 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.426 -25.410 2.963 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.782 -25.169 5.699 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.823 -26.593 4.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.059 -26.981 6.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.274 -26.433 4.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -1.488 -25.385 6.051 1.00 0.00 H new ATOM 836 N ILE A 57 0.632 -21.802 4.836 1.00 0.00 N ATOM 837 CA ILE A 57 2.035 -22.179 5.165 1.00 0.00 C ATOM 838 C ILE A 57 2.043 -23.265 6.241 1.00 0.00 C ATOM 839 O ILE A 57 1.395 -23.148 7.262 1.00 0.00 O ATOM 840 CB ILE A 57 2.784 -20.948 5.682 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.681 -19.818 4.657 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.256 -21.302 5.903 1.00 0.00 C ATOM 843 CD1 ILE A 57 3.033 -18.490 5.330 1.00 0.00 C ATOM 0 H ILE A 57 0.059 -21.520 5.631 1.00 0.00 H new ATOM 0 HA ILE A 57 2.524 -22.558 4.268 1.00 0.00 H new ATOM 0 HB ILE A 57 2.342 -20.625 6.624 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.357 -20.006 3.822 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.672 -19.775 4.247 1.00 0.00 H new ATOM 0 HG21 ILE A 57 4.790 -20.426 6.271 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.331 -22.106 6.635 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.698 -21.626 4.961 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.960 -17.682 4.602 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.340 -18.303 6.150 1.00 0.00 H new ATOM 0 HD13 ILE A 57 4.050 -18.538 5.719 1.00 0.00 H new ATOM 855 N THR A 58 2.780 -24.320 6.021 1.00 0.00 N ATOM 856 CA THR A 58 2.839 -25.413 7.031 1.00 0.00 C ATOM 857 C THR A 58 4.241 -25.456 7.642 1.00 0.00 C ATOM 858 O THR A 58 5.232 -25.500 6.941 1.00 0.00 O ATOM 859 CB THR A 58 2.535 -26.751 6.353 1.00 0.00 C ATOM 860 OG1 THR A 58 1.274 -26.674 5.701 1.00 0.00 O ATOM 861 CG2 THR A 58 2.502 -27.862 7.403 1.00 0.00 C ATOM 0 H THR A 58 3.344 -24.471 5.185 1.00 0.00 H new ATOM 0 HA THR A 58 2.103 -25.230 7.814 1.00 0.00 H new ATOM 0 HB THR A 58 3.311 -26.971 5.620 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.078 -27.530 5.265 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.285 -28.814 6.919 1.00 0.00 H new ATOM 0 HG22 THR A 58 3.470 -27.920 7.902 1.00 0.00 H new ATOM 0 HG23 THR A 58 1.727 -27.645 8.138 1.00 0.00 H new ATOM 869 N PHE A 59 4.335 -25.437 8.944 1.00 0.00 N ATOM 870 CA PHE A 59 5.675 -25.470 9.594 1.00 0.00 C ATOM 871 C PHE A 59 5.951 -26.873 10.138 1.00 0.00 C ATOM 872 O PHE A 59 5.123 -27.466 10.802 1.00 0.00 O ATOM 873 CB PHE A 59 5.709 -24.462 10.743 1.00 0.00 C ATOM 874 CG PHE A 59 5.344 -23.092 10.224 1.00 0.00 C ATOM 875 CD1 PHE A 59 6.331 -22.265 9.677 1.00 0.00 C ATOM 876 CD2 PHE A 59 4.016 -22.650 10.288 1.00 0.00 C ATOM 877 CE1 PHE A 59 5.993 -20.995 9.195 1.00 0.00 C ATOM 878 CE2 PHE A 59 3.678 -21.379 9.806 1.00 0.00 C ATOM 879 CZ PHE A 59 4.666 -20.552 9.260 1.00 0.00 C ATOM 0 H PHE A 59 3.542 -25.400 9.585 1.00 0.00 H new ATOM 0 HA PHE A 59 6.438 -25.212 8.860 1.00 0.00 H new ATOM 0 HB2 PHE A 59 5.013 -24.763 11.525 1.00 0.00 H new ATOM 0 HB3 PHE A 59 6.702 -24.440 11.192 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.354 -22.607 9.627 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.254 -23.289 10.709 1.00 0.00 H new ATOM 0 HE1 PHE A 59 6.755 -20.357 8.773 1.00 0.00 H new ATOM 0 HE2 PHE A 59 2.655 -21.037 9.856 1.00 0.00 H new ATOM 0 HZ PHE A 59 4.405 -19.572 8.889 1.00 0.00 H new ATOM 974 N TYR A 67 0.216 -24.093 11.380 1.00 0.00 N ATOM 975 CA TYR A 67 0.289 -23.538 9.999 1.00 0.00 C ATOM 976 C TYR A 67 -0.322 -22.134 9.979 1.00 0.00 C ATOM 977 O TYR A 67 -1.283 -21.854 10.665 1.00 0.00 O ATOM 978 CB TYR A 67 -0.483 -24.448 9.040 1.00 0.00 C ATOM 979 CG TYR A 67 -1.960 -24.360 9.338 1.00 0.00 C ATOM 980 CD1 TYR A 67 -2.749 -23.402 8.691 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.543 -25.239 10.260 1.00 0.00 C ATOM 982 CE1 TYR A 67 -4.120 -23.321 8.966 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.912 -25.158 10.535 1.00 0.00 C ATOM 984 CZ TYR A 67 -4.701 -24.200 9.888 1.00 0.00 C ATOM 985 OH TYR A 67 -6.052 -24.121 10.159 1.00 0.00 O ATOM 0 HA TYR A 67 1.331 -23.483 9.685 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.292 -24.152 8.009 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.141 -25.478 9.145 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -2.300 -22.725 7.979 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.935 -25.979 10.759 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -4.728 -22.581 8.467 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.360 -25.835 11.247 1.00 0.00 H new ATOM 0 HH TYR A 67 -6.351 -23.193 10.062 1.00 0.00 H new ATOM 995 N VAL A 68 0.232 -21.250 9.193 1.00 0.00 N ATOM 996 CA VAL A 68 -0.311 -19.864 9.123 1.00 0.00 C ATOM 997 C VAL A 68 -0.787 -19.580 7.698 1.00 0.00 C ATOM 998 O VAL A 68 -0.172 -19.995 6.735 1.00 0.00 O ATOM 999 CB VAL A 68 0.788 -18.869 9.503 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.225 -17.446 9.465 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.291 -19.180 10.914 1.00 0.00 C ATOM 0 H VAL A 68 1.039 -21.429 8.595 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.148 -19.762 9.814 1.00 0.00 H new ATOM 0 HB VAL A 68 1.613 -18.952 8.796 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.008 -16.738 9.736 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -0.134 -17.224 8.460 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.600 -17.362 10.172 1.00 0.00 H new ATOM 0 HG21 VAL A 68 2.074 -18.472 11.186 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.466 -19.097 11.621 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.692 -20.193 10.942 1.00 0.00 H new ATOM 1011 N LYS A 69 -1.876 -18.879 7.552 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.386 -18.574 6.185 1.00 0.00 C ATOM 1013 C LYS A 69 -2.355 -17.062 5.955 1.00 0.00 C ATOM 1014 O LYS A 69 -2.642 -16.283 6.842 1.00 0.00 O ATOM 1015 CB LYS A 69 -3.823 -19.082 6.053 1.00 0.00 C ATOM 1016 CG LYS A 69 -3.827 -20.611 6.098 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.238 -21.128 5.809 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.262 -22.651 5.948 1.00 0.00 C ATOM 1019 NZ LYS A 69 -6.575 -23.079 6.507 1.00 0.00 N ATOM 0 H LYS A 69 -2.435 -18.504 8.318 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.757 -19.066 5.443 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.437 -18.682 6.859 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.259 -18.734 5.117 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.126 -21.009 5.365 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.495 -20.957 7.077 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -5.950 -20.678 6.500 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.544 -20.839 4.803 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -5.099 -23.118 4.977 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.453 -22.980 6.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.591 -24.115 6.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -6.713 -22.644 7.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -7.339 -22.778 5.869 1.00 0.00 H new ATOM 1033 N HIS A 70 -2.007 -16.639 4.769 1.00 0.00 N ATOM 1034 CA HIS A 70 -1.958 -15.178 4.485 1.00 0.00 C ATOM 1035 C HIS A 70 -2.910 -14.850 3.334 1.00 0.00 C ATOM 1036 O HIS A 70 -3.077 -15.625 2.413 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.533 -14.779 4.097 1.00 0.00 C ATOM 1038 CG HIS A 70 0.393 -15.040 5.252 1.00 0.00 C ATOM 1039 ND1 HIS A 70 1.176 -16.121 5.571 1.00 0.00 N flip ATOM 1040 CD2 HIS A 70 0.599 -14.112 6.260 1.00 0.00 C flip ATOM 1041 CE1 HIS A 70 1.858 -15.871 6.758 1.00 0.00 C flip ATOM 1042 NE2 HIS A 70 1.475 -14.647 7.131 1.00 0.00 N flip ATOM 0 H HIS A 70 -1.755 -17.242 3.986 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.259 -14.626 5.375 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.211 -15.346 3.223 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.501 -13.725 3.823 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.140 -13.137 6.334 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.549 -16.526 7.268 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.806 -14.175 7.973 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.537 -13.706 3.378 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.479 -13.330 2.286 1.00 0.00 C ATOM 1052 C LYS A 71 -4.019 -12.020 1.643 1.00 0.00 C ATOM 1053 O LYS A 71 -3.567 -11.113 2.314 1.00 0.00 O ATOM 1054 CB LYS A 71 -5.884 -13.149 2.863 1.00 0.00 C ATOM 1055 CG LYS A 71 -6.877 -12.915 1.723 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.255 -12.593 2.305 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.282 -12.520 1.174 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.606 -12.983 1.673 1.00 0.00 N ATOM 0 H LYS A 71 -3.438 -13.016 4.123 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.494 -14.118 1.533 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.171 -14.032 3.434 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.900 -12.305 3.552 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.536 -12.094 1.092 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -6.936 -13.800 1.090 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.545 -13.358 3.025 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.222 -11.645 2.842 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -9.359 -11.498 0.804 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -8.961 -13.139 0.