USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 913 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 18 GLN : amide:sc= -1.56 X(o=-9.7,f=-9.6) USER MOD Set 1.2: A 19 HIS : no HD1:sc= -7.96! C(o=-9.7!,f=-10!) USER MOD Set 1.3: A 75 ASN : amide:sc= -0.165 K(o=-9.7,f=-11!) USER MOD Set 2.1: A 6 THR OG1 : rot 147:sc= 1.1 USER MOD Set 2.2: A 38 HIS : no HE2:sc= 1.03 K(o=2.1,f=-7.5!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 177:sc= -0.355 (180deg=-0.404) USER MOD Single : A 2 THR OG1 : rot 67:sc= 0.222 USER MOD Single : A 3 MET CE :methyl 152:sc= -0.383 (180deg=-1.8!) USER MOD Single : A 4 ASN : amide:sc= -0.0131 K(o=-0.013,f=-2.2) USER MOD Single : A 7 SER OG : rot -109:sc= 1.19 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -5.9! C(o=-5.9!,f=-5.7!) USER MOD Single : A 10 MET CE :methyl -119:sc= -8.74! (180deg=-16.7!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -165:sc= -0.0189 (180deg=-0.245) USER MOD Single : A 29 LYS NZ :NH3+ 143:sc= -0.753 (180deg=-1.81) USER MOD Single : A 31 GLN : amide:sc= -0.242 X(o=-0.24,f=-0.042) USER MOD Single : A 32 THR OG1 : rot 160:sc= 0.00591 USER MOD Single : A 33 HIS : no HD1:sc= -2.21 K(o=-2.2,f=-3.7) USER MOD Single : A 36 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.8!) USER MOD Single : A 42 SER OG : rot 149:sc= -1.04 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 ASN :FLIP amide:sc= -0.187 F(o=-3.3!,f=-0.19) USER MOD Single : A 56 THR OG1 : rot 31:sc= 1.17 USER MOD Single : A 58 ASN :FLIP amide:sc= -0.453 F(o=-1.1,f=-0.45) USER MOD Single : A 64 SER OG : rot 180:sc= -1.46 USER MOD Single : A 66 LYS NZ :NH3+ -123:sc= -0.995 (180deg=-2.66!) USER MOD Single : A 67 HIS :FLIP no HD1:sc= -2.33! F(o=-3.9,f=-2.3!) USER MOD Single : A 70 MET CE :methyl -144:sc= -0.566 (180deg=-2.06!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0703 USER MOD Single : A 79 ASN : amide:sc= -0.532 X(o=-0.53,f=-0.68) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.957 K(o=-0.96,f=-2!) USER MOD Single : A 86 ASN : amide:sc= -0.234 K(o=-0.23,f=-1.5) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 GLN :FLIP amide:sc= -0.704 F(o=-2.5!,f=-0.7) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -136:sc= 0 (180deg=-0.356) USER MOD Single : A 105 ASN :FLIP amide:sc= -1.39! C(o=-3.6!,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 185.992 -0.134 -5.621 1.00 0.00 N ATOM 2 CA MET A 1 186.155 -0.377 -7.078 1.00 0.00 C ATOM 3 C MET A 1 185.116 -1.373 -7.590 1.00 0.00 C ATOM 4 O MET A 1 184.336 -1.062 -8.489 1.00 0.00 O ATOM 5 CB MET A 1 187.569 -0.911 -7.327 1.00 0.00 C ATOM 6 CG MET A 1 188.449 0.048 -8.110 1.00 0.00 C ATOM 7 SD MET A 1 189.914 -0.752 -8.790 1.00 0.00 S ATOM 8 CE MET A 1 189.262 -1.409 -10.323 1.00 0.00 C ATOM 0 H1 MET A 1 186.741 0.507 -5.290 1.00 0.00 H new ATOM 0 H2 MET A 1 185.063 0.299 -5.443 1.00 0.00 H new ATOM 0 H3 MET A 1 186.057 -1.037 -5.109 1.00 0.00 H new ATOM 0 HA MET A 1 186.006 0.558 -7.617 1.00 0.00 H new ATOM 0 HB2 MET A 1 188.042 -1.126 -6.369 1.00 0.00 H new ATOM 0 HB3 MET A 1 187.502 -1.855 -7.868 1.00 0.00 H new ATOM 0 HG2 MET A 1 187.869 0.486 -8.922 1.00 0.00 H new ATOM 0 HG3 MET A 1 188.756 0.867 -7.459 1.00 0.00 H new ATOM 0 HE1 MET A 1 190.052 -1.934 -10.859 1.00 0.00 H new ATOM 0 HE2 MET A 1 188.449 -2.102 -10.105 1.00 0.00 H new ATOM 0 HE3 MET A 1 188.887 -0.592 -10.939 1.00 0.00 H new ATOM 20 N THR A 2 185.116 -2.570 -7.013 1.00 0.00 N ATOM 21 CA THR A 2 184.175 -3.610 -7.413 1.00 0.00 C ATOM 22 C THR A 2 182.872 -3.496 -6.629 1.00 0.00 C ATOM 23 O THR A 2 182.641 -4.244 -5.678 1.00 0.00 O ATOM 24 CB THR A 2 184.792 -4.993 -7.201 1.00 0.00 C ATOM 25 OG1 THR A 2 184.893 -5.291 -5.819 1.00 0.00 O ATOM 26 CG2 THR A 2 186.174 -5.131 -7.803 1.00 0.00 C ATOM 0 H THR A 2 185.756 -2.844 -6.268 1.00 0.00 H new ATOM 0 HA THR A 2 183.953 -3.477 -8.472 1.00 0.00 H new ATOM 0 HB THR A 2 184.122 -5.688 -7.707 1.00 0.00 H new ATOM 0 HG1 THR A 2 183.995 -5.385 -5.438 1.00 0.00 H new ATOM 0 HG21 THR A 2 186.553 -6.136 -7.617 1.00 0.00 H new ATOM 0 HG22 THR A 2 186.122 -4.956 -8.878 1.00 0.00 H new ATOM 0 HG23 THR A 2 186.843 -4.400 -7.349 1.00 0.00 H new ATOM 34 N MET A 3 182.020 -2.558 -7.034 1.00 0.00 N ATOM 35 CA MET A 3 180.738 -2.347 -6.368 1.00 0.00 C ATOM 36 C MET A 3 179.926 -3.638 -6.328 1.00 0.00 C ATOM 37 O MET A 3 179.171 -3.938 -7.253 1.00 0.00 O ATOM 38 CB MET A 3 179.943 -1.251 -7.081 1.00 0.00 C ATOM 39 CG MET A 3 179.873 -1.431 -8.590 1.00 0.00 C ATOM 40 SD MET A 3 178.197 -1.272 -9.237 1.00 0.00 S ATOM 41 CE MET A 3 177.608 0.146 -8.315 1.00 0.00 C ATOM 0 H MET A 3 182.194 -1.932 -7.820 1.00 0.00 H new ATOM 0 HA MET A 3 180.937 -2.033 -5.343 1.00 0.00 H new ATOM 0 HB2 MET A 3 178.930 -1.229 -6.679 1.00 0.00 H new ATOM 0 HB3 MET A 3 180.395 -0.284 -6.860 1.00 0.00 H new ATOM 0 HG2 MET A 3 180.514 -0.691 -9.069 1.00 0.00 H new ATOM 0 HG3 MET A 3 180.267 -2.413 -8.853 1.00 0.00 H new ATOM 0 HE1 MET A 3 176.849 0.669 -8.897 1.00 0.00 H new ATOM 0 HE2 MET A 3 177.175 -0.187 -7.372 1.00 0.00 H new ATOM 0 HE3 MET A 3 178.440 0.821 -8.114 1.00 0.00 H new ATOM 51 N ASN A 4 180.091 -4.401 -5.252 1.00 0.00 N ATOM 52 CA ASN A 4 179.378 -5.663 -5.091 1.00 0.00 C ATOM 53 C ASN A 4 178.194 -5.508 -4.140 1.00 0.00 C ATOM 54 O ASN A 4 178.288 -4.827 -3.120 1.00 0.00 O ATOM 55 CB ASN A 4 180.327 -6.743 -4.567 1.00 0.00 C ATOM 56 CG ASN A 4 181.400 -7.109 -5.572 1.00 0.00 C ATOM 57 OD1 ASN A 4 181.456 -6.553 -6.669 1.00 0.00 O ATOM 58 ND2 ASN A 4 182.261 -8.050 -5.202 1.00 0.00 N ATOM 0 H ASN A 4 180.713 -4.167 -4.478 1.00 0.00 H new ATOM 0 HA ASN A 4 178.997 -5.961 -6.068 1.00 0.00 H new ATOM 0 HB2 ASN A 4 180.798 -6.394 -3.648 1.00 0.00 H new ATOM 0 HB3 ASN A 4 179.753 -7.634 -4.312 1.00 0.00 H new ATOM 0 HD21 ASN A 4 183.006 -8.338 -5.837 1.00 0.00 H new ATOM 0 HD22 ASN A 4 182.178 -8.485 -4.283 1.00 0.00 H new ATOM 65 N ILE A 5 177.081 -6.150 -4.482 1.00 0.00 N ATOM 66 CA ILE A 5 175.877 -6.090 -3.659 1.00 0.00 C ATOM 67 C ILE A 5 175.418 -7.489 -3.264 1.00 0.00 C ATOM 68 O ILE A 5 175.386 -8.398 -4.096 1.00 0.00 O ATOM 69 CB ILE A 5 174.719 -5.374 -4.387 1.00 0.00 C ATOM 70 CG1 ILE A 5 175.251 -4.256 -5.289 1.00 0.00 C ATOM 71 CG2 ILE A 5 173.725 -4.820 -3.378 1.00 0.00 C ATOM 72 CD1 ILE A 5 175.865 -3.100 -4.528 1.00 0.00 C ATOM 0 H ILE A 5 176.988 -6.718 -5.324 1.00 0.00 H new ATOM 0 HA ILE A 5 176.137 -5.521 -2.767 1.00 0.00 H new ATOM 0 HB ILE A 5 174.207 -6.101 -5.017 1.00 0.00 H new ATOM 0 HG12 ILE A 5 175.998 -4.672 -5.966 1.00 0.00 H new ATOM 0 HG13 ILE A 5 174.435 -3.880 -5.907 1.00 0.00 H new ATOM 0 HG21 ILE A 5 172.914 -4.318 -3.905 1.00 0.00 H new ATOM 0 HG22 ILE A 5 173.319 -5.637 -2.781 1.00 0.00 H new ATOM 0 HG23 ILE A 5 174.229 -4.108 -2.724 1.00 0.00 H new ATOM 0 HD11 ILE A 5 176.219 -2.348 -5.233 1.00 0.00 H new ATOM 0 HD12 ILE A 5 175.116 -2.658 -3.871 1.00 0.00 H new ATOM 0 HD13 ILE A 5 176.703 -3.461 -3.931 1.00 0.00 H new ATOM 84 N THR A 6 175.063 -7.660 -1.995 1.00 0.00 N ATOM 85 CA THR A 6 174.607 -8.954 -1.498 1.00 0.00 C ATOM 86 C THR A 6 173.591 -8.786 -0.373 1.00 0.00 C ATOM 87 O THR A 6 173.952 -8.759 0.804 1.00 0.00 O ATOM 88 CB THR A 6 175.797 -9.780 -1.004 1.00 0.00 C ATOM 89 OG1 THR A 6 176.759 -9.939 -2.030 1.00 0.00 O ATOM 90 CG2 THR A 6 175.407 -11.162 -0.523 1.00 0.00 C ATOM 0 H THR A 6 175.082 -6.921 -1.293 1.00 0.00 H new ATOM 0 HA THR A 6 174.122 -9.477 -2.322 1.00 0.00 H new ATOM 0 HB THR A 6 176.207 -9.221 -0.163 1.00 0.00 H new ATOM 0 HG1 THR A 6 177.656 -9.959 -1.637 1.00 0.00 H new ATOM 0 HG21 THR A 6 176.297 -11.695 -0.187 1.00 0.00 H new ATOM 0 HG22 THR A 6 174.702 -11.074 0.304 1.00 0.00 H new ATOM 0 HG23 THR A 6 174.941 -11.713 -1.340 1.00 0.00 H new ATOM 98 N SER A 7 172.317 -8.678 -0.741 1.00 0.00 N ATOM 99 CA SER A 7 171.250 -8.517 0.239 1.00 0.00 C ATOM 100 C SER A 7 170.701 -9.873 0.672 1.00 0.00 C ATOM 101 O SER A 7 170.746 -10.842 -0.085 1.00 0.00 O ATOM 102 CB SER A 7 170.130 -7.652 -0.335 1.00 0.00 C ATOM 103 OG SER A 7 170.537 -6.297 -0.435 1.00 0.00 O ATOM 0 H SER A 7 172.000 -8.699 -1.710 1.00 0.00 H new ATOM 0 HA SER A 7 171.665 -8.020 1.116 1.00 0.00 H new ATOM 0 HB2 SER A 7 169.846 -8.024 -1.319 1.00 0.00 H new ATOM 0 HB3 SER A 7 169.247 -7.725 0.300 1.00 0.00 H new ATOM 0 HG SER A 7 170.065 -5.763 0.238 1.00 0.00 H new ATOM 109 N LYS A 8 170.194 -9.937 1.900 1.00 0.00 N ATOM 110 CA LYS A 8 169.650 -11.179 2.437 1.00 0.00 C ATOM 111 C LYS A 8 168.122 -11.160 2.456 1.00 0.00 C ATOM 112 O LYS A 8 167.509 -10.268 3.040 1.00 0.00 O ATOM 113 CB LYS A 8 170.185 -11.420 3.851 1.00 0.00 C ATOM 114 CG LYS A 8 170.833 -12.783 4.033 1.00 0.00 C ATOM 115 CD LYS A 8 172.039 -12.708 4.954 1.00 0.00 C ATOM 116 CE LYS A 8 173.117 -11.794 4.393 1.00 0.00 C ATOM 117 NZ LYS A 8 174.345 -12.548 4.011 1.00 0.00 N ATOM 0 H LYS A 8 170.149 -9.144 2.540 1.00 0.00 H new ATOM 0 HA LYS A 8 169.969 -11.991 1.784 1.00 0.00 H new ATOM 0 HB2 LYS A 8 170.914 -10.646 4.092 1.00 0.00 H new ATOM 0 HB3 LYS A 8 169.366 -11.319 4.563 1.00 0.00 H new ATOM 0 HG2 LYS A 8 170.104 -13.482 4.443 1.00 0.00 H new ATOM 0 HG3 LYS A 8 171.139 -13.174 3.063 1.00 0.00 H new ATOM 0 HD2 LYS A 8 171.727 -12.345 5.933 1.00 0.00 H new ATOM 0 HD3 LYS A 8 172.449 -13.708 5.100 1.00 0.00 H new ATOM 0 HE2 LYS A 8 172.729 -11.268 3.521 1.00 0.00 H new ATOM 0 HE3 LYS A 8 173.372 -11.037 5.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 175.054 -11.888 3.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 174.731 -13.030 4.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 174.107 -13.253 3.285 1.00 0.00 H new ATOM 131 N GLN A 9 167.521 -12.163 1.819 1.00 0.00 N ATOM 132 CA GLN A 9 166.065 -12.293 1.758 1.00 0.00 C ATOM 133 C GLN A 9 165.383 -10.950 1.496 1.00 0.00 C ATOM 134 O GLN A 9 164.272 -10.709 1.965 1.00 0.00 O ATOM 135 CB GLN A 9 165.532 -12.908 3.057 1.00 0.00 C ATOM 136 CG GLN A 9 165.583 -11.971 4.257 1.00 0.00 C ATOM 137 CD GLN A 9 166.890 -12.066 5.019 1.00 0.00 C ATOM 138 OE1 GLN A 9 167.517 -13.125 5.072 1.00 0.00 O ATOM 139 NE2 GLN A 9 167.307 -10.955 5.616 1.00 0.00 N ATOM 0 H GLN A 9 168.025 -12.905 1.333 1.00 0.00 H new ATOM 0 HA GLN A 9 165.831 -12.952 0.922 1.00 0.00 H new ATOM 0 HB2 GLN A 9 164.501 -13.224 2.900 1.00 0.00 H new ATOM 0 HB3 GLN A 9 166.109 -13.804 3.285 1.00 0.00 H new ATOM 0 HG2 GLN A 9 165.439 -10.945 3.918 1.00 0.00 H new ATOM 0 HG3 GLN A 9 164.757 -12.204 4.930 1.00 0.00 H new ATOM 0 HE21 GLN A 9 166.755 -10.100 5.545 1.00 0.00 H new ATOM 0 HE22 GLN A 9 168.179 -10.957 6.145 1.00 0.00 H new ATOM 148 N MET A 10 166.053 -10.080 0.750 1.00 0.00 N ATOM 149 CA MET A 10 165.500 -8.769 0.438 1.00 0.00 C ATOM 150 C MET A 10 166.243 -8.119 -0.725 1.00 0.00 C ATOM 151 O MET A 10 167.281 -7.488 -0.535 1.00 0.00 O ATOM 152 CB MET A 10 165.560 -7.863 1.668 1.00 0.00 C ATOM 153 CG MET A 10 164.951 -6.491 1.435 1.00 0.00 C ATOM 154 SD MET A 10 166.192 -5.195 1.280 1.00 0.00 S ATOM 155 CE MET A 10 166.206 -4.534 2.944 1.00 0.00 C ATOM 0 H MET A 10 166.975 -10.258 0.352 1.00 0.00 H new ATOM 0 HA MET A 10 164.459 -8.905 0.144 1.00 0.00 H new ATOM 0 HB2 MET A 10 165.039 -8.348 2.494 1.00 0.00 H new ATOM 0 HB3 MET A 10 166.600 -7.744 1.973 1.00 0.00 H new ATOM 0 HG2 MET A 10 164.344 -6.517 0.530 1.00 0.00 H new ATOM 0 HG3 MET A 10 164.282 -6.250 2.261 1.00 0.00 H new ATOM 0 HE1 MET A 10 165.916 -3.483 2.921 1.00 0.00 H new ATOM 0 HE2 MET A 10 165.502 -5.091 3.563 1.00 0.00 H new ATOM 0 HE3 MET A 10 167.208 -4.625 3.363 1.00 0.00 H new ATOM 165 N GLU A 11 165.699 -8.273 -1.927 1.00 0.00 N ATOM 166 CA GLU A 11 166.310 -7.697 -3.121 1.00 0.00 C ATOM 167 C GLU A 11 166.460 -6.186 -2.982 1.00 0.00 C ATOM 168 O GLU A 11 165.752 -5.549 -2.202 1.00 0.00 O ATOM 169 CB GLU A 11 165.469 -8.031 -4.356 1.00 0.00 C ATOM 170 CG GLU A 11 165.987 -7.407 -5.642 1.00 