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -11.304 -12.933 0.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.527 -13.965 2.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -10.913 -12.375 2.459 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.132 -11.913 0.347 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.703 -10.661 -0.336 1.00 0.00 C ATOM 1074 C ILE A 72 -4.929 -9.787 -0.615 1.00 0.00 C ATOM 1075 O ILE A 72 -5.948 -10.260 -1.078 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.016 -11.010 -1.658 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.847 -11.960 -1.390 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.494 -9.731 -2.314 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.229 -12.396 -2.721 1.00 0.00 C ATOM 0 H ILE A 72 -4.503 -12.638 -0.267 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.007 -10.119 0.304 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.732 -11.493 -2.323 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.097 -11.466 -0.773 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.193 -12.832 -0.834 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.004 -9.979 -3.256 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.327 -9.054 -2.505 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.778 -9.247 -1.649 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.396 -13.073 -2.531 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.982 -12.907 -3.322 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.869 -11.519 -3.259 1.00 0.00 H new ATOM 1091 N HIS A 73 -4.838 -8.516 -0.335 1.00 0.00 N ATOM 1092 CA HIS A 73 -5.999 -7.614 -0.585 1.00 0.00 C ATOM 1093 C HIS A 73 -5.923 -7.068 -2.011 1.00 0.00 C ATOM 1094 O HIS A 73 -6.888 -7.094 -2.749 1.00 0.00 O ATOM 1095 CB HIS A 73 -5.962 -6.451 0.409 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.267 -6.962 1.791 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.541 -7.353 2.170 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -5.472 -7.151 2.894 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.477 -7.756 3.452 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.238 -7.654 3.943 1.00 0.00 N ATOM 0 H HIS A 73 -4.012 -8.063 0.055 1.00 0.00 H new ATOM 0 HA HIS A 73 -6.927 -8.172 -0.459 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -4.981 -5.977 0.394 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -6.688 -5.690 0.122 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.376 -7.338 1.584 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.414 -6.942 2.941 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.324 -8.118 4.016 1.00 0.00 H new ATOM 1108 N SER A 74 -4.782 -6.573 -2.407 1.00 0.00 N ATOM 1109 CA SER A 74 -4.643 -6.026 -3.785 1.00 0.00 C ATOM 1110 C SER A 74 -3.168 -5.748 -4.078 1.00 0.00 C ATOM 1111 O SER A 74 -2.392 -5.460 -3.188 1.00 0.00 O ATOM 1112 CB SER A 74 -5.441 -4.726 -3.902 1.00 0.00 C ATOM 1113 OG SER A 74 -4.815 -3.717 -3.124 1.00 0.00 O ATOM 0 H SER A 74 -3.939 -6.524 -1.834 1.00 0.00 H new ATOM 0 HA SER A 74 -5.025 -6.752 -4.503 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.498 -4.414 -4.945 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.464 -4.882 -3.560 1.00 0.00 H new ATOM 0 HG SER A 74 -5.324 -2.883 -3.199 1.00 0.00 H new ATOM 1119 N ILE A 75 -2.775 -5.831 -5.319 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.350 -5.572 -5.668 1.00 0.00 C ATOM 1121 C ILE A 75 -1.282 -4.556 -6.810 1.00 0.00 C ATOM 1122 O ILE A 75 -2.117 -4.542 -7.691 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.687 -6.879 -6.108 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.268 -7.318 -7.454 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -0.950 -7.963 -5.062 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.605 -8.624 -7.895 1.00 0.00 C ATOM 0 H ILE A 75 -3.379 -6.067 -6.106 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.828 -5.176 -4.797 1.00 0.00 H new ATOM 0 HB ILE A 75 0.387 -6.725 -6.208 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.346 -7.456 -7.369 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.104 -6.543 -8.203 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.478 -8.894 -5.376 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.536 -7.651 -4.103 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.024 -8.118 -4.960 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.019 -8.937 -8.854 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.469 -8.471 -7.996 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.792 -9.397 -7.150 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.292 -3.705 -6.801 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.172 -2.692 -7.887 1.00 0.00 C ATOM 1140 C ASP A 76 1.246 -2.726 -8.463 1.00 0.00 C ATOM 1141 O ASP A 76 2.141 -2.066 -7.974 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.460 -1.301 -7.321 1.00 0.00 C ATOM 1143 CG ASP A 76 -1.934 -1.208 -6.923 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -2.687 -2.089 -7.302 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.285 -0.255 -6.245 1.00 0.00 O ATOM 0 H ASP A 76 0.438 -3.668 -6.089 1.00 0.00 H new ATOM 0 HA ASP A 76 -0.889 -2.919 -8.676 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.174 -1.110 -6.455 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.224 -0.539 -8.063 1.00 0.00 H new ATOM 1150 N LYS A 77 1.457 -3.491 -9.499 1.00 0.00 N ATOM 1151 CA LYS A 77 2.816 -3.568 -10.104 1.00 0.00 C ATOM 1152 C LYS A 77 3.197 -2.199 -10.674 1.00 0.00 C ATOM 1153 O LYS A 77 4.339 -1.789 -10.617 1.00 0.00 O ATOM 1154 CB LYS A 77 2.816 -4.606 -11.228 1.00 0.00 C ATOM 1155 CG LYS A 77 2.500 -5.986 -10.645 1.00 0.00 C ATOM 1156 CD LYS A 77 2.613 -7.042 -11.745 1.00 0.00 C ATOM 1157 CE LYS A 77 2.214 -8.408 -11.181 1.00 0.00 C ATOM 1158 NZ LYS A 77 2.502 -9.466 -12.191 1.00 0.00 N ATOM 0 H LYS A 77 0.747 -4.066 -9.952 1.00 0.00 H new ATOM 0 HA LYS A 77 3.538 -3.859 -9.341 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.077 -4.340 -11.984 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.787 -4.622 -11.724 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.190 -6.216 -9.833 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.496 -5.992 -10.222 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.968 -6.780 -12.584 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.633 -7.078 -12.127 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.764 -8.609 -10.262 1.00 0.00 H new ATOM 0 HE3 LYS A 77 1.154 -8.413 -10.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.231 -10.394 -11.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.958 -9.276 -13.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.518 -9.466 -12.413 1.00 0.00 H new ATOM 1172 N VAL A 78 2.249 -1.488 -11.221 1.00 0.00 N ATOM 1173 CA VAL A 78 2.559 -0.147 -11.792 1.00 0.00 C ATOM 1174 C VAL A 78 2.881 0.828 -10.658 1.00 0.00 C ATOM 1175 O VAL A 78 3.807 1.609 -10.742 1.00 0.00 O ATOM 1176 CB VAL A 78 1.350 0.365 -12.576 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.586 1.820 -12.985 1.00 0.00 C ATOM 1178 CG2 VAL A 78 1.154 -0.493 -13.828 1.00 0.00 C ATOM 0 H VAL A 78 1.274 -1.778 -11.297 1.00 0.00 H new ATOM 0 HA VAL A 78 3.418 -0.226 -12.459 1.00 0.00 H new ATOM 0 HB VAL A 78 0.459 0.304 -11.951 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.724 2.185 -13.544 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.725 2.431 -12.093 1.00 0.00 H new ATOM 0 HG13 VAL A 78 2.477 1.882 -13.610 1.00 0.00 H new ATOM 0 HG21 VAL A 78 0.292 -0.129 -14.387 1.00 0.00 H new ATOM 0 HG22 VAL A 78 2.045 -0.433 -14.453 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.985 -1.530 -13.536 1.00 0.00 H new ATOM 1188 N ASN A 79 2.123 0.787 -9.596 1.00 0.00 N ATOM 1189 CA ASN A 79 2.388 1.711 -8.457 1.00 0.00 C ATOM 1190 C ASN A 79 3.403 1.073 -7.506 1.00 0.00 C ATOM 1191 O ASN A 79 3.683 1.590 -6.443 1.00 0.00 O ATOM 1192 CB ASN A 79 1.082 1.977 -7.704 1.00 0.00 C ATOM 1193 CG ASN A 79 0.050 2.570 -8.666 1.00 0.00 C ATOM 1194 OD1 ASN A 79 0.304 3.572 -9.304 1.00 0.00 O ATOM 1195 ND2 ASN A 79 -1.110 1.990 -8.796 1.00 0.00 N ATOM 0 H ASN A 79 1.333 0.155 -9.468 1.00 0.00 H new ATOM 0 HA ASN A 79 2.788 2.651 -8.837 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.703 1.050 -7.273 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.260 