0.00 C ATOM 171 CD GLU A 11 167.353 -7.933 -6.036 1.00 0.00 C ATOM 172 OE1 GLU A 11 168.292 -7.814 -5.222 1.00 0.00 O ATOM 173 OE2 GLU A 11 167.483 -8.464 -7.158 1.00 0.00 O ATOM 0 H GLU A 11 164.838 -8.791 -2.101 1.00 0.00 H new ATOM 0 HA GLU A 11 167.304 -8.129 -3.238 1.00 0.00 H new ATOM 0 HB2 GLU A 11 165.434 -9.114 -4.478 1.00 0.00 H new ATOM 0 HB3 GLU A 11 164.446 -7.696 -4.188 1.00 0.00 H new ATOM 0 HG2 GLU A 11 165.280 -7.604 -6.448 1.00 0.00 H new ATOM 0 HG3 GLU A 11 166.039 -6.325 -5.521 1.00 0.00 H new ATOM 180 N ILE A 12 167.387 -5.619 -3.746 1.00 0.00 N ATOM 181 CA ILE A 12 167.634 -4.183 -3.716 1.00 0.00 C ATOM 182 C ILE A 12 166.588 -3.433 -4.535 1.00 0.00 C ATOM 183 O ILE A 12 166.313 -3.786 -5.683 1.00 0.00 O ATOM 184 CB ILE A 12 169.039 -3.843 -4.254 1.00 0.00 C ATOM 185 CG1 ILE A 12 170.104 -4.652 -3.511 1.00 0.00 C ATOM 186 CG2 ILE A 12 169.314 -2.351 -4.121 1.00 0.00 C ATOM 187 CD1 ILE A 12 170.386 -6.000 -4.140 1.00 0.00 C ATOM 0 H ILE A 12 167.981 -6.134 -4.395 1.00 0.00 H new ATOM 0 HA ILE A 12 167.570 -3.869 -2.674 1.00 0.00 H new ATOM 0 HB ILE A 12 169.078 -4.107 -5.311 1.00 0.00 H new ATOM 0 HG12 ILE A 12 171.028 -4.076 -3.476 1.00 0.00 H new ATOM 0 HG13 ILE A 12 169.782 -4.801 -2.480 1.00 0.00 H new ATOM 0 HG21 ILE A 12 170.310 -2.129 -4.505 1.00 0.00 H new ATOM 0 HG22 ILE A 12 168.572 -1.792 -4.691 1.00 0.00 H new ATOM 0 HG23 ILE A 12 169.258 -2.063 -3.071 1.00 0.00 H new ATOM 0 HD11 ILE A 12 171.150 -6.519 -3.562 1.00 0.00 H new ATOM 0 HD12 ILE A 12 169.473 -6.595 -4.150 1.00 0.00 H new ATOM 0 HD13 ILE A 12 170.738 -5.858 -5.162 1.00 0.00 H new ATOM 199 N THR A 13 166.007 -2.397 -3.938 1.00 0.00 N ATOM 200 CA THR A 13 164.989 -1.598 -4.613 1.00 0.00 C ATOM 201 C THR A 13 165.632 -0.436 -5.370 1.00 0.00 C ATOM 202 O THR A 13 166.774 -0.066 -5.098 1.00 0.00 O ATOM 203 CB THR A 13 163.960 -1.070 -3.600 1.00 0.00 C ATOM 204 OG1 THR A 13 164.278 0.249 -3.192 1.00 0.00 O ATOM 205 CG2 THR A 13 163.848 -1.920 -2.351 1.00 0.00 C ATOM 0 H THR A 13 166.223 -2.091 -2.989 1.00 0.00 H new ATOM 0 HA THR A 13 164.474 -2.236 -5.331 1.00 0.00 H new ATOM 0 HB THR A 13 163.007 -1.101 -4.127 1.00 0.00 H new ATOM 0 HG1 THR A 13 163.608 0.563 -2.549 1.00 0.00 H new ATOM 0 HG21 THR A 13 163.104 -1.488 -1.682 1.00 0.00 H new ATOM 0 HG22 THR A 13 163.546 -2.931 -2.625 1.00 0.00 H new ATOM 0 HG23 THR A 13 164.813 -1.954 -1.846 1.00 0.00 H new ATOM 213 N PRO A 14 164.908 0.156 -6.337 1.00 0.00 N ATOM 214 CA PRO A 14 165.418 1.278 -7.131 1.00 0.00 C ATOM 215 C PRO A 14 165.920 2.421 -6.255 1.00 0.00 C ATOM 216 O PRO A 14 166.945 3.041 -6.548 1.00 0.00 O ATOM 217 CB PRO A 14 164.207 1.729 -7.963 1.00 0.00 C ATOM 218 CG PRO A 14 163.025 1.059 -7.342 1.00 0.00 C ATOM 219 CD PRO A 14 163.543 -0.211 -6.733 1.00 0.00 C ATOM 0 HA PRO A 14 166.273 0.984 -7.740 1.00 0.00 H new ATOM 0 HB2 PRO A 14 164.099 2.813 -7.943 1.00 0.00 H new ATOM 0 HB3 PRO A 14 164.319 1.439 -9.008 1.00 0.00 H new ATOM 0 HG2 PRO A 14 162.568 1.697 -6.585 1.00 0.00 H new ATOM 0 HG3 PRO A 14 162.258 0.850 -8.088 1.00 0.00 H new ATOM 0 HD2 PRO A 14 162.944 -0.524 -5.878 1.00 0.00 H new ATOM 0 HD3 PRO A 14 163.536 -1.035 -7.447 1.00 0.00 H new ATOM 227 N ALA A 15 165.197 2.697 -5.176 1.00 0.00 N ATOM 228 CA ALA A 15 165.579 3.761 -4.260 1.00 0.00 C ATOM 229 C ALA A 15 166.932 3.466 -3.626 1.00 0.00 C ATOM 230 O ALA A 15 167.813 4.324 -3.586 1.00 0.00 O ATOM 231 CB ALA A 15 164.518 3.946 -3.187 1.00 0.00 C ATOM 0 H ALA A 15 164.346 2.199 -4.916 1.00 0.00 H new ATOM 0 HA ALA A 15 165.662 4.688 -4.828 1.00 0.00 H new ATOM 0 HB1 ALA A 15 164.820 4.746 -2.511 1.00 0.00 H new ATOM 0 HB2 ALA A 15 163.569 4.206 -3.655 1.00 0.00 H new ATOM 0 HB3 ALA A 15 164.404 3.019 -2.625 1.00 0.00 H new ATOM 237 N ILE A 16 167.093 2.242 -3.134 1.00 0.00 N ATOM 238 CA ILE A 16 168.340 1.831 -2.503 1.00 0.00 C ATOM 239 C ILE A 16 169.494 1.859 -3.499 1.00 0.00 C ATOM 240 O ILE A 16 170.489 2.553 -3.290 1.00 0.00 O ATOM 241 CB ILE A 16 168.236 0.417 -1.904 1.00 0.00 C ATOM 242 CG1 ILE A 16 166.954 0.283 -1.064 1.00 0.00 C ATOM 243 CG2 ILE A 16 169.482 0.105 -1.083 1.00 0.00 C ATOM 244 CD1 ILE A 16 167.181 0.227 0.434 1.00 0.00 C ATOM 0 H ILE A 16 166.375 1.518 -3.161 1.00 0.00 H new ATOM 0 HA ILE A 16 168.532 2.543 -1.700 1.00 0.00 H new ATOM 0 HB ILE A 16 168.176 -0.312 -2.712 1.00 0.00 H new ATOM 0 HG12 ILE A 16 166.300 1.126 -1.287 1.00 0.00 H new ATOM 0 HG13 ILE A 16 166.427 -0.620 -1.372 1.00 0.00 H new ATOM 0 HG21 ILE A 16 169.399 -0.897 -0.663 1.00 0.00 H new ATOM 0 HG22 ILE A 16 170.363 0.159 -1.723 1.00 0.00 H new ATOM 0 HG23 ILE A 16 169.576 0.830 -0.275 1.00 0.00 H new ATOM 0 HD11 ILE A 16 166.222 0.133 0.944 1.00 0.00 H new ATOM 0 HD12 ILE A 16 167.807 -0.632 0.675 1.00 0.00 H new ATOM 0 HD13 ILE A 16 167.678 1.141 0.761 1.00 0.00 H new ATOM 256 N ARG A 17 169.357 1.096 -4.580 1.00 0.00 N ATOM 257 CA ARG A 17 170.391 1.029 -5.610 1.00 0.00 C ATOM 258 C ARG A 17 170.866 2.426 -6.005 1.00 0.00 C ATOM 259 O ARG A 17 172.022 2.615 -6.381 1.00 0.00 O ATOM 260 CB ARG A 17 169.874 0.280 -6.842 1.00 0.00 C ATOM 261 CG ARG A 17 168.828 1.045 -7.634 1.00 0.00 C ATOM 262 CD ARG A 17 168.390 0.276 -8.869 1.00 0.00 C ATOM 263 NE ARG A 17 169.409 0.291 -9.917 1.00 0.00 N ATOM 264 CZ ARG A 17 169.163 0.011 -11.195 1.00 0.00 C ATOM 265 NH1 ARG A 17 167.935 -0.307 -11.586 1.00 0.00 N ATOM 266 NH2 ARG A 17 170.145 0.050 -12.084 1.00 0.00 N ATOM 0 H ARG A 17 168.540 0.515 -4.766 1.00 0.00 H new ATOM 0 HA ARG A 17 171.240 0.484 -5.196 1.00 0.00 H new ATOM 0 HB2 ARG A 17 170.716 0.052 -7.496 1.00 0.00 H new ATOM 0 HB3 ARG A 17 169.450 -0.673 -6.524 1.00 0.00 H new ATOM 0 HG2 ARG A 17 167.963 1.241 -7.001 1.00 0.00 H new ATOM 0 HG3 ARG A 17 169.232 2.013 -7.931 1.00 0.00 H new ATOM 0 HD2 ARG A 17 168.169 -0.755 -8.594 1.00 0.00 H new ATOM 0 HD3 ARG A 17 167.467 0.708 -9.256 1.00 0.00 H new ATOM 0 HE ARG A 17 170.365 