2.664 -6.876 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.805 2.377 -9.434 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.322 1.149 -8.260 1.00 0.00 H new ATOM 1202 N HIS A 80 3.958 -0.049 -7.879 1.00 0.00 N ATOM 1203 CA HIS A 80 4.953 -0.717 -6.994 1.00 0.00 C ATOM 1204 C HIS A 80 4.404 -0.784 -5.568 1.00 0.00 C ATOM 1205 O HIS A 80 5.100 -0.509 -4.611 1.00 0.00 O ATOM 1206 CB HIS A 80 6.258 0.081 -7.003 1.00 0.00 C ATOM 1207 CG HIS A 80 6.776 0.176 -8.412 1.00 0.00 C ATOM 1208 ND1 HIS A 80 6.503 1.261 -9.230 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.551 -0.674 -9.163 1.00 0.00 C ATOM 1210 CE1 HIS A 80 7.103 1.038 -10.413 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.756 -0.127 -10.426 1.00 0.00 N ATOM 0 H HIS A 80 3.765 -0.531 -8.757 1.00 0.00 H new ATOM 0 HA HIS A 80 5.142 -1.727 -7.357 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.090 1.079 -6.598 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.997 -0.402 -6.364 1.00 0.00 H new ATOM 0 HD1 HIS A 80 5.948 2.080 -8.980 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.942 -1.622 -8.825 1.00 0.00 H new ATOM 0 HE1 HIS A 80 7.062 1.718 -11.251 1.00 0.00 H new ATOM 1219 N THR A 81 3.161 -1.152 -5.418 1.00 0.00 N ATOM 1220 CA THR A 81 2.568 -1.240 -4.054 1.00 0.00 C ATOM 1221 C THR A 81 2.003 -2.644 -3.836 1.00 0.00 C ATOM 1222 O THR A 81 1.391 -3.220 -4.714 1.00 0.00 O ATOM 1223 CB THR A 81 1.445 -0.209 -3.918 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.957 1.087 -4.199 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.888 -0.243 -2.493 1.00 0.00 C ATOM 0 H THR A 81 2.530 -1.396 -6.182 1.00 0.00 H new ATOM 0 HA THR A 81 3.337 -1.038 -3.308 1.00 0.00 H new ATOM 0 HB THR A 81 0.647 -0.445 -4.622 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.496 1.055 -5.017 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.088 0.492 -2.397 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.495 -1.237 -2.280 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.683 -0.008 -1.786 1.00 0.00 H new ATOM 1233 N TYR A 82 2.204 -3.200 -2.673 1.00 0.00 N ATOM 1234 CA TYR A 82 1.679 -4.568 -2.401 1.00 0.00 C ATOM 1235 C TYR A 82 1.000 -4.591 -1.031 1.00 0.00 C ATOM 1236 O TYR A 82 1.537 -4.109 -0.053 1.00 0.00 O ATOM 1237 CB TYR A 82 2.836 -5.568 -2.413 1.00 0.00 C ATOM 1238 CG TYR A 82 2.290 -6.975 -2.368 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.946 -7.631 -3.555 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.126 -7.623 -1.137 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.440 -8.936 -3.513 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.621 -8.927 -1.095 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.277 -9.584 -2.283 1.00 0.00 C ATOM 1244 OH TYR A 82 0.780 -10.870 -2.240 1.00 0.00 O ATOM 0 H TYR A 82 2.709 -2.767 -1.900 1.00 0.00 H new ATOM 0 HA TYR A 82 0.955 -4.839 -3.169 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.440 -5.430 -3.310 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.490 -5.393 -1.559 1.00 0.00 H new ATOM 0 HD1 TYR A 82 2.071 -7.131 -4.504 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.389 -7.116 -0.220 1.00 0.00 H new ATOM 0 HE1 TYR A 82 1.176 -9.442 -4.429 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.496 -9.427 -0.146 1.00 0.00 H new ATOM 0 HH TYR A 82 0.980 -11.269 -1.367 1.00 0.00 H new ATOM 1254 N SER A 83 -0.179 -5.144 -0.951 1.00 0.00 N ATOM 1255 CA SER A 83 -0.890 -5.195 0.357 1.00 0.00 C ATOM 1256 C SER A 83 -1.292 -6.639 0.663 1.00 0.00 C ATOM 1257 O SER A 83 -1.704 -7.378 -0.209 1.00 0.00 O ATOM 1258 CB SER A 83 -2.144 -4.320 0.290 1.00 0.00 C ATOM 1259 OG SER A 83 -1.777 -2.995 -0.067 1.00 0.00 O ATOM 0 H SER A 83 -0.680 -5.562 -1.735 1.00 0.00 H new ATOM 0 HA SER A 83 -0.231 -4.827 1.143 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.844 -4.724 -0.441 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.653 -4.321 1.254 1.00 0.00 H new ATOM 0 HG SER A 83 -2.579 -2.434 -0.112 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.177 -7.048 1.897 1.00 0.00 N ATOM 1266 CA TYR A 84 -1.555 -8.444 2.257 1.00 0.00 C ATOM 1267 C TYR A 84 -1.978 -8.497 3.726 1.00 0.00 C ATOM 1268 O TYR A 84 -1.835 -7.538 4.459 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.355 -9.370 2.038 1.00 0.00 C ATOM 1270 CG TYR A 84 0.691 -9.100 3.093 1.00 0.00 C ATOM 1271 CD1 TYR A 84 1.611 -8.059 2.917 1.00 0.00 C ATOM 1272 CD2 TYR A 84 0.740 -9.890 4.248 1.00 0.00 C ATOM 1273 CE1 TYR A 84 2.581 -7.809 3.895 1.00 0.00 C ATOM 1274 CE2 TYR A 84 1.710 -9.640 5.226 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.630 -8.599 5.050 1.00 0.00 C ATOM 1276 OH TYR A 84 3.586 -8.353 6.015 1.00 0.00 O ATOM 0 H TYR A 84 -0.838 -6.476 2.671 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.385 -8.768 1.629 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -0.673 -10.412 2.085 1.00 0.00 H new ATOM 0 HB3 TYR A 84 0.065 -9.209 1.045 1.00 0.00 H new ATOM 0 HD1 TYR A 84 1.572 -7.449 2.027 1.00 0.00 H new ATOM 0 HD2 TYR A 84 0.030 -10.692 4.384 1.00 0.00 H new ATOM 0 HE1 TYR A 84 3.291 -7.007 3.759 1.00 0.00 H new ATOM 0 HE2 TYR A 84 1.749 -10.250 6.116 1.00 0.00 H new ATOM 0 HH TYR A 84 3.153 -8.007 6.824 1.00 0.00 H new ATOM 1286 N SER A 85 -2.500 -9.610 4.162 1.00 0.00 N ATOM 1287 CA SER A 85 -2.933 -9.726 5.583 1.00 0.00 C ATOM 1288 C SER A 85 -2.781 -11.175 6.045 1.00 0.00 C ATOM 1289 O SER A 85 -2.847 -12.098 5.257 1.00 0.00 O ATOM 1290 CB SER A 85 -4.399 -9.301 5.707 1.00 0.00 C ATOM 1291 OG SER A 85 -5.225 -10.258 5.057 1.00 0.00 O ATOM 0 H SER A 85 -2.646 -10.445 3.595 1.00 0.00 H new ATOM 0 HA SER A 85 -2.314 -9.079 6.205 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.677 -9.218 6.758 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.543 -8.317 5.260 1.00 0.00 H new ATOM 0 HG SER A 85 -5.854 -9.798 4.464 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.578 -11.385 7.316 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.423 -12.776 7.826 1.00 0.00 C ATOM 1299 C LEU A 86 -3.798 -13.350 8.167 1.00 0.00 C ATOM 1300 O LEU A 86 -4.568 -12.756 8.895 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.550 -12.766 9.083 1.00 0.00 C ATOM 1302 CG LEU A 86 -0.977 -14.165 9.317 1.00 0.00 C ATOM 1303 CD1 LEU A 86 0.055 -14.112 10.445 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -2.108 -15.120 9.704 1.00 0.00 C ATOM 0 H LEU A 86 -2.513 -10.653 8.024 1.00 0.00 H new ATOM 0 HA LEU A 86 -1.951 -13.392 7.061 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.741 -12.044 8.971 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.139 -12.454 9.945 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.498 -14.519 8.404 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.463 -15.109 10.612 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.861 -13.431 10.169 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.422 -13.758 11.359 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -1.701 -16.117 9.871 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.587 -14.766 10.617 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -2.843 -15.158 8.900 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.115 -14.504 7.647 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.441 -15.116 7.940 1.00 0.00 C ATOM 1318 C ILE A 87 -5.354 -15.923 9.237 1.00 0.00 C ATOM 1319 O ILE A 87 -5.870 -15.526 10.264 1.00 0.00 O ATOM 1320 CB ILE A 87 -5.839 -16.043 6.791 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -5.941 -15.236 5.496 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.193 -16.685 7.098 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -6.216 -16.185 4.326 1.00 0.00 C ATOM 0 H ILE A 87 -3.512 -15.050 7.031 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.188 -14.330 8.049 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.085 -16.822 6.676 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -6.740 -14.499 5.576 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -5.016 -14.686 5.323 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.476 -17.346 6.279 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.122 -17.261 8.021 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.947 -15.906 7.214 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.289 -15.612 3.402 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -5.402 -16.905 4.243 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.153 -16.715 4.499 1.00 0.00 H new ATOM 1335 N GLU A 88 -4.704 -17.054 9.201 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.585 -17.884 10.432 1.00 0.00 C ATOM 1337 C GLU A 88 -3.107 -18.118 10.748 1.00 0.00 C ATOM 1338 O GLU A 88 -2.252 -17.977 9.900 1.00 0.00 O ATOM 1339 CB GLU A 88 -5.279 -19.229 10.210 1.00 0.00 C ATOM 1340 CG GLU A 88 -6.778 -19.001 9.999 1.00 0.00 C ATOM 1341 CD GLU A 88 -7.489 -20.351 9.900 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -6.803 -21.359 9.850 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -8.710 -20.355 9.877 1.00 0.00 O ATOM 0 H GLU A 88 -4.250 -17.439 8.372 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.057 -17.366 11.267 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -4.851 -19.732 9.343 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.117 -19.880 11.069 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.189 -18.421 10.826 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.945 -18.423 9.090 1.00 0.00 H new ATOM 1350 N GLY A 89 -2.803 -18.477 11.965 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.381 -18.720 12.336 1.00 0.00 C ATOM 1352 C GLY A 89 -1.311 -19.176 13.796 1.00 0.00 C ATOM 1353 O GLY A 89 -2.168 -18.862 14.596 1.00 0.00 O ATOM 0 H GLY A 89 -3.478 -18.612 12.718 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.948 -19.479 11.685 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.796 -17.810 12.198 1.00 0.00 H new ATOM 1357 N ASP A 90 -0.295 -19.914 14.147 1.00 0.00 N ATOM 1358 CA ASP A 90 -0.170 -20.391 15.553 1.00 0.00 C ATOM 1359 C ASP A 90 -0.049 -19.189 16.493 1.00 0.00 C ATOM 1360 O ASP A 90 -0.383 -19.265 17.660 1.00 0.00 O ATOM 1361 CB ASP A 90 1.077 -21.266 15.684 1.00 0.00 C ATOM 1362 CG ASP A 90 1.020 -22.394 14.652 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -0.077 -22.791 14.298 1.00 0.00 O ATOM 1364 OD2 ASP A 90 2.075 -22.840 14.232 1.00 0.00 O ATOM 0 H ASP A 90 0.455 -20.208 13.521 1.00 0.00 H new ATOM 0 HA ASP A 90 -1.053 -20.972 15.819 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.974 -20.665 15.532 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.138 -21.682 16.690 1.00 0.00 H new ATOM 1369 N ALA A 91 0.430 -18.082 15.997 1.00 0.00 N ATOM 1370 CA ALA A 91 0.575 -16.880 16.865 1.00 0.00 C ATOM 1371 C ALA A 91 -0.786 -16.201 17.035 1.00 0.00 C ATOM 1372 O ALA A 91 -1.064 -15.592 18.049 1.00 0.00 O ATOM 1373 CB ALA A 91 1.558 -15.903 16.216 1.00 0.00 C ATOM 0 H ALA A 91 0.727 -17.958 15.029 1.00 0.00 H new ATOM 0 HA ALA A 91 0.951 -17.181 17.843 1.00 0.00 H new ATOM 0 HB1 ALA A 91 1.667 -15.022 16.849 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.528 -16.387 16.098 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.181 -15.603 15.238 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.638 -16.301 16.051 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.981 -15.661 16.162 1.00 0.00 C ATOM 1381 C LEU A 92 -3.820 -16.447 17.163 1.00 0.00 C ATOM 1382 O LEU A 92 -4.655 -15.906 17.861 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.674 -15.682 14.797 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.644 -15.439 13.690 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -3.368 -15.135 12.376 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -1.757 -14.253 14.067 1.00 0.00 C ATOM 0 H LEU A 92 -1.463 -16.797 15.177 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.870 -14.629 16.495 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -4.167 -16.642 14.644 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.449 -14.916 14.760 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.027 -16.330 13.569 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.635 -14.962 11.588 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.000 -15.981 12.105 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.986 -14.245 12.498 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -1.024 -14.081 13.278 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -2.373 -13.362 14.190 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -1.240 -14.468 15.002 1.00 0.00 H new ATOM 1398 N SER A 93 -3.595 -17.725 17.236 1.00 0.00 N ATOM 1399 CA SER A 93 -4.369 -18.571 18.187 1.00 0.00 C ATOM 1400 C SER A 93 -5.864 -18.296 18.016 1.00 0.00 C ATOM 1401 O SER A 93 -6.277 -17.598 17.111 1.00 0.00 O ATOM 1402 CB SER A 93 -3.951 -18.241 19.622 1.00 0.00 C ATOM 1403 OG SER A 93 -2.681 -18.815 19.890 1.00 0.00 O ATOM 0 H SER A 93 -2.905 -18.225 16.676 1.00 0.00 H new ATOM 0 HA SER A 93 -4.167 -19.622 17.982 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.910 -17.161 19.761 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.691 -18.625 20.325 1.00 0.00 H new ATOM 0 HG SER A 93 -2.157 -18.850 19.063 1.00 0.00 H new ATOM 1409 N GLU A 94 -6.679 -18.839 18.879 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.146 -18.608 18.764 1.00 0.00 C ATOM 1411 C GLU A 94 -8.527 -17.354 19.553 1.00 0.00 C ATOM 1412 O GLU A 94 -9.685 -17.114 19.834 1.00 0.00 O ATOM 1413 CB GLU A 94 -8.897 -19.814 19.330 1.00 0.00 C ATOM 1414 CG GLU A 94 -8.550 -21.061 18.513 1.00 0.00 C ATOM 1415 CD GLU A 94 -9.376 -22.246 19.018 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -10.050 -22.088 20.022 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -9.321 -23.291 18.391 1.00 0.00 O ATOM 0 H GLU A 94 -6.392 -19.432 19.658 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.412 -18.473 17.716 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.629 -19.965 20.376 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.972 -19.634 19.300 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.754 -20.885 17.457 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.486 -21.282 18.600 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.563 -16.551 19.915 1.00 0.00 N ATOM 1425 CA ASN A 95 -7.875 -15.316 20.687 1.00 0.00 C ATOM 1426 C ASN A 95 -7.492 -14.085 19.863 1.00 0.00 C ATOM 1427 O ASN A 95 -7.934 -12.986 20.132 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.082 -15.318 21.995 1.00 0.00 C ATOM 1429 CG ASN A 95 -7.413 -16.582 22.791 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -8.564 -16.947 22.923 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -6.444 -17.268 23.333 1.00 0.00 N ATOM 0 H ASN A 95 -6.575 -16.697 19.709 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.942 -15.288 20.907 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -6.013 -15.277 21.785 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.325 -14.432 22.581 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -6.653 -18.111 23.868 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.478 -16.961 23.222 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.672 -14.259 18.862 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.265 -13.095 18.026 1.00 0.00 C ATOM 1440 C ILE A 96 -6.912 -13.209 16.645 1.00 0.00 C ATOM 1441 O ILE A 96 -7.025 -14.282 16.086 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.742 -13.080 17.879 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -4.093 -13.209 19.258 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.305 -11.763 17.232 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.572 -13.122 19.118 1.00 0.00 C ATOM 0 H ILE A 96 -6.268 -15.154 18.588 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.591 -12.171 18.504 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.431 -13.915 17.252 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.454 -12.419 19.916 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.373 -14.158 19.716 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.220 -11.752 17.127 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.766 -11.670 16.249 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.618 -10.928 17.859 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.110 -13.214 20.101 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.219 -13.928 18.475 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.301 -12.162 18.678 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.340 -12.108 16.090 1.00 0.00 N ATOM 1458 CA GLU A 97 -7.982 -12.149 14.746 1.00 0.00 C ATOM 1459 C GLU A 97 -6.918 -11.958 13.664 1.00 0.00 C ATOM 1460 O GLU A 97 -5.746 -11.809 13.950 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.021 -11.031 14.642 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.107 -11.238 15.699 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.209 -10.195 15.505 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -11.029 -9.320 14.673 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -12.214 -10.289 16.189 1.00 0.00 O ATOM 0 H GLU A 97 -7.273 -11.181 16.510 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.471 -13.114 14.608 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.542 -10.062 14.783 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.465 -11.025 13.647 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.523 -12.242 15.617 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -9.679 -11.150 16.698 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.315 -11.964 12.420 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.326 -11.787 11.319 1.00 0.00 C ATOM 1474 C LYS A 98 -5.580 -10.464 11.504 1.00 0.00 C ATOM 1475 O LYS A 98 -5.869 -9.695 12.400 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.059 -11.767 9.975 1.00 0.00 C ATOM 1477 CG LYS A 98 -7.829 -13.076 9.791 1.00 0.00 C ATOM 1478 CD LYS A 98 -8.468 -13.100 8.401 1.00 0.00 C ATOM 1479 CE LYS A 98 -9.299 -14.374 8.241 1.00 0.00 C ATOM 1480 NZ LYS A 98 -10.733 -14.068 8.506 1.00 0.00 N ATOM 0 H LYS A 98 -8.282 -12.084 12.119 1.00 0.00 H new ATOM 0 HA LYS A 98 -5.614 -12.612 11.339 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -7.745 -10.921 9.936 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.345 -11.636 9.162 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.156 -13.926 9.909 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -8.598 -13.169 10.558 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.100 -12.222 8.265 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -7.695 -13.059 7.633 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -9.181 -14.774 7.234 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -8.946 -15.140 8.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.299 -14.934 8.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.837 -13.706 9.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.065 -13.350 7.831 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.622 -10.195 10.659 1.00 0.00 N ATOM 1495 CA ILE A 99 -3.854 -8.925 10.777 1.00 0.00 C ATOM 1496 C ILE A 99 -3.744 -8.272 9.398 1.00 0.00 C ATOM 1497 O ILE A 99 -3.425 -8.919 8.420 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.452 -9.221 11.314 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.561 -9.922 12.671 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.682 -7.910 11.479 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.226 -10.590 13.007 1.00 0.00 C ATOM 0 H ILE A 99 -4.338 -10.802 9.890 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.368 -8.251 11.462 1.00 0.00 H new ATOM 0 HB ILE A 99 -1.924 -9.867 10.613 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.824 -9.201 13.445 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.356 -10.667 12.645 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.683 -8.120 11.862 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.603 -7.410 10.513 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.210 -7.264 12.180 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.302 -11.089 13.973 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -0.982 -11.323 12.238 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.442 -9.834 13.050 1.00 0.00 H new ATOM 1513 N ASP A 100 -4.006 -6.997 9.310 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.917 -6.310 7.991 1.00 0.00 C ATOM 1515 C ASP A 100 -2.483 -5.831 7.759 1.00 0.00 C ATOM 1516 O ASP A 100 -1.941 -5.064 8.531 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.866 -5.109 7.977 1.00 0.00 C ATOM 1518 CG ASP A 100 -6.309 -5.598 8.106 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -6.525 -6.790 7.964 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -7.174 -4.771 8.347 1.00 0.00 O ATOM 0 H ASP A 100 -4.277 -6.402 10.093 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.198 -7.005 7.200 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -4.625 -4.432 8.797 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.743 -4.546 7.052 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.864 -6.276 6.699 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.467 -5.844 6.417 1.00 0.00 C ATOM 1527 C TYR A 101 -0.443 -5.012 5.134 1.00 0.00 C ATOM 1528 O TYR A 101 -1.175 -5.272 4.200 1.00 0.00 O ATOM 1529 CB TYR A 101 0.423 -7.077 6.243 1.00 0.00 C ATOM 1530 CG TYR A 101 0.677 -7.710 7.590 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.672 -7.194 8.430 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.081 -8.813 8.001 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.909 -7.781 9.678 1.00 0.00 C ATOM 1534 CE2 TYR A 101 0.155 -9.400 9.249 1.00 0.00 C ATOM 1535 CZ TYR A 101 1.150 -8.884 10.088 1.00 0.00 C ATOM 1536 OH TYR A 101 1.383 -9.462 11.320 1.00 0.00 O ATOM 0 H TYR A 101 -2.266 -6.920 6.017 1.00 0.00 H new ATOM 0 HA TYR A 101 -0.096 -5.244 7.248 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -0.057 -7.794 5.577 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.368 -6.794 5.779 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.257 -6.343 8.114 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -0.849 -9.211 7.354 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.677 -7.383 10.325 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.430 -10.251 9.565 1.00 0.00 H new ATOM 0 HH TYR A 101 1.708 -8.781 11.945 1.00 0.00 H new ATOM 1546 N GLU A 102 0.393 -4.011 5.081 1.00 0.00 N ATOM 1547 CA GLU A 102 0.462 -3.163 3.857 1.00 0.00 C ATOM 1548 C GLU A 102 1.926 -2.967 3.455 1.00 0.00 C ATOM 1549 O GLU A 102 2.787 -2.768 4.289 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.176 -1.803 4.144 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.641 -2.000 4.538 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.340 -0.640 4.602 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.651 0.362 4.506 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.552 -0.625 4.746 1.00 0.00 O ATOM 0 H GLU A 102 1.030 -3.744 5.831 1.00 0.00 H new ATOM 0 HA GLU A 102 -0.075 -3.652 3.044 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.363 -1.299 4.946 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.108 -1.164 3.263 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.140 -2.643 3.813 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.705 -2.499 5.505 1.00 0.00 H new ATOM 1561 N THR A 103 2.214 -3.020 2.184 1.00 0.00 N ATOM 1562 CA THR A 103 3.622 -2.836 1.731 1.00 0.00 C ATOM 1563 C THR A 103 3.653 -1.897 0.524 1.00 0.00 C ATOM 1564 O THR A 103 2.947 -2.092 -0.446 1.00 0.00 O ATOM 1565 CB THR A 103 4.212 -4.192 1.337 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.044 -5.110 2.410 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.702 -4.032 1.028 1.00 0.00 C ATOM 0 H THR A 103 1.536 -3.183 1.440 1.00 0.00 H new ATOM 0 HA THR A 103 4.210 -2.404 2.541 1.00 0.00 H new ATOM 0 HB THR A 103 3.699 -4.569 0.452 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.420 -5.979 2.159 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.121 -4.998 0.748 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.829 -3.329 0.205 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.218 -3.655 1.911 1.00 0.00 H new ATOM 1575 N LYS A 104 4.468 -0.878 0.574 1.00 0.00 N ATOM 1576 CA LYS A 104 4.546 0.073 -0.571 1.00 0.00 C ATOM 1577 C LYS A 104 6.014 0.369 -0.884 1.00 0.00 C ATOM 1578 O LYS A 104 6.770 0.787 -0.030 1.00 0.00 O ATOM 1579 CB LYS A 104 3.830 1.374 -0.204 1.00 0.00 C ATOM 1580 CG LYS A 104 3.622 2.215 -1.464 1.00 0.00 C ATOM 1581 CD LYS A 104 3.006 3.563 -1.083 1.00 0.00 C ATOM 1582 CE LYS A 104 2.773 4.392 -2.347 1.00 0.00 C ATOM 1583 NZ LYS A 104 1.477 3.997 -2.968 1.00 0.00 N ATOM 0 H LYS A 104 5.083 -0.663 1.359 1.00 0.00 H new ATOM 0 HA LYS A 104 4.068 -0.369 -1.445 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.869 1.154 0.262 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.418 1.932 0.525 1.00 0.00 H new ATOM 0 HG2 LYS A 104 4.574 2.369 -1.972 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.970 1.689 -2.161 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.064 3.409 -0.557 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.667 4.098 -0.401 1.00 0.00 H new ATOM 0 HE2 LYS A 104 2.762 5.454 -2.101 1.00 0.00 H new ATOM 0 HE3 LYS A 104 3.589 4.236 -3.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.227 4.678 -3.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.566 3.047 -3.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 0.732 3.989 -2.242 1.00 0.00 H new ATOM 1597 N LEU A 105 6.426 0.153 -2.104 1.00 0.00 N ATOM 1598 CA LEU A 105 7.846 0.421 -2.470 1.00 0.00 C ATOM 1599 C LEU A 105 7.972 1.835 -3.039 1.00 0.00 C ATOM 1600 O LEU A 105 7.244 2.222 -3.933 1.00 0.00 O ATOM 1601 CB LEU A 105 8.302 -0.594 -3.520 1.00 0.00 C ATOM 1602 CG LEU A 105 8.253 -2.002 -2.924 1.00 0.00 C ATOM 1603 CD1 LEU A 105 8.968 -2.010 -1.572 1.00 0.00 C ATOM 1604 CD2 LEU A 105 6.794 -2.425 -2.731 1.00 0.00 C ATOM 0 H LEU A 105 5.841 -0.197 -2.862 1.00 0.00 H new ATOM 0 HA LEU A 105 8.471 0.332 -1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.660 -0.537 -4.399 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.315 -0.362 -3.850 1.00 0.00 H new ATOM 0 HG LEU A 105 8.747 -2.699 -3.601 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.933 -3.013 -1.148 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.007 -1.710 -1.708 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.474 -1.312 -0.895 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.759 -3.428 -2.306 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.299 -1.727 -2.055 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.284 -2.421 -3.694 1.00 0.00 H new ATOM 1616 N VAL A 106 8.891 2.608 -2.531 1.00 0.00 N ATOM 1617 CA VAL A 106 9.066 3.996 -3.044 1.00 0.00 C ATOM 1618 C VAL A 106 10.548 4.255 -3.320 1.00 0.00 C ATOM 1619 O VAL A 106 11.411 3.818 -2.585 1.00 0.00 O ATOM 1620 CB VAL A 106 8.559 4.993 -1.999 