0.530 -9.653 1.00 0.00 H new ATOM 0 HH11 ARG A 17 167.175 -0.338 -10.906 1.00 0.00 H new ATOM 0 HH12 ARG A 17 167.751 -0.521 -12.566 1.00 0.00 H new ATOM 0 HH21 ARG A 17 171.090 0.295 -11.789 1.00 0.00 H new ATOM 0 HH22 ARG A 17 169.956 -0.165 -13.063 1.00 0.00 H new ATOM 280 N GLN A 18 169.966 3.400 -5.913 1.00 0.00 N ATOM 281 CA GLN A 18 170.296 4.779 -6.258 1.00 0.00 C ATOM 282 C GLN A 18 171.242 5.388 -5.228 1.00 0.00 C ATOM 283 O GLN A 18 172.301 5.910 -5.575 1.00 0.00 O ATOM 284 CB GLN A 18 169.022 5.620 -6.359 1.00 0.00 C ATOM 285 CG GLN A 18 169.203 6.906 -7.146 1.00 0.00 C ATOM 286 CD GLN A 18 170.142 7.881 -6.465 1.00 0.00 C ATOM 287 OE1 GLN A 18 171.149 8.297 -7.038 1.00 0.00 O ATOM 288 NE2 GLN A 18 169.818 8.250 -5.231 1.00 0.00 N ATOM 0 H GLN A 18 169.004 3.261 -5.603 1.00 0.00 H new ATOM 0 HA GLN A 18 170.798 4.774 -7.226 1.00 0.00 H new ATOM 0 HB2 GLN A 18 168.239 5.024 -6.828 1.00 0.00 H new ATOM 0 HB3 GLN A 18 168.677 5.864 -5.354 1.00 0.00 H new ATOM 0 HG2 GLN A 18 169.588 6.669 -8.138 1.00 0.00 H new ATOM 0 HG3 GLN A 18 168.232 7.381 -7.287 1.00 0.00 H new ATOM 0 HE21 GLN A 18 168.974 7.881 -4.793 1.00 0.00 H new ATOM 0 HE22 GLN A 18 170.413 8.903 -4.721 1.00 0.00 H new ATOM 297 N HIS A 19 170.852 5.320 -3.959 1.00 0.00 N ATOM 298 CA HIS A 19 171.664 5.868 -2.876 1.00 0.00 C ATOM 299 C HIS A 19 173.029 5.185 -2.814 1.00 0.00 C ATOM 300 O HIS A 19 174.065 5.849 -2.847 1.00 0.00 O ATOM 301 CB HIS A 19 170.941 5.707 -1.536 1.00 0.00 C ATOM 302 CG HIS A 19 170.223 6.943 -1.083 1.00 0.00 C ATOM 303 ND1 HIS A 19 169.549 7.786 -1.943 1.00 0.00 N ATOM 304 CD2 HIS A 19 170.070 7.476 0.156 1.00 0.00 C ATOM 305 CE1 HIS A 19 169.015 8.781 -1.253 1.00 0.00 C ATOM 306 NE2 HIS A 19 169.317 8.615 0.020 1.00 0.00 N ATOM 0 H HIS A 19 169.978 4.891 -3.654 1.00 0.00 H new ATOM 0 HA HIS A 19 171.818 6.929 -3.075 1.00 0.00 H new ATOM 0 HB2 HIS A 19 170.224 4.890 -1.617 1.00 0.00 H new ATOM 0 HB3 HIS A 19 171.666 5.420 -0.775 1.00 0.00 H new ATOM 0 HD2 HIS A 19 170.467 7.077 1.078 1.00 0.00 H new ATOM 0 HE1 HIS A 19 168.431 9.592 -1.663 1.00 0.00 H new ATOM 0 HE2 HIS A 19 169.036 9.234 0.781 1.00 0.00 H new ATOM 315 N VAL A 20 173.024 3.858 -2.719 1.00 0.00 N ATOM 316 CA VAL A 20 174.265 3.091 -2.647 1.00 0.00 C ATOM 317 C VAL A 20 175.155 3.360 -3.855 1.00 0.00 C ATOM 318 O VAL A 20 176.353 3.602 -3.713 1.00 0.00 O ATOM 319 CB VAL A 20 173.992 1.576 -2.552 1.00 0.00 C ATOM 320 CG1 VAL A 20 173.354 1.227 -1.216 1.00 0.00 C ATOM 321 CG2 VAL A 20 173.118 1.115 -3.708 1.00 0.00 C ATOM 0 H VAL A 20 172.176 3.292 -2.690 1.00 0.00 H new ATOM 0 HA VAL A 20 174.778 3.417 -1.742 1.00 0.00 H new ATOM 0 HB VAL A 20 174.945 1.051 -2.618 1.00 0.00 H new ATOM 0 HG11 VAL A 20 173.170 0.154 -1.170 1.00 0.00 H new ATOM 0 HG12 VAL A 20 174.024 1.515 -0.406 1.00 0.00 H new ATOM 0 HG13 VAL A 20 172.410 1.762 -1.113 1.00 0.00 H new ATOM 0 HG21 VAL A 20 172.937 0.044 -3.623 1.00 0.00 H new ATOM 0 HG22 VAL A 20 172.167 1.647 -3.680 1.00 0.00 H new ATOM 0 HG23 VAL A 20 173.623 1.324 -4.651 1.00 0.00 H new ATOM 331 N ALA A 21 174.564 3.319 -5.045 1.00 0.00 N ATOM 332 CA ALA A 21 175.308 3.559 -6.276 1.00 0.00 C ATOM 333 C ALA A 21 175.847 4.984 -6.318 1.00 0.00 C ATOM 334 O ALA A 21 176.894 5.248 -6.908 1.00 0.00 O ATOM 335 CB ALA A 21 174.430 3.287 -7.486 1.00 0.00 C ATOM 0 H ALA A 21 173.573 3.122 -5.183 1.00 0.00 H new ATOM 0 HA ALA A 21 176.157 2.875 -6.299 1.00 0.00 H new ATOM 0 HB1 ALA A 21 174.999 3.471 -8.397 1.00 0.00 H new ATOM 0 HB2 ALA A 21 174.098 2.249 -7.469 1.00 0.00 H new ATOM 0 HB3 ALA A 21 173.562 3.946 -7.461 1.00 0.00 H new ATOM 341 N ASP A 22 175.122 5.902 -5.683 1.00 0.00 N ATOM 342 CA ASP A 22 175.527 7.301 -5.645 1.00 0.00 C ATOM 343 C ASP A 22 176.793 7.480 -4.813 1.00 0.00 C ATOM 344 O ASP A 22 177.624 8.339 -5.106 1.00 0.00 O ATOM 345 CB ASP A 22 174.400 8.163 -5.073 1.00 0.00 C ATOM 346 CG ASP A 22 174.637 9.644 -5.290 1.00 0.00 C ATOM 347 OD1 ASP A 22 175.255 10.003 -6.312 1.00 0.00 O ATOM 348 OD2 ASP A 22 174.202 10.445 -4.436 1.00 0.00 O ATOM 0 H ASP A 22 174.253 5.701 -5.189 1.00 0.00 H new ATOM 0 HA ASP A 22 175.738 7.620 -6.666 1.00 0.00 H new ATOM 0 HB2 ASP A 22 173.456 7.877 -5.538 1.00 0.00 H new ATOM 0 HB3 ASP A 22 174.302 7.966 -4.005 1.00 0.00 H new ATOM 353 N ARG A 23 176.934 6.662 -3.773 1.00 0.00 N ATOM 354 CA ARG A 23 178.099 6.733 -2.900 1.00 0.00 C ATOM 355 C ARG A 23 179.335 6.175 -3.602 1.00 0.00 C ATOM 356 O ARG A 23 180.291 6.904 -3.863 1.00 0.00 O ATOM 357 CB ARG A 23 177.834 5.961 -1.599 1.00 0.00 C ATOM 358 CG ARG A 23 179.097 5.491 -0.889 1.00 0.00 C ATOM 359 CD ARG A 23 178.842 5.202 0.580 1.00 0.00 C ATOM 360 NE ARG A 23 178.743 3.769 0.850 1.00 0.00 N ATOM 361 CZ ARG A 23 177.635 3.051 0.672 1.00 0.00 C ATOM 362 NH1 ARG A 23 176.526 3.627 0.223 1.00 0.00 N ATOM 363 NH2 ARG A 23 177.635 1.753 0.946 1.00 0.00 N ATOM 0 H ARG A 23 176.257 5.944 -3.516 1.00 0.00 H new ATOM 0 HA ARG A 23 178.284 7.780 -2.658 1.00 0.00 H new ATOM 0 HB2 ARG A 23 177.264 6.596 -0.921 1.00 0.00 H new ATOM 0 HB3 ARG A 23 177.212 5.095 -1.823 1.00 0.00 H new ATOM 0 HG2 ARG A 23 179.475 4.592 -1.376 1.00 0.00 H new ATOM 0 HG3 ARG A 23 179.871 6.253 -0.981 1.00 0.00 H new ATOM 0 HD2 ARG A 23 179.648 5.628 1.178 1.00 0.00 H new ATOM 0 HD3 ARG A 23 177.920 5.693 0.891 1.00 0.00 H new ATOM 0 HE ARG A 23 179.574 3.289 1.196 1.00 0.00 H new ATOM 0 HH11 ARG A 23 176.519 4.625 0.012 1.00 0.00 H new ATOM 0 HH12 ARG A 23 175.681 3.071 0.089 1.00 0.00 H new ATOM 0 HH21 ARG A 23 178.483 1.305 1.293 1.00 0.00 H new ATOM 0 HH22 ARG A 23 176.787 1.203 0.810 1.00 0.00 H new ATOM 377 N LEU A 24 179.307 4.879 -3.898 1.00 0.00 N ATOM 378 CA LEU A 24 180.427 4.216 -4.563 1.00 0.00 C ATOM 379 C LEU A 24 180.901 5.009 -5.778 1.00 0.00 C ATOM 380 O LEU A 24 182.098 5.082 -6.055 1.00 0.00 O ATOM 381 CB LEU A 24 180.028 2.798 -4.982 1.00 0.00 C ATOM 382 CG LEU A 24 