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.696 6.417 -2.545 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.090 4.704 -1.690 1.00 0.00 C ATOM 0 H VAL A 106 9.529 2.339 -1.782 1.00 0.00 H new ATOM 0 HA VAL A 106 8.499 4.117 -3.967 1.00 0.00 H new ATOM 0 HB VAL A 106 9.148 4.895 -1.087 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.335 7.128 -1.802 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.743 6.623 -2.766 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.107 6.515 -3.457 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.728 5.414 -0.946 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.500 4.802 -2.602 1.00 0.00 H new ATOM 0 HG23 VAL A 106 6.992 3.690 -1.302 1.00 0.00 H new ATOM 1632 N SER A 107 10.851 4.959 -4.375 1.00 0.00 N ATOM 1633 CA SER A 107 12.277 5.242 -4.696 1.00 0.00 C ATOM 1634 C SER A 107 12.579 6.717 -4.429 1.00 0.00 C ATOM 1635 O SER A 107 11.737 7.576 -4.603 1.00 0.00 O ATOM 1636 CB SER A 107 12.539 4.926 -6.170 1.00 0.00 C ATOM 1637 OG SER A 107 11.818 5.838 -6.986 1.00 0.00 O ATOM 0 H SER A 107 10.173 5.350 -5.028 1.00 0.00 H new ATOM 0 HA SER A 107 12.920 4.622 -4.071 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.606 4.995 -6.384 1.00 0.00 H new ATOM 0 HB3 SER A 107 12.235 3.903 -6.393 1.00 0.00 H new ATOM 0 HG SER A 107 11.987 5.637 -7.930 1.00 0.00 H new ATOM 1643 N ALA A 108 13.776 7.018 -4.004 1.00 0.00 N ATOM 1644 CA ALA A 108 14.131 8.438 -3.724 1.00 0.00 C ATOM 1645 C ALA A 108 15.163 8.915 -4.748 1.00 0.00 C ATOM 1646 O ALA A 108 15.773 8.128 -5.443 1.00 0.00 O ATOM 1647 CB ALA A 108 14.722 8.546 -2.317 1.00 0.00 C ATOM 0 H ALA A 108 14.522 6.343 -3.839 1.00 0.00 H new ATOM 0 HA ALA A 108 13.237 9.058 -3.792 1.00 0.00 H new ATOM 0 HB1 ALA A 108 14.982 9.584 -2.110 1.00 0.00 H new ATOM 0 HB2 ALA A 108 13.989 8.204 -1.587 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.617 7.927 -2.250 1.00 0.00 H new ATOM 1653 N PRO A 109 15.356 10.240 -4.839 1.00 0.00 N ATOM 1654 CA PRO A 109 16.314 10.839 -5.777 1.00 0.00 C ATOM 1655 C PRO A 109 17.763 10.553 -5.372 1.00 0.00 C ATOM 1656 O PRO A 109 18.675 10.682 -6.165 1.00 0.00 O ATOM 1657 CB PRO A 109 16.029 12.336 -5.672 1.00 0.00 C ATOM 1658 CG PRO A 109 15.433 12.511 -4.317 1.00 0.00 C ATOM 1659 CD PRO A 109 14.656 11.256 -4.035 1.00 0.00 C ATOM 0 HA PRO A 109 16.203 10.439 -6.785 1.00 0.00 H new ATOM 0 HB2 PRO A 109 16.941 12.922 -5.782 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.343 12.665 -6.452 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.209 12.665 -3.567 1.00 0.00 H new ATOM 0 HG3 PRO A 109 14.783 13.386 -4.288 1.00 0.00 H new ATOM 0 HD2 PRO A 109 14.665 11.006 -2.974 1.00 0.00 H new ATOM 0 HD3 PRO A 109 13.611 11.354 -4.330 1.00 0.00 H new ATOM 1667 N HIS A 110 17.982 10.166 -4.145 1.00 0.00 N ATOM 1668 CA HIS A 110 19.371 9.873 -3.693 1.00 0.00 C ATOM 1669 C HIS A 110 19.833 8.545 -4.295 1.00 0.00 C ATOM 1670 O HIS A 110 21.006 8.229 -4.301 1.00 0.00 O ATOM 1671 CB HIS A 110 19.403 9.779 -2.166 1.00 0.00 C ATOM 1672 CG HIS A 110 18.990 11.099 -1.573 1.00 0.00 C ATOM 1673 ND1 HIS A 110 17.671 11.389 -1.261 1.00 0.00 N ATOM 1674 CD2 HIS A 110 19.711 12.215 -1.230 1.00 0.00 C ATOM 1675 CE1 HIS A 110 17.640 12.635 -0.754 1.00 0.00 C ATOM 1676 NE2 HIS A 110 18.856 13.184 -0.712 1.00 0.00 N ATOM 0 H HIS A 110 17.259 10.040 -3.436 1.00 0.00 H new ATOM 0 HA HIS A 110 20.035 10.672 -4.021 1.00 0.00 H new ATOM 0 HB2 HIS A 110 18.733 8.990 -1.826 1.00 0.00 H new ATOM 0 HB3 HIS A 110 20.405 9.514 -1.828 1.00 0.00 H new ATOM 0 HD2 HIS A 110 20.779 12.325 -1.344 1.00 0.00 H new ATOM 0 HE1 HIS A 110 16.740 13.131 -0.421 1.00 0.00 H new ATOM 0 HE2 HIS A 110 19.105 14.113 -0.373 1.00 0.00 H new ATOM 1684 N GLY A 111 18.920 7.763 -4.803 1.00 0.00 N ATOM 1685 CA GLY A 111 19.309 6.456 -5.404 1.00 0.00 C ATOM 1686 C GLY A 111 18.847 5.317 -4.492 1.00 0.00 C ATOM 1687 O GLY A 111 18.799 4.170 -4.891 1.00 0.00 O ATOM 0 H GLY A 111 17.922 7.973 -4.828 1.00 0.00 H new ATOM 0 HA2 GLY A 111 18.860 6.350 -6.392 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.390 6.413 -5.539 1.00 0.00 H new ATOM 1691 N GLY A 112 18.506 5.623 -3.270 1.00 0.00 N ATOM 1692 CA GLY A 112 18.050 4.556 -2.335 1.00 0.00 C ATOM 1693 C GLY A 112 16.557 4.294 -2.548 1.00 0.00 C ATOM 1694 O GLY A 112 15.882 5.025 -3.246 1.00 0.00 O ATOM 0 H GLY A 112 18.523 6.565 -2.879 1.00 0.00 H new ATOM 0 HA2 GLY A 112 18.618 3.642 -2.505 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.234 4.858 -1.304 1.00 0.00 H new ATOM 1698 N THR A 113 16.038 3.255 -1.954 1.00 0.00 N ATOM 1699 CA THR A 113 14.589 2.946 -2.124 1.00 0.00 C ATOM 1700 C THR A 113 13.900 2.968 -0.758 1.00 0.00 C ATOM 1701 O THR A 113 14.312 2.298 0.167 1.00 0.00 O ATOM 1702 CB THR A 113 14.434 1.559 -2.752 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.076 1.541 -4.019 1.00 0.00 O ATOM 1704 CG2 THR A 113 12.949 1.237 -2.924 1.00 0.00 C ATOM 0 H THR A 113 16.553 2.607 -1.359 1.00 0.00 H new ATOM 0 HA THR A 113 14.131 3.692 -2.774 1.00 0.00 H new ATOM 0 HB THR A 113 14.891 0.812 -2.103 1.00 0.00 H new ATOM 0 HG1 THR A 113 15.238 0.613 -4.290 1.00 0.00 H new ATOM 0 HG21 THR A 113 12.840 0.249 -3.371 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.459 1.251 -1.951 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.488 1.982 -3.573 1.00 0.00 H new ATOM 1712 N ILE A 114 12.851 3.735 -0.624 1.00 0.00 N ATOM 1713 CA ILE A 114 12.137 3.797 0.683 1.00 0.00 C ATOM 1714 C ILE A 114 10.993 2.782 0.687 1.00 0.00 C ATOM 1715 O ILE A 114 10.299 2.611 -0.296 1.00 0.00 O ATOM 1716 CB ILE A 114 11.573 5.206 0.889 1.00 0.00 C ATOM 1717 CG1 ILE A 114 12.702 6.231 0.772 1.00 0.00 C ATOM 1718 CG2 ILE A 114 10.939 5.302 2.278 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.112 7.642 0.772 1.00 0.00 C ATOM 0 H ILE A 114 12.459 4.320 -1.362 1.00 0.00 H new ATOM 0 HA ILE A 114 12.832 3.563 1.490 1.00 0.00 H new ATOM 0 HB ILE A 114 10.819 5.410 0.129 1.00 0.00 H new ATOM 0 HG12 ILE A 114 13.399 6.117 1.602 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.268 6.062 -0.144 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.537 6.304 2.426 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.134 4.572 2.362 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.694 5.098 3.037 1.00 0.00 H new ATOM 0 HD11 ILE A 114 12.916 8.373 0.689 1.00 0.00 H new ATOM 0 HD12 ILE A 114 11.433 7.752 -0.073 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.566 7.808 1.701 1.00 0.00 H new ATOM 1731 N ILE A 115 10.789 2.105 1.784 1.00 0.00 N ATOM 1732 CA ILE A 115 9.690 1.100 1.844 1.00 0.00 C ATOM 1733 C ILE A 115 8.798 1.382 3.054 1.00 0.00 C ATOM 1734 O ILE A 115 9.249 1.397 4.182 1.00 0.00 O ATOM 1735 CB ILE A 115 10.288 -0.303 1.971 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.294 -0.535 0.842 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.169 -1.342 1.877 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.111 -1.793 1.140 1.00 0.00 C ATOM 0 H ILE A 115 11.335 2.204 2.640 1.00 0.00 H new ATOM 0 HA ILE A 115 9.095 1.163 0.933 1.00 0.00 H new ATOM 0 HB ILE A 115 10.794 -0.397 2.932 1.00 0.00 H new ATOM 0 HG12 ILE A 115 10.772 -0.644 -0.109 1.00 0.00 H new ATOM 0 HG13 ILE A 115 11.955 0.327 0.746 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.593 -2.342 1.967 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.452 -1.178 2.681 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.664 -1.247 0.916 1.00 0.00 H new ATOM 0 HD11 ILE A 115 12.828 -1.960 0.336 1.00 0.00 H new ATOM 0 HD12 ILE A 115 12.644 -1.666 2.082 1.00 0.00 H new ATOM 0 HD13 ILE A 115 11.443 -2.651 1.214 1.00 0.00 H new ATOM 1750 N LYS A 116 7.530 1.599 2.828 1.00 0.00 N ATOM 1751 CA LYS A 116 6.604 1.872 3.963 1.00 0.00 C ATOM 1752 C LYS A 116 5.722 0.644 4.194 1.00 0.00 C ATOM 1753 O LYS A 116 5.164 0.087 3.269 1.00 0.00 O ATOM 1754 CB LYS A 116 5.726 3.078 3.625 1.00 0.00 C ATOM 1755 CG LYS A 116 6.602 4.325 3.485 1.00 0.00 C ATOM 1756 CD LYS A 116 5.713 5.558 3.318 1.00 0.00 C ATOM 1757 CE LYS A 116 6.590 6.806 3.198 1.00 0.00 C ATOM 1758 NZ LYS A 116 7.153 6.890 1.821 1.00 0.00 N ATOM 0 H LYS A 116 7.096 1.599 1.905 1.00 0.00 H new ATOM 0 HA LYS A 116 7.178 2.086 4.865 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.182 2.897 2.698 1.00 0.00 H new ATOM 0 HB3 LYS A 116 4.982 3.230 4.407 1.00 0.00 H new ATOM 0 HG2 LYS A 116 7.236 4.437 4.364 1.00 0.00 H new ATOM 0 HG3 LYS A 116 7.264 4.222 2.625 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.089 5.452 2.431 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.041 5.653 4.171 1.00 0.00 H new ATOM 0 HE2 LYS A 116 6.003 7.698 3.417 1.00 0.00 H new ATOM 0 HE3 LYS A 116 7.397 6.768 3.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 7.679 7.781 1.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 7.794 6.088 1.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 6.379 6.860 1.127 1.00 0.00 H new ATOM 1772 N THR A 117 5.592 0.211 5.419 1.00 0.00 N ATOM 1773 CA THR A 117 4.750 -0.986 5.695 1.00 0.00 C ATOM 1774 C THR A 117 3.798 -0.699 6.858 1.00 0.00 C ATOM 1775 O THR A 117 4.204 -0.242 7.908 1.00 0.00 O ATOM 1776 CB THR A 117 5.651 -2.169 6.057 1.00 0.00 C ATOM 1777 OG1 THR A 117 6.575 -2.398 5.004 1.00 0.00 O ATOM 1778 CG2 THR A 117 4.794 -3.418 6.268 1.00 0.00 C ATOM 0 H THR A 117 6.031 0.633 6.237 1.00 0.00 H new ATOM 0 HA THR A 117 4.167 -1.225 4.806 1.00 0.00 H new ATOM 0 HB THR A 117 6.195 -1.945 6.975 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.154 -3.154 5.235 1.00 0.00 H new ATOM 0 HG21 THR A 117 5.436 -4.260 6.526 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.086 -3.241 7.077 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.249 -3.644 5.352 1.00 0.00 H new ATOM 1786 N THR A 118 2.536 -0.974 6.679 1.00 0.00 N ATOM 1787 CA THR A 118 1.554 -0.731 7.773 1.00 0.00 C ATOM 1788 C THR A 118 1.012 -2.076 8.261 1.00 0.00 C ATOM 1789 O THR A 118 0.905 -3.021 7.503 1.00 0.00 O ATOM 1790 CB THR A 118 0.401 0.126 7.245 1.00 0.00 C ATOM 1791 OG1 THR A 118 0.925 1.295 6.630 1.00 0.00 O ATOM 1792 CG2 THR A 118 -0.515 0.522 8.403 1.00 0.00 C ATOM 0 H THR A 118 2.141 -1.357 5.820 1.00 0.00 H new ATOM 0 HA THR A 118 2.040 -0.208 8.597 1.00 0.00 H new ATOM 0 HB THR A 118 -0.171 -0.444 6.513 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.188 1.844 6.290 1.00 0.00 H new ATOM 0 HG21 THR A 118 -1.336 1.132 8.026 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.917 -0.376 8.873 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.053 1.092 9.138 1.00 0.00 H new ATOM 1800 N SER A 119 0.672 -2.178 9.516 1.00 0.00 N ATOM 1801 CA SER A 119 0.146 -3.471 10.035 1.00 0.00 C ATOM 1802 C SER A 119 -1.003 -3.213 11.011 1.00 0.00 C ATOM 1803 O SER A 119 -1.031 -2.217 11.707 1.00 0.00 O ATOM 1804 CB SER A 119 1.266 -4.223 10.757 1.00 0.00 C ATOM 1805 OG SER A 119 2.326 -4.480 9.848 1.00 0.00 O ATOM 0 H SER A 119 0.735 -1.426 10.202 1.00 0.00 H new ATOM 0 HA SER A 119 -0.220 -4.069 9.200 1.00 0.00 H new ATOM 0 HB2 SER A 119 1.630 -3.634 11.599 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.886 -5.160 11.164 1.00 0.00 H new ATOM 0 HG SER A 119 2.293 -5.417 9.564 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.949 -4.110 11.069 1.00 0.00 N ATOM 1812 CA LYS A 120 -3.098 -3.932 12.000 1.00 0.00 C ATOM 1813 C LYS A 120 -3.421 -5.273 12.661 1.00 0.00 C ATOM 1814 O LYS A 120 -3.607 -6.273 11.995 1.00 0.00 O ATOM 1815 CB LYS A 120 -4.319 -3.439 11.220 1.00 0.00 C ATOM 1816 CG LYS A 120 -5.332 -2.833 12.193 1.00 0.00 C ATOM 1817 CD LYS A 120 -6.590 -2.415 11.426 1.00 0.00 C ATOM 1818 CE LYS A 120 -7.615 -1.839 12.404 1.00 0.00 C ATOM 1819 NZ LYS A 120 -8.889 -1.561 11.682 1.00 0.00 N ATOM 0 H LYS A 120 -1.975 -4.962 10.509 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.840 -3.199 12.764 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -4.017 -2.696 10.482 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.773 -4.265 10.673 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -5.588 -3.558 12.966 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.897 -1.970 12.697 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -6.337 -1.673 10.668 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -7.012 -3.273 10.903 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.792 -2.542 13.218 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -7.231 -0.923 12.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -9.526 -1.017 12.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -8.688 -1.013 10.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -9.344 -2.459 11.422 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.485 -5.307 13.963 1.00 0.00 N ATOM 1834 CA TYR A 121 -3.791 -6.588 14.658 1.00 0.00 C ATOM 1835 C TYR A 121 -5.229 -6.560 15.179 1.00 0.00 C ATOM 1836 O TYR A 121 -5.604 -5.700 15.951 1.00 0.00 O ATOM 1837 CB TYR A 121 -2.827 -6.774 15.832 1.00 0.00 C ATOM 1838 CG TYR A 121 -1.408 -6.600 15.347 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -0.841 -5.322 15.287 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -0.659 -7.717 14.956 1.00 0.00 C ATOM 1841 CE1 TYR A 121 0.474 -5.159 14.836 1.00 0.00 C ATOM 1842 CE2 TYR A 121 0.657 -7.555 14.506 1.00 0.00 C ATOM 1843 CZ TYR A 121 1.223 -6.276 14.446 1.00 0.00 C ATOM 1844 OH TYR A 121 2.519 -6.115 14.000 1.00 0.00 O ATOM 0 H TYR A 121 -3.339 -4.504 14.575 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.677 -7.415 13.958 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -3.047 -6.049 16.616 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -2.955 -7.764 16.269 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -1.419 -4.461 15.589 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -1.097 -8.703 15.002 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.911 -4.172 14.789 1.00 0.00 H new ATOM 0 HE2 TYR A 121 1.235 -8.416 14.205 1.00 0.00 H new ATOM 0 HH TYR A 121 2.897 -6.990 13.770 1.00 0.00 H new ATOM 1854 N HIS A 122 -6.035 -7.498 14.765 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.447 -7.529 15.238 1.00 0.00 C ATOM 1856 C HIS A 122 -7.590 -8.592 16.329 1.00 0.00 C ATOM 1857 O HIS A 122 -7.003 -9.652 16.256 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.369 -7.870 14.064 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.362 -6.738 13.075 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -7.464 -6.683 12.021 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -9.139 -5.611 12.964 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -7.720 -5.559 11.328 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -8.731 -4.869 11.860 1.00 0.00 N ATOM 0 H HIS A 122 -5.777 -8.244 14.120 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.721 -6.554 15.641 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.037 -8.790 13.582 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.383 -8.047 14.423 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -6.740 -7.370 11.809 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -9.944 -5.342 13.632 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -7.174 -5.252 10.448 1.00 0.00 H new ATOM 1871 N THR A 123 -8.366 -8.319 17.342 1.00 0.00 N ATOM 1872 CA THR A 123 -8.541 -9.317 18.435 1.00 0.00 C ATOM 1873 C THR A 123 -10.014 -9.721 18.531 1.00 0.00 C ATOM 1874 O THR A 123 -10.902 -8.929 18.285 1.00 0.00 O ATOM 1875 CB THR A 123 -8.093 -8.704 19.764 1.00 0.00 C ATOM 1876 OG1 THR A 123 -9.030 -7.714 20.166 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.714 -8.066 19.595 1.00 0.00 C ATOM 0 H THR A 123 -8.886 -7.449 17.460 1.00 0.00 H new ATOM 0 HA THR A 123 -7.937 -10.198 18.219 1.00 0.00 H new ATOM 0 HB THR A 123 -8.038 -9.483 20.524 1.00 0.00 H new ATOM 0 HG1 THR A 123 -8.746 -7.321 21.018 1.00 0.00 H new ATOM 0 HG21 THR A 123 -6.396 -7.630 20.542 1.00 0.00 H new ATOM 0 HG22 THR A 123 -5.997 -8.827 19.287 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.765 -7.286 18.835 1.00 0.00 H new ATOM 2169 N ALA A 142 11.618 -6.122 10.146 1.00 0.00 N ATOM 2170 CA ALA A 142 12.745 -5.301 9.619 1.00 0.00 C ATOM 2171 C ALA A 142 13.920 -6.217 9.270 1.00 0.00 C ATOM 2172 O ALA A 142 14.577 -6.043 8.263 1.00 0.00 O ATOM 2173 CB ALA A 142 13.183 -4.294 10.684 1.00 0.00 C ATOM 0 HA ALA A 142 12.421 -4.767 8.726 1.00 0.00 H new ATOM 0 HB1 ALA A 142 14.007 -3.693 10.300 1.00 0.00 H new ATOM 0 HB2 ALA A 142 12.346 -3.643 10.935 1.00 0.00 H new ATOM 0 HB3 ALA A 142 13.509 -4.827 11.577 1.00 0.00 H new ATOM 2179 N HIS A 143 14.188 -7.194 10.093 1.00 0.00 N ATOM 2180 CA HIS A 143 15.318 -8.121 9.807 1.00 0.00 C ATOM 2181 C HIS A 143 15.088 -8.801 8.456 1.00 0.00 C ATOM 2182 O HIS A 143 15.989 -8.920 7.649 1.00 0.00 O ATOM 2183 CB HIS A 143 15.397 -9.183 10.906 1.00 0.00 C ATOM 2184 CG HIS A 143 15.776 -8.532 12.207 1.00 0.00 C ATOM 2185 ND1 HIS A 143 16.895 -7.723 12.329 1.00 0.00 N ATOM 2186 CD2 HIS A 143 15.196 -8.560 13.450 1.00 0.00 C ATOM 2187 CE1 HIS A 143 16.952 -7.300 13.605 1.00 0.00 C ATOM 2188 NE2 HIS A 143 15.940 -7.782 14.332 1.00 0.00 N ATOM 0 H HIS A 143 13.673 -7.390 10.951 1.00 0.00 H new ATOM 0 HA HIS A 143 16.252 -7.559 9.777 1.00 0.00 H new ATOM 0 HB2 HIS A 143 14.437 -9.689 11.007 1.00 0.00 H new ATOM 0 HB3 HIS A 143 16.132 -9.943 10.640 1.00 0.00 H new ATOM 0 HD2 HIS A 143 14.298 -9.103 13.705 1.00 0.00 H new ATOM 0 HE1 HIS A 143 17.722 -6.650 13.994 1.00 0.00 H new ATOM 0 HE2 HIS A 143 15.753 -7.616 15.321 1.00 0.00 H new ATOM 2196 N LEU A 144 13.888 -9.244 8.202 1.00 0.00 N ATOM 2197 CA LEU A 144 13.599 -9.913 6.902 1.00 0.00 C ATOM 2198 C LEU A 144 13.957 -8.968 5.755 1.00 0.00 C ATOM 2199 O LEU A 144 14.637 -9.340 4.819 1.00 0.00 O ATOM 2200 CB LEU A 144 12.113 -10.266 6.829 1.00 0.00 C ATOM 2201 CG LEU A 144 11.766 -11.252 7.945 1.00 0.00 C ATOM 2202 CD1 LEU A 144 10.331 -11.750 7.760 1.00 0.00 C ATOM 2203 CD2 LEU A 144 12.729 -12.440 7.891 1.00 0.00 C ATOM 0 H LEU A 144 13.094 -9.172 8.839 1.00 0.00 H new ATOM 0 HA LEU A 144 14.192 -10.824 