180.891 1.683 -4.385 1.00 0.00 C ATOM 383 CD1 LEU A 24 180.033 0.482 -4.012 1.00 0.00 C ATOM 384 CD2 LEU A 24 181.983 1.275 -5.363 1.00 0.00 C ATOM 0 H LEU A 24 178.520 4.265 -3.688 1.00 0.00 H new ATOM 0 HA LEU A 24 181.253 4.161 -3.854 1.00 0.00 H new ATOM 0 HB2 LEU A 24 178.990 2.628 -4.694 1.00 0.00 H new ATOM 0 HB3 LEU A 24 180.073 2.730 -6.069 1.00 0.00 H new ATOM 0 HG LEU A 24 181.363 2.062 -3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 24 180.665 -0.299 -3.590 1.00 0.00 H new ATOM 0 HD12 LEU A 24 179.287 0.782 -3.277 1.00 0.00 H new ATOM 0 HD13 LEU A 24 179.532 0.102 -4.902 1.00 0.00 H new ATOM 0 HD21 LEU A 24 182.587 0.482 -4.923 1.00 0.00 H new ATOM 0 HD22 LEU A 24 181.529 0.916 -6.286 1.00 0.00 H new ATOM 0 HD23 LEU A 24 182.616 2.135 -5.581 1.00 0.00 H new ATOM 396 N ALA A 25 179.955 5.601 -6.498 1.00 0.00 N ATOM 397 CA ALA A 25 180.279 6.388 -7.680 1.00 0.00 C ATOM 398 C ALA A 25 181.132 7.598 -7.315 1.00 0.00 C ATOM 399 O ALA A 25 182.257 7.744 -7.796 1.00 0.00 O ATOM 400 CB ALA A 25 179.005 6.829 -8.384 1.00 0.00 C ATOM 0 H ALA A 25 178.959 5.551 -6.284 1.00 0.00 H new ATOM 0 HA ALA A 25 180.857 5.761 -8.359 1.00 0.00 H new ATOM 0 HB1 ALA A 25 179.261 7.416 -9.266 1.00 0.00 H new ATOM 0 HB2 ALA A 25 178.434 5.951 -8.686 1.00 0.00 H new ATOM 0 HB3 ALA A 25 178.406 7.436 -7.705 1.00 0.00 H new ATOM 406 N LYS A 26 180.592 8.462 -6.463 1.00 0.00 N ATOM 407 CA LYS A 26 181.302 9.661 -6.036 1.00 0.00 C ATOM 408 C LYS A 26 182.513 9.310 -5.173 1.00 0.00 C ATOM 409 O LYS A 26 183.482 10.067 -5.111 1.00 0.00 O ATOM 410 CB LYS A 26 180.362 10.588 -5.264 1.00 0.00 C ATOM 411 CG LYS A 26 179.365 11.317 -6.150 1.00 0.00 C ATOM 412 CD LYS A 26 180.054 12.342 -7.037 1.00 0.00 C ATOM 413 CE LYS A 26 179.072 13.000 -7.994 1.00 0.00 C ATOM 414 NZ LYS A 26 178.504 12.025 -8.965 1.00 0.00 N ATOM 0 H LYS A 26 179.664 8.354 -6.054 1.00 0.00 H new ATOM 0 HA LYS A 26 181.658 10.174 -6.929 1.00 0.00 H new ATOM 0 HB2 LYS A 26 179.817 10.004 -4.522 1.00 0.00 H new ATOM 0 HB3 LYS A 26 180.956 11.322 -4.719 1.00 0.00 H new ATOM 0 HG2 LYS A 26 178.833 10.596 -6.771 1.00 0.00 H new ATOM 0 HG3 LYS A 26 178.620 11.814 -5.529 1.00 0.00 H new ATOM 0 HD2 LYS A 26 180.525 13.104 -6.416 1.00 0.00 H new ATOM 0 HD3 LYS A 26 180.848 11.858 -7.605 1.00 0.00 H new ATOM 0 HE2 LYS A 26 178.263 13.459 -7.425 1.00 0.00 H new ATOM 0 HE3 LYS A 26 179.575 13.801 -8.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 178.048 12.538 -9.746 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 179.266 11.427 -9.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 177.800 11.428 -8.486 1.00 0.00 H new ATOM 428 N LEU A 27 182.452 8.159 -4.509 1.00 0.00 N ATOM 429 CA LEU A 27 183.548 7.716 -3.651 1.00 0.00 C ATOM 430 C LEU A 27 184.857 7.630 -4.434 1.00 0.00 C ATOM 431 O LEU A 27 185.942 7.685 -3.853 1.00 0.00 O ATOM 432 CB LEU A 27 183.221 6.353 -3.029 1.00 0.00 C ATOM 433 CG LEU A 27 183.350 6.289 -1.507 1.00 0.00 C ATOM 434 CD1 LEU A 27 184.795 6.510 -1.082 1.00 0.00 C ATOM 435 CD2 LEU A 27 182.438 7.317 -0.852 1.00 0.00 C ATOM 0 H LEU A 27 181.659 7.518 -4.548 1.00 0.00 H new ATOM 0 HA LEU A 27 183.670 8.451 -2.856 1.00 0.00 H new ATOM 0 HB2 LEU A 27 182.202 6.080 -3.304 1.00 0.00 H new ATOM 0 HB3 LEU A 27 183.881 5.603 -3.466 1.00 0.00 H new ATOM 0 HG LEU A 27 183.044 5.296 -1.178 1.00 0.00 H new ATOM 0 HD11 LEU A 27 184.866 6.461 0.005 1.00 0.00 H new ATOM 0 HD12 LEU A 27 185.426 5.738 -1.522 1.00 0.00 H new ATOM 0 HD13 LEU A 27 185.129 7.490 -1.423 1.00 0.00 H new ATOM 0 HD21 LEU A 27 182.542 7.258 0.231 1.00 0.00 H new ATOM 0 HD22 LEU A 27 182.714 8.316 -1.189 1.00 0.00 H new ATOM 0 HD23 LEU A 27 181.403 7.114 -1.129 1.00 0.00 H new ATOM 447 N GLU A 28 184.752 7.493 -5.753 1.00 0.00 N ATOM 448 CA GLU A 28 185.933 7.400 -6.607 1.00 0.00 C ATOM 449 C GLU A 28 186.854 8.602 -6.404 1.00 0.00 C ATOM 450 O GLU A 28 188.054 8.527 -6.666 1.00 0.00 O ATOM 451 CB GLU A 28 185.517 7.300 -8.077 1.00 0.00 C ATOM 452 CG GLU A 28 185.860 5.965 -8.715 1.00 0.00 C ATOM 453 CD GLU A 28 184.910 5.592 -9.835 1.00 0.00 C ATOM 454 OE1 GLU A 28 183.776 6.113 -9.849 1.00 0.00 O ATOM 455 OE2 GLU A 28 185.301 4.778 -10.700 1.00 0.00 O ATOM 0 H GLU A 28 183.864 7.444 -6.253 1.00 0.00 H new ATOM 0 HA GLU A 28 186.481 6.500 -6.329 1.00 0.00 H new ATOM 0 HB2 GLU A 28 184.442 7.465 -8.154 1.00 0.00 H new ATOM 0 HB3 GLU A 28 186.003 8.098 -8.639 1.00 0.00 H new ATOM 0 HG2 GLU A 28 186.877 6.004 -9.104 1.00 0.00 H new ATOM 0 HG3 GLU A 28 185.840 5.186 -7.952 1.00 0.00 H new ATOM 462 N LYS A 29 186.285 9.709 -5.936 1.00 0.00 N ATOM 463 CA LYS A 29 187.057 10.922 -5.698 1.00 0.00 C ATOM 464 C LYS A 29 187.082 11.268 -4.210 1.00 0.00 C ATOM 465 O LYS A 29 186.924 12.426 -3.827 1.00 0.00 O ATOM 466 CB LYS A 29 186.472 12.086 -6.505 1.00 0.00 C ATOM 467 CG LYS A 29 187.433 12.646 -7.543 1.00 0.00 C ATOM 468 CD LYS A 29 187.806 14.088 -7.240 1.00 0.00 C ATOM 469 CE LYS A 29 188.487 14.216 -5.886 1.00 0.00 C ATOM 470 NZ LYS A 29 189.525 13.169 -5.685 1.00 0.00 N ATOM 0 H LYS A 29 185.293 9.790 -5.715 1.00 0.00 H new ATOM 0 HA LYS A 29 188.082 10.746 -6.023 1.00 0.00 H new ATOM 0 HB2 LYS A 29 185.564 11.751 -7.005 1.00 0.00 H new ATOM 0 HB3 LYS A 29 186.183 12.884 -5.821 1.00 0.00 H new ATOM 0 HG2 LYS A 29 188.335 12.035 -7.572 1.00 0.00 H new ATOM 0 HG3 LYS A 29 186.977 12.588 -8.531 1.00 0.00 H new ATOM 0 HD2 LYS A 29 188.469 14.464 -8.019 1.00 0.00 H new ATOM 0 HD3 LYS A 29 186.910 14.708 -7.257 1.00 0.00 H new ATOM 0 HE2 LYS A 29 188.945 15.202 -5.802 1.00 0.00 H new ATOM 0 HE3 LYS A 29 187.740 14.143 -5.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 190.331 13.574 -5.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 189.122 12.381 -5.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 189.848 12.819 -6.609 1.00 0.00 H new ATOM 484 N TRP A 30 187.283 10.253 -3.377 1.00 0.00 N ATOM 485 CA TRP A 30 187.329 10.445 -1.932 1.00 0.00 C ATOM 486 C TRP A 30 188.738 10.213 -1.394 1.00 0.00 C ATOM 487 O TRP A 30 188.916 9.710 -0.287 1.00 0.00 O ATOM 488 CB TRP A 30 186.344 9.499 -1.241 1.00 0.00 C ATOM 489 CG TRP A 30 185.257 10.214 -0.497 1.00 0.00 C ATOM 490 CD1 TRP A 30 184.010 10.516 -0.961 1.00 0.00 C ATOM 491 CD2 TRP A 30 185.321 10.713 0.843 1.00 0.00 C ATOM 492 NE1 TRP A 30 183.293 11.172 0.009 1.00 0.00 N ATOM 493 CE2 TRP A 30 184.076 11.305 1.126 1.00 0.00 C ATOM 494 CE3 TRP A 30 186.311 10.716 1.830 1.00 0.00 C ATOM 495 CZ2 TRP A 30 183.796 11.894 2.356 1.00 0.00 C ATOM 496 CZ3 TRP A 30 186.029 11.301 3.051 1.00 0.00 C ATOM 497 CH2 TRP A 30 184.782 11.882 3.305 1.00 0.00 C ATOM 0 H TRP A 30 187.417 9.288 -3.678 1.00 0.00 H new ATOM 0 HA TRP A 30 187.045 11.476 -1.719 1.00 0.00 H new ATOM 0 HB2 TRP A 30 185.894 8.845 -1.988 1.00 0.00 H new ATOM 0 HB3 TRP A 30 186.890 8.861 -0.547 1.00 0.00 H new ATOM 0 HD1 TRP A 30 183.641 10.274 -1.947 1.00 0.00 H new ATOM 0 HE1 TRP A 30 182.334 11.506 -0.086 1.00 0.00 H new ATOM 0 HE3 TRP A 30 187.277 10.270 1.643 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 182.835 12.344 2.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 186.785 11.309 3.822 1.00 0.00 H new ATOM 0 HH2 TRP A 30 184.594 12.330 4.269 1.00 0.00 H new ATOM 508 N GLN A 31 189.739 10.572 -2.191 1.00 0.00 N ATOM 509 CA GLN A 31 191.134 10.399 -1.796 1.00 0.00 C ATOM 510 C GLN A 31 191.480 8.927 -1.550 1.00 0.00 C ATOM 511 O GLN A 31 192.610 8.606 -1.182 1.00 0.00 O ATOM 512 CB GLN A 31 191.432 11.218 -0.538 1.00 0.00 C ATOM 513 CG GLN A 31 191.597 12.705 -0.807 1.00 0.00 C ATOM 514 CD GLN A 31 190.350 13.499 -0.475 1.00 0.00 C ATOM 515 OE1 GLN A 31 189.851 14.266 -1.299 1.00 0.00 O ATOM 516 NE2 GLN A 31 189.839 13.319 0.738 1.00 0.00 N ATOM 0 H GLN A 31 189.611 10.985 -3.115 1.00 0.00 H new ATOM 0 HA GLN A 31 191.753 10.754 -2.620 1.00 0.00 H new ATOM 0 HB2 GLN A 31 190.624 11.074 0.179 1.00 0.00 H new ATOM 0 HB3 GLN A 31 192.342 10.838 -0.074 1.00 0.00 H new ATOM 0 HG2 GLN A 31 192.433 13.086 -0.220 1.00 0.00 H new ATOM 0 HG3 GLN A 31 191.850 12.855 -1.857 1.00 0.00 H new ATOM 0 HE21 GLN A 31 190.286 12.673 1.389 1.00 0.00 H new ATOM 0 HE22 GLN A 31 189.000 13.827 1.018 1.00 0.00 H new ATOM 525 N THR A 32 190.513 8.036 -1.757 1.00 0.00 N ATOM 526 CA THR A 32 190.733 6.609 -1.557 1.00 0.00 C ATOM 527 C THR A 32 190.699 5.867 -2.889 1.00 0.00 C ATOM 528 O THR A 32 190.605 6.485 -3.950 1.00 0.00 O ATOM 529 CB THR A 32 189.680 6.038 -0.608 1.00 0.00 C ATOM 530 OG1 THR A 32 188.478 6.782 -0.688 1.00 0.00 O ATOM 531 CG2 THR A 32 190.121 6.029 0.838 1.00 0.00 C ATOM 0 H THR A 32 189.571 8.279 -2.063 1.00 0.00 H new ATOM 0 HA THR A 32 191.719 6.473 -1.112 1.00 0.00 H new ATOM 0 HB THR A 32 189.528 5.008 -0.930 1.00 0.00 H new ATOM 0 HG1 THR A 32 187.736 6.243 -0.343 1.00 0.00 H new ATOM 0 HG21 THR A 32 189.327 5.612 1.458 1.00 0.00 H new ATOM 0 HG22 THR A 32 191.020 5.421 0.941 1.00 0.00 H new ATOM 0 HG23 THR A 32 190.334 7.048 1.160 1.00 0.00 H new ATOM 539 N HIS A 33 190.779 4.542 -2.829 1.00 0.00 N ATOM 540 CA HIS A 33 190.758 3.724 -4.035 1.00 0.00 C ATOM 541 C HIS A 33 189.639 2.688 -3.981 1.00 0.00 C ATOM 542 O HIS A 33 188.943 2.465 -4.971 1.00 0.00 O ATOM 543 CB HIS A 33 192.107 3.025 -4.220 1.00 0.00 C ATOM 544 CG HIS A 33 193.282 3.936 -4.047 1.00 0.00 C ATOM 545 ND1 HIS A 33 193.576 4.960 -4.923 1.00 0.00 N ATOM 546 CD2 HIS A 33 194.243 3.973 -3.093 1.00 0.00 C ATOM 547 CE1 HIS A 33 194.666 5.586 -4.516 1.00 0.00 C ATOM 548 NE2 HIS A 33 195.090 5.008 -3.409 1.00 0.00 N ATOM 0 H HIS A 33 190.859 4.013 -1.960 1.00 0.00 H new ATOM 0 HA HIS A 33 190.572 4.381 -4.884 1.00 0.00 H new ATOM 0 HB2 HIS A 33 192.184 2.206 -3.504 1.00 0.00 H new ATOM 0 HB3 HIS A 33 192.144 2.583 -5.215 1.00 0.00 H new ATOM 0 HD2 HIS A 33 194.328 3.312 -2.243 1.00 0.00 H new ATOM 0 HE1 HIS A 33 195.131 6.428 -5.007 1.00 0.00 H new ATOM 0 HE2 HIS A 33 195.913 5.284 -2.874 1.00 0.00 H new ATOM 557 N LEU A 34 189.476 2.059 -2.821 1.00 0.00 N ATOM 558 CA LEU A 34 188.443 1.043 -2.639 1.00 0.00 C ATOM 559 C LEU A 34 188.685 -0.145 -3.564 1.00 0.00 C ATOM 560 O LEU A 34 189.054 0.027 -4.725 1.00 0.00 O ATOM 561 CB LEU A 34 187.054 1.637 -2.900 1.00 0.00 C ATOM 562 CG LEU A 34 186.456 2.434 -1.738 1.00 0.00 C ATOM 563 CD1 LEU A 34 186.553 1.649 -0.440 1.00 0.00 C ATOM 564 CD2 LEU A 34 187.151 3.782 -1.604 1.00 0.00 C ATOM 0 H LEU A 34 190.045 2.234 -1.993 1.00 0.00 H new ATOM 0 HA LEU A 34 188.489 0.695 -1.607 1.00 0.00 H new ATOM 0 HB2 LEU A 34 187.113 2.287 -3.773 1.00 0.00 H new ATOM 0 HB3 LEU A 34 186.371 0.826 -3.152 1.00 0.00 H new ATOM 0 HG LEU A 34 185.401 2.610 -1.950 1.00 0.00 H new ATOM 0 HD11 LEU A 34 186.122 2.234 0.372 1.00 0.00 H new ATOM 0 HD12 LEU A 34 186.007 0.711 -0.540 1.00 0.00 H new ATOM 0 HD13 LEU A 34 187.599 1.438 -0.220 1.00 0.00 H new ATOM 0 HD21 LEU A 34 186.714 4.336 -0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 34 188.214 3.627 -1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 34 187.024 4.350 -2.526 1.00 0.00 H new ATOM 576 N ILE A 35 188.484 -1.350 -3.041 1.00 0.00 N ATOM 577 CA ILE A 35 188.693 -2.561 -3.829 1.00 0.00 C ATOM 578 C ILE A 35 187.520 -3.528 -3.701 1.00 0.00 C ATOM 579 O ILE A 35 186.934 -3.938 -4.701 1.00 0.00 O ATOM 580 CB ILE A 35 189.987 -3.287 -3.413 1.00 0.00 C ATOM 581 CG1 ILE A 35 191.103 -2.279 -3.126 1.00 0.00 C ATOM 582 CG2 ILE A 35 190.417 -4.264 -4.497 1.00 0.00 C ATOM 583 CD1 ILE A 35 192.369 -2.913 -2.591 1.00 0.00 C ATOM 0 H ILE A 35 188.179 -1.515 -2.082 1.00 0.00 H new ATOM 0 HA ILE A 35 188.777 -2.241 -4.868 1.00 0.00 H new ATOM 0 HB ILE A 35 189.789 -3.847 -2.499 1.00 0.00 H new ATOM 0 HG12 ILE A 35 191.337 -1.738 -4.043 1.00 0.00 H new ATOM 0 HG13 ILE A 35 190.742 -1.545 -2.406 1.00 0.00 H new ATOM 0 HG21 ILE A 35 191.332 -4.769 -4.189 1.00 0.00 H new ATOM 0 HG22 ILE A 