6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.509 -9.364 6.926 1.00 0.00 H new ATOM 0 HB3 LEU A 144 11.880 -10.703 5.858 1.00 0.00 H new ATOM 0 HG LEU A 144 11.855 -10.754 8.911 1.00 0.00 H new ATOM 0 HD11 LEU A 144 10.084 -12.453 8.556 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.645 -10.904 7.797 1.00 0.00 H new ATOM 0 HD13 LEU A 144 10.240 -12.248 6.795 1.00 0.00 H new ATOM 0 HD21 LEU A 144 12.483 -13.144 8.686 1.00 0.00 H new ATOM 0 HD22 LEU A 144 12.639 -12.937 6.925 1.00 0.00 H new ATOM 0 HD23 LEU A 144 13.751 -12.086 8.023 1.00 0.00 H new ATOM 2215 N PHE A 145 13.504 -7.745 5.818 1.00 0.00 N ATOM 2216 CA PHE A 145 13.819 -6.776 4.732 1.00 0.00 C ATOM 2217 C PHE A 145 15.331 -6.732 4.513 1.00 0.00 C ATOM 2218 O PHE A 145 15.808 -6.735 3.395 1.00 0.00 O ATOM 2219 CB PHE A 145 13.320 -5.385 5.128 1.00 0.00 C ATOM 2220 CG PHE A 145 11.813 -5.348 5.050 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.179 -5.288 3.803 1.00 0.00 C ATOM 2222 CD2 PHE A 145 11.050 -5.374 6.223 1.00 0.00 C ATOM 2223 CE1 PHE A 145 9.781 -5.254 3.730 1.00 0.00 C ATOM 2224 CE2 PHE A 145 9.653 -5.339 6.150 1.00 0.00 C ATOM 2225 CZ PHE A 145 9.018 -5.279 4.903 1.00 0.00 C ATOM 0 H PHE A 145 12.929 -7.376 6.575 1.00 0.00 H new ATOM 0 HA PHE A 145 13.327 -7.089 3.811 1.00 0.00 H new ATOM 0 HB2 PHE A 145 13.648 -5.144 6.139 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.747 -4.632 4.466 1.00 0.00 H new ATOM 0 HD1 PHE A 145 11.768 -5.268 2.898 1.00 0.00 H new ATOM 0 HD2 PHE A 145 11.539 -5.421 7.185 1.00 0.00 H new ATOM 0 HE1 PHE A 145 9.292 -5.208 2.768 1.00 0.00 H new ATOM 0 HE2 PHE A 145 9.064 -5.358 7.055 1.00 0.00 H new ATOM 0 HZ PHE A 145 7.940 -5.252 4.847 1.00 0.00 H new ATOM 2235 N LYS A 146 16.091 -6.693 5.573 1.00 0.00 N ATOM 2236 CA LYS A 146 17.573 -6.650 5.426 1.00 0.00 C ATOM 2237 C LYS A 146 18.042 -7.885 4.654 1.00 0.00 C ATOM 2238 O LYS A 146 18.908 -7.807 3.806 1.00 0.00 O ATOM 2239 CB LYS A 146 18.224 -6.637 6.809 1.00 0.00 C ATOM 2240 CG LYS A 146 19.731 -6.423 6.661 1.00 0.00 C ATOM 2241 CD LYS A 146 20.387 -6.438 8.044 1.00 0.00 C ATOM 2242 CE LYS A 146 21.868 -6.080 7.909 1.00 0.00 C ATOM 2243 NZ LYS A 146 22.260 -5.163 9.016 1.00 0.00 N ATOM 0 H LYS A 146 15.750 -6.689 6.534 1.00 0.00 H new ATOM 0 HA LYS A 146 17.859 -5.749 4.883 1.00 0.00 H new ATOM 0 HB2 LYS A 146 17.791 -5.844 7.419 1.00 0.00 H new ATOM 0 HB3 LYS A 146 18.028 -7.578 7.324 1.00 0.00 H new ATOM 0 HG2 LYS A 146 20.160 -7.205 6.035 1.00 0.00 H new ATOM 0 HG3 LYS A 146 19.927 -5.473 6.164 1.00 0.00 H new ATOM 0 HD2 LYS A 146 19.888 -5.727 8.703 1.00 0.00 H new ATOM 0 HD3 LYS A 146 20.280 -7.423 8.499 1.00 0.00 H new ATOM 0 HE2 LYS A 146 22.476 -6.984 7.939 1.00 0.00 H new ATOM 0 HE3 LYS A 146 22.052 -5.604 6.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 23.267 -4.919 8.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 21.688 -4.296 8.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 22.099 -5.633 9.930 1.00 0.00 H new ATOM 2257 N LEU A 147 17.476 -9.025 4.941 1.00 0.00 N ATOM 2258 CA LEU A 147 17.890 -10.263 4.224 1.00 0.00 C ATOM 2259 C LEU A 147 17.541 -10.131 2.742 1.00 0.00 C ATOM 2260 O LEU A 147 18.296 -10.531 1.877 1.00 0.00 O ATOM 2261 CB LEU A 147 17.155 -11.466 4.818 1.00 0.00 C ATOM 2262 CG LEU A 147 17.431 -11.541 6.321 1.00 0.00 C ATOM 2263 CD1 LEU A 147 16.812 -12.820 6.889 1.00 0.00 C ATOM 2264 CD2 LEU A 147 18.942 -11.555 6.562 1.00 0.00 C ATOM 0 H LEU A 147 16.745 -9.152 5.641 1.00 0.00 H new ATOM 0 HA LEU A 147 18.965 -10.406 4.333 1.00 0.00 H new ATOM 0 HB2 LEU A 147 16.084 -11.376 4.638 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.484 -12.384 4.331 1.00 0.00 H new ATOM 0 HG LEU A 147 16.993 -10.674 6.815 1.00 0.00 H new ATOM 0 HD11 LEU A 147 17.008 -12.875 7.960 1.00 0.00 H new ATOM 0 HD12 LEU A 147 15.736 -12.811 6.717 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.251 -13.687 6.395 1.00 0.00 H new ATOM 0 HD21 LEU A 147 19.139 -11.608 7.633 1.00 0.00 H new ATOM 0 HD22 LEU A 147 19.381 -12.422 6.068 1.00 0.00 H new ATOM 0 HD23 LEU A 147 19.384 -10.645 6.157 1.00 0.00 H new ATOM 2276 N ILE A 148 16.402 -9.571 2.438 1.00 0.00 N ATOM 2277 CA ILE A 148 16.008 -9.412 1.011 1.00 0.00 C ATOM 2278 C ILE A 148 17.103 -8.648 0.264 1.00 0.00 C ATOM 2279 O ILE A 148 17.600 -9.092 -0.751 1.00 0.00 O ATOM 2280 CB ILE A 148 14.693 -8.636 0.927 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.623 -9.355 1.751 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.241 -8.555 -0.533 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.329 -8.539 1.731 1.00 0.00 C ATOM 0 H ILE A 148 15.728 -9.217 3.117 1.00 0.00 H new ATOM 0 HA ILE A 148 15.877 -10.395 0.558 1.00 0.00 H new ATOM 0 HB ILE A 148 14.840 -7.630 1.319 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.444 -10.350 1.345 1.00 0.00 H new ATOM 0 HG13 ILE A 148 13.967 -9.487 2.777 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.304 -8.002 -0.594 1.00 0.00 H new ATOM 0 HG22 ILE A 148 15.003 -8.044 -1.122 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.094 -9.562 -0.925 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.567 -9.051 2.318 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.514 -7.553 2.158 1.00 0.00 H new ATOM 0 HD13 ILE A 148 11.983 -8.430 0.703 1.00 0.00 H new ATOM 2295 N GLU A 149 17.485 -7.503 0.760 1.00 0.00 N ATOM 2296 CA GLU A 149 18.551 -6.717 0.078 1.00 0.00 C ATOM 2297 C GLU A 149 19.788 -7.598 -0.101 1.00 0.00 C ATOM 2298 O GLU A 149 20.442 -7.567 -1.124 1.00 0.00 O ATOM 2299 CB GLU A 149 18.911 -5.496 0.927 1.00 0.00 C ATOM 2300 CG GLU A 149 17.717 -4.540 0.979 1.00 0.00 C ATOM 2301 CD GLU A 149 17.247 -4.229 -0.443 1.00 0.00 C ATOM 2302 OE1 GLU A 149 18.082 -3.863 -1.254 1.00 0.00 O ATOM 2303 OE2 GLU A 149 16.062 -4.363 -0.697 1.00 0.00 O ATOM 0 H GLU A 149 17.106 -7.079 1.606 1.00 0.00 H new ATOM 0 HA GLU A 149 18.193 -6.384 -0.896 1.00 0.00 H new ATOM 0 HB2 GLU A 149 19.184 -5.808 1.935 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.778 -4.989 0.504 1.00 0.00 H new ATOM 0 HG2 GLU A 149 16.905 -4.987 1.552 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.998 -3.619 1.490 1.00 0.00 H new ATOM 2310 N GLY A 150 20.110 -8.389 0.887 1.00 0.00 N ATOM 2311 CA GLY A 150 21.301 -9.277 0.772 1.00 0.00 C ATOM 2312 C GLY A 150 20.939 -10.497 -0.076 1.00 0.00 C ATOM 2313 O GLY A 150 21.785 -11.108 -0.699 1.00 0.00 O ATOM 0 H GLY A 150 19.600 -8.458 1.768 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.130 -8.736 0.317 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.631 -9.592 1.762 1.00 0.00 H new ATOM 2317 N TYR A 151 19.685 -10.856 -0.105 1.00 0.00 N ATOM 2318 CA TYR A 151 19.264 -12.035 -0.914 1.00 0.00 C ATOM 2319 C TYR A 151 19.596 -11.783 -2.386 1.00 0.00 C ATOM 2320 O TYR A 151 20.136 -12.634 -3.065 1.00 0.00 O ATOM 2321 CB TYR A 151 17.756 -12.246 -0.759 1.00 0.00 C ATOM 2322 CG TYR A 151 17.340 -13.486 -1.514 1.00 0.00 C ATOM 2323 CD1 TYR A 151 16.978 -13.395 -2.863 1.00 0.00 C ATOM 2324 CD2 TYR A 151 17.315 -14.726 -0.864 1.00 0.00 C ATOM 2325 CE1 TYR A 151 16.592 -14.544 -3.563 1.00 0.00 C ATOM 2326 CE2 TYR A 151 16.927 -15.874 -1.563 1.00 0.00 C ATOM 2327 CZ TYR A 151 16.566 -15.784 -2.914 1.00 0.00 C ATOM 2328 OH TYR A 151 16.183 -16.917 -3.603 1.00 0.00 O ATOM 0 H TYR A 151 18.933 -10.384 0.397 1.00 0.00 H new ATOM 0 HA TYR A 151 19.792 -12.924 -0.568 1.00 0.00 H new ATOM 0 HB2 TYR A 151 17.499 -12.346 0.295 1.00 0.00 H new ATOM 0 HB3 TYR A 151 17.216 -11.378 -1.138 1.00 0.00 H new ATOM 0 HD1 TYR A 151 16.997 -12.438 -3.364 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.595 -14.796 0.177 1.00 0.00 H new ATOM 0 HE1 TYR A 151 16.314 -14.474 -4.604 1.00 0.00 H new ATOM 0 HE2 TYR A 151 16.906 -16.830 -1.061 1.00 0.00 H new ATOM 0 HH TYR A 151 16.899 -17.585 -3.559 1.00 0.00 H new ATOM 2338 N LEU A 152 19.278 -10.619 -2.884 1.00 0.00 N ATOM 2339 CA LEU A 152 19.576 -10.312 -4.310 1.00 0.00 C ATOM 2340 C LEU A 152 21.077 -10.067 -4.474 1.00 0.00 C ATOM 2341 O LEU A 152 21.708 -10.591 -5.371 1.00 0.00 O ATOM 2342 CB LEU A 152 18.805 -9.060 -4.733 1.00 0.00 C ATOM 2343 CG LEU A 152 17.308 -9.375 -4.777 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.769 -9.485 -3.350 1.00 0.00 C ATOM 2345 CD2 LEU A 152 16.572 -8.255 -5.515 1.00 0.00 C ATOM 0 H LEU A 152 18.825 -9.868 -2.364 1.00 0.00 H new ATOM 0 HA LEU A 152 19.274 -11.153 -4.935 1.00 0.00 H new ATOM 0 HB2 LEU A 152 18.996 -8.248 -4.032 1.00 0.00 H new ATOM 0 HB3 LEU A 152 19.146 -8.723 -5.712 1.00 0.00 H new ATOM 0 HG LEU A 152 17.150 -10.319 -5.299 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.703 -9.709 -3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 152 17.293 -10.283 -2.824 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.927 -8.541 -2.828 1.00 0.00 H new ATOM 0 HD21 LEU A 152 15.506 -8.479 -5.546 1.00 0.00 H new ATOM 0 HD22 LEU A 152 16.729 -7.311 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 152 16.956 -8.176 -6.532 1.00 0.00 H new