35 189.630 -5.002 -4.654 1.00 0.00 H new ATOM 0 HG23 ILE A 35 190.597 -3.722 -5.425 1.00 0.00 H new ATOM 0 HD11 ILE A 35 193.115 -2.139 -2.411 1.00 0.00 H new ATOM 0 HD12 ILE A 35 192.150 -3.431 -1.657 1.00 0.00 H new ATOM 0 HD13 ILE A 35 192.755 -3.626 -3.319 1.00 0.00 H new ATOM 595 N ASN A 36 187.193 -3.904 -2.466 1.00 0.00 N ATOM 596 CA ASN A 36 186.098 -4.840 -2.220 1.00 0.00 C ATOM 597 C ASN A 36 184.911 -4.161 -1.531 1.00 0.00 C ATOM 598 O ASN A 36 184.594 -4.469 -0.382 1.00 0.00 O ATOM 599 CB ASN A 36 186.591 -6.010 -1.366 1.00 0.00 C ATOM 600 CG ASN A 36 187.225 -7.108 -2.199 1.00 0.00 C ATOM 601 OD1 ASN A 36 186.891 -7.283 -3.371 1.00 0.00 O ATOM 602 ND2 ASN A 36 188.141 -7.854 -1.595 1.00 0.00 N ATOM 0 H ASN A 36 187.668 -3.577 -1.624 1.00 0.00 H new ATOM 0 HA ASN A 36 185.757 -5.208 -3.188 1.00 0.00 H new ATOM 0 HB2 ASN A 36 187.316 -5.645 -0.639 1.00 0.00 H new ATOM 0 HB3 ASN A 36 185.754 -6.423 -0.802 1.00 0.00 H new ATOM 0 HD21 ASN A 36 188.600 -8.609 -2.104 1.00 0.00 H new ATOM 0 HD22 ASN A 36 188.386 -7.672 -0.622 1.00 0.00 H new ATOM 609 N PRO A 37 184.230 -3.234 -2.227 1.00 0.00 N ATOM 610 CA PRO A 37 183.068 -2.528 -1.675 1.00 0.00 C ATOM 611 C PRO A 37 181.812 -3.393 -1.694 1.00 0.00 C ATOM 612 O PRO A 37 181.107 -3.455 -2.701 1.00 0.00 O ATOM 613 CB PRO A 37 182.911 -1.343 -2.624 1.00 0.00 C ATOM 614 CG PRO A 37 183.394 -1.862 -3.931 1.00 0.00 C ATOM 615 CD PRO A 37 184.524 -2.803 -3.608 1.00 0.00 C ATOM 0 HA PRO A 37 183.207 -2.247 -0.631 1.00 0.00 H new ATOM 0 HB2 PRO A 37 181.873 -1.014 -2.684 1.00 0.00 H new ATOM 0 HB3 PRO A 37 183.498 -0.486 -2.293 1.00 0.00 H new ATOM 0 HG2 PRO A 37 182.596 -2.378 -4.465 1.00 0.00 H new ATOM 0 HG3 PRO A 37 183.734 -1.049 -4.573 1.00 0.00 H new ATOM 0 HD2 PRO A 37 184.551 -3.649 -4.295 1.00 0.00 H new ATOM 0 HD3 PRO A 37 185.492 -2.306 -3.676 1.00 0.00 H new ATOM 623 N HIS A 38 181.538 -4.063 -0.580 1.00 0.00 N ATOM 624 CA HIS A 38 180.368 -4.928 -0.480 1.00 0.00 C ATOM 625 C HIS A 38 179.191 -4.194 0.159 1.00 0.00 C ATOM 626 O HIS A 38 179.353 -3.482 1.150 1.00 0.00 O ATOM 627 CB HIS A 38 180.703 -6.184 0.325 1.00 0.00 C ATOM 628 CG HIS A 38 180.265 -7.453 -0.338 1.00 0.00 C ATOM 629 ND1 HIS A 38 181.148 -8.359 -0.887 1.00 0.00 N ATOM 630 CD2 HIS A 38 179.028 -7.966 -0.542 1.00 0.00 C ATOM 631 CE1 HIS A 38 180.474 -9.373 -1.401 1.00 0.00 C ATOM 632 NE2 HIS A 38 179.187 -9.159 -1.205 1.00 0.00 N ATOM 0 H HIS A 38 182.109 -4.024 0.265 1.00 0.00 H new ATOM 0 HA HIS A 38 180.079 -5.219 -1.490 1.00 0.00 H new ATOM 0 HB2 HIS A 38 181.780 -6.223 0.491 1.00 0.00 H new ATOM 0 HB3 HIS A 38 180.232 -6.114 1.305 1.00 0.00 H new ATOM 0 HD1 HIS A 38 182.163 -8.262 -0.895 1.00 0.00 H new ATOM 0 HD2 HIS A 38 178.092 -7.521 -0.240 1.00 0.00 H new ATOM 0 HE1 HIS A 38 180.904 -10.231 -1.897 1.00 0.00 H new ATOM 641 N ILE A 39 178.007 -4.379 -0.416 1.00 0.00 N ATOM 642 CA ILE A 39 176.798 -3.743 0.091 1.00 0.00 C ATOM 643 C ILE A 39 175.739 -4.792 0.425 1.00 0.00 C ATOM 644 O ILE A 39 175.071 -5.317 -0.464 1.00 0.00 O ATOM 645 CB ILE A 39 176.221 -2.734 -0.931 1.00 0.00 C ATOM 646 CG1 ILE A 39 177.151 -1.529 -1.072 1.00 0.00 C ATOM 647 CG2 ILE A 39 174.826 -2.278 -0.521 1.00 0.00 C ATOM 648 CD1 ILE A 39 178.513 -1.872 -1.638 1.00 0.00 C ATOM 0 H ILE A 39 177.860 -4.967 -1.237 1.00 0.00 H new ATOM 0 HA ILE A 39 177.069 -3.202 0.998 1.00 0.00 H new ATOM 0 HB ILE A 39 176.145 -3.236 -1.896 1.00 0.00 H new ATOM 0 HG12 ILE A 39 176.676 -0.789 -1.716 1.00 0.00 H new ATOM 0 HG13 ILE A 39 177.280 -1.065 -0.094 1.00 0.00 H new ATOM 0 HG21 ILE A 39 174.444 -1.570 -1.256 1.00 0.00 H new ATOM 0 HG22 ILE A 39 174.162 -3.141 -0.469 1.00 0.00 H new ATOM 0 HG23 ILE A 39 174.873 -1.797 0.456 1.00 0.00 H new ATOM 0 HD11 ILE A 39 179.116 -0.967 -1.708 1.00 0.00 H new ATOM 0 HD12 ILE A 39 179.009 -2.589 -0.983 1.00 0.00 H new ATOM 0 HD13 ILE A 39 178.395 -2.308 -2.630 1.00 0.00 H new ATOM 660 N ILE A 40 175.595 -5.089 1.711 1.00 0.00 N ATOM 661 CA ILE A 40 174.620 -6.074 2.161 1.00 0.00 C ATOM 662 C ILE A 40 173.424 -5.399 2.826 1.00 0.00 C ATOM 663 O ILE A 40 173.482 -5.028 3.999 1.00 0.00 O ATOM 664 CB ILE A 40 175.250 -7.076 3.150 1.00 0.00 C ATOM 665 CG1 ILE A 40 176.543 -7.653 2.568 1.00 0.00 C ATOM 666 CG2 ILE A 40 174.267 -8.190 3.480 1.00 0.00 C ATOM 667 CD1 ILE A 40 177.266 -8.589 3.512 1.00 0.00 C ATOM 0 H ILE A 40 176.141 -4.662 2.460 1.00 0.00 H new ATOM 0 HA ILE A 40 174.282 -6.614 1.276 1.00 0.00 H new ATOM 0 HB ILE A 40 175.491 -6.549 4.073 1.00 0.00 H new ATOM 0 HG12 ILE A 40 176.311 -8.187 1.647 1.00 0.00 H new ATOM 0 HG13 ILE A 40 177.210 -6.833 2.301 1.00 0.00 H new ATOM 0 HG21 ILE A 40 174.729 -8.887 4.179 1.00 0.00 H new ATOM 0 HG22 ILE A 40 173.372 -7.763 3.932 1.00 0.00 H new ATOM 0 HG23 ILE A 40 173.996 -8.718 2.566 1.00 0.00 H new ATOM 0 HD11 ILE A 40 178.173 -8.960 3.034 1.00 0.00 H new ATOM 0 HD12 ILE A 40 177.530 -8.054 4.424 1.00 0.00 H new ATOM 0 HD13 ILE A 40 176.617 -9.429 3.759 1.00 0.00 H new ATOM 679 N LEU A 41 172.343 -5.233 2.069 1.00 0.00 N ATOM 680 CA LEU A 41 171.138 -4.592 2.584 1.00 0.00 C ATOM 681 C LEU A 41 169.994 -5.596 2.728 1.00 0.00 C ATOM 682 O LEU A 41 169.380 -5.996 1.739 1.00 0.00 O ATOM 683 CB LEU A 41 170.720 -3.445 1.662 1.00 0.00 C ATOM 684 CG LEU A 41 169.342 -2.843 1.953 1.00 0.00 C ATOM 685 CD1 LEU A 41 169.460 -1.365 2.291 1.00 0.00 C ATOM 686 CD2 LEU A 41 168.414 -3.050 0.769 1.00 0.00 C ATOM 0 H LEU A 41 172.277 -5.534 1.097 1.00 0.00 H new ATOM 0 HA LEU A 41 171.363 -4.194 3.574 1.00 0.00 H new ATOM 0 HB2 LEU A 41 171.466 -2.654 1.732 1.00 0.00 H new ATOM 0 HB3 LEU A 41 170.732 -3.805 0.633 1.00 0.00 H new ATOM 0 HG LEU A 41 168.919 -3.355 2.817 1.00 0.00 H new ATOM 0 HD11 LEU A 41 168.469 -0.958 2.494 1.00 0.00 H new ATOM 0 HD12 LEU A 41 170.090 -1.242 3.172 1.00 0.00 H new ATOM 0 HD13 LEU A 41 169.905 -0.834 1.450 1.00 0.00 H new ATOM 0 HD21 LEU A 41 167.439 -2.617 0.991 1.00 0.00 H new ATOM 0 HD22 LEU A 41 168.834 -2.565 -0.112 1.00 0.00 H new ATOM 0 HD23 LEU A 41 168.302 -4.117 0.577 1.00 0.00 H new ATOM 698 N SER A 42 169.717 -5.998 3.965 1.00 0.00 N ATOM 699 CA SER A 42 168.651 -6.957 4.243 1.00 0.00 C ATOM 700 C SER A 42 167.509 -6.304 5.014 1.00 0.00 C ATOM 701 O SER A 42 167.629 -5.172 5.484 1.00 0.00 O ATOM 702 CB SER A 42 169.199 -8.139 5.042 1.00 0.00 C ATOM 703 OG SER A 42 170.459 -8.554 4.540 1.00 0.00 O ATOM 0 H SER A 42 170.217 -5.674 4.793 1.00 0.00 H new ATOM 0 HA SER A 42 168.264 -7.312 3.288 1.00 0.00 H new ATOM 0 HB2 SER A 42 169.296 -7.859 6.091 1.00 0.00 H new ATOM 0 HB3 SER A 42 168.495 -8.970 4.998 1.00 0.00 H new ATOM 0 HG SER A 42 171.001 -8.914 5.273 1.00 0.00 H new ATOM 709 N LYS A 43 166.399 -7.027 5.139 1.00 0.00 N ATOM 710 CA LYS A 43 165.235 -6.521 5.856 1.00 0.00 C ATOM 711 C LYS A 43 165.107 -7.173 7.227 1.00 0.00 C ATOM 712 O LYS A 43 164.765 -8.350 7.338 1.00 0.00 O ATOM 713 CB LYS A 43 163.961 -6.766 5.043 1.00 0.00 C ATOM 714 CG LYS A 43 162.694 -6.275 5.729 1.00 0.00 C ATOM 715 CD LYS A 43 161.630 -7.360 5.793 1.00 0.00 C ATOM 716 CE LYS A 43 162.088 -8.548 6.624 1.00 0.00 C ATOM 717 NZ LYS A 43 161.028 -9.587 6.735 1.00 0.00 N ATOM 0 H LYS A 43 166.282 -7.964 4.753 1.00 0.00 H new ATOM 0 HA LYS A 43 165.370 -5.449 5.997 1.00 0.00 H new ATOM 0 HB2 LYS A 43 164.056 -6.270 4.077 1.00 0.00 H new ATOM 0 HB3 LYS A 43 163.866 -7.834 4.845 1.00 0.00 H new ATOM 0 HG2 LYS A 43 162.933 -5.941 6.738 1.00 0.00 H new ATOM 0 HG3 LYS A 43 162.301 -5.412 5.192 1.00 0.00 H new ATOM 0 HD2 LYS A 43 160.715 -6.948 6.220 1.00 0.00 H new ATOM 0 HD3 LYS A 43 161.389 -7.693 4.784 1.00 0.00 H new ATOM 0 HE2 LYS A 43 162.979 -8.985 6.173 1.00 0.00 H new ATOM 0 HE3 LYS A 43 162.369 -8.208 7.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 161.378 -10.380 7.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 160.186 -9.177 7.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 160.778 -9.930 5.786 1.00 0.00 H new ATOM 731 N GLU A 44 165.380 -6.396 8.271 1.00 0.00 N ATOM 732 CA GLU A 44 165.290 -6.898 9.636 1.00 0.00 C ATOM 733 C GLU A 44 163.972 -6.481 10.281 1.00 0.00 C ATOM 734 O GLU A 44 163.456 -5.394 10.011 1.00 0.00 O ATOM 735 CB GLU A 44 166.464 -6.388 10.476 1.00 0.00 C ATOM 736 CG GLU A 44 167.481 -7.464 10.811 1.00 0.00 C ATOM 737 CD GLU A 44 168.421 -7.052 11.927 1.00 0.00 C ATOM 738 OE1 GLU A 44 168.017 -6.218 12.766 1.00 0.00 O ATOM 739 OE2 GLU A 44 169.561 -7.560 11.964 1.00 0.00 O ATOM 0 H GLU A 44 165.664 -5.419 8.197 1.00 0.00 H new ATOM 0 HA GLU A 44 165.331 -7.987 9.596 1.00 0.00 H new ATOM 0 HB2 GLU A 44 166.963 -5.583 9.937 1.00 0.00 H new ATOM 0 HB3 GLU A 44 166.079 -5.961 11.402 1.00 0.00 H new ATOM 0 HG2 GLU A 44 166.958 -8.376 11.100 1.00 0.00 H new ATOM 0 HG3 GLU A 44 168.063 -7.699 9.920 1.00 0.00 H new ATOM 746 N PRO A 45 163.407 -7.346 11.141 1.00 0.00 N ATOM 747 CA PRO A 45 162.148 -7.087 11.832 1.00 0.00 C ATOM 748 C PRO A 45 161.980 -5.629 12.251 1.00 0.00 C ATOM 749 O PRO A 45 160.946 -5.012 11.993 1.00 0.00 O ATOM 750 CB PRO A 45 162.235 -7.973 13.084 1.00 0.00 C ATOM 751 CG PRO A 45 163.415 -8.882 12.896 1.00 0.00 C ATOM 752 CD PRO A 45 163.950 -8.657 11.507 1.00 0.00 C ATOM 0 HA PRO A 45 161.297 -7.298 11.184 1.00 0.00 H new ATOM 0 HB2 PRO A 45 162.356 -7.364 13.980 1.00 0.00 H new ATOM 0 HB3 PRO A 45 161.320 -8.551 13.212 1.00 0.00 H new ATOM 0 HG2 PRO A 45 164.183 -8.671 13.640 1.00 0.00 H new ATOM 0 HG3 PRO A 45 163.121 -9.923 13.028 1.00 0.00 H new ATOM 0 HD2 PRO A 45 165.040 -8.659 11.491 1.00 0.00 H new ATOM 0 HD3 PRO A 45 163.620 -9.435 10.819 1.00 0.00 H new ATOM 760 N GLN A 46 162.990 -5.098 12.929 1.00 0.00 N ATOM 761 CA GLN A 46 162.942 -3.728 13.422 1.00 0.00 C ATOM 762 C GLN A 46 163.747 -2.761 12.552 1.00 0.00 C ATOM 763 O GLN A 46 164.505 -1.940 13.068 1.00 0.00 O ATOM 764 CB GLN A 46 163.458 -3.688 14.860 1.00 0.00 C ATOM 765 CG GLN A 46 162.749 -2.668 15.734 1.00 0.00 C ATOM 766 CD GLN A 46 161.887 -3.314 16.800 1.00 0.00 C ATOM 767 OE1 GLN A 46 162.194 -3.246 17.991 1.00 0.00 O ATOM 768 NE2 GLN A 46 160.799 -3.947 16.377 1.00 0.00 N ATOM 0 H GLN A 46 163.852 -5.596 13.150 1.00 0.00 H new ATOM 0 HA GLN A 46 161.903 -3.401 13.383 1.00 0.00 H new ATOM 0 HB2 GLN A 46 163.345 -4.676 15.305 1.00 0.00 H new ATOM 0 HB3 GLN A 46 164.525 -3.464 14.848 1.00 0.00 H new ATOM 0 HG2 GLN A 46 163.490 -2.026 16.211 1.00 0.00 H new ATOM 0 HG3 GLN A 46 162.128 -2.028 15.108 1.00 0.00 H new ATOM 0 HE21 GLN A 46 160.582 -3.979 15.381 1.00 0.00 H new ATOM 0 HE22 GLN A 46 160.180 -4.401 17.048 1.00 0.00 H new ATOM 777 N GLY A 47 163.563 -2.837 11.235 1.00 0.00 N ATOM 778 CA GLY A 47 164.272 -1.931 10.344 1.00 0.00 C ATOM 779 C GLY A 47 165.174 -2.635 9.347 1.00 0.00 C ATOM 780 O GLY A 47 165.388 -3.844 9.428 1.00 0.00 O ATOM 0 H GLY A 47 162.943 -3.502 10.773 1.00 0.00 H new ATOM 0 HA2 GLY A 47 163.545 -1.328 9.800 1.00 0.00 H new ATOM 0 HA3 GLY A 47 164.872 -1.244 10.941 1.00 0.00 H new ATOM 784 N PHE A 48 165.704 -1.858 8.402 1.00 0.00 N ATOM 785 CA PHE A 48 166.594 -2.384 7.370 1.00 0.00 C ATOM 786 C PHE A 48 168.018 -2.518 7.900 1.00 0.00 C ATOM 787 O PHE A 48 168.452 -1.732 8.742 1.00 0.00 O ATOM 788 CB PHE A 48 166.595 -1.462 6.145 1.00 0.00 C ATOM 789 CG PHE A 48 165.428 -1.655 5.211 1.00 0.00 C ATOM 790 CD1 PHE A 48 164.777 -2.874 5.119 1.00 0.00 C ATOM 791 CD2 PHE A 48 164.989 -0.607 4.415 1.00 0.00 C ATOM 792 CE1 PHE A 48 163.714 -3.047 4.256 1.00 0.00 C ATOM 793 CE2 PHE A 48 163.924 -0.774 3.551 1.00 0.00 C ATOM 794 CZ PHE A 48 163.286 -1.996 3.471 1.00 0.00 C ATOM 0 H PHE A 48 165.530 -0.855 8.331 1.00 0.00 H new ATOM 0 HA PHE A 48 166.227 -3.369 7.082 1.00 0.00 H new ATOM 0 HB2 PHE A 48 166.602 -0.427 6.486 1.00 0.00 H new ATOM 0 HB3 PHE A 48 167.519 -1.621 5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 48 165.106 -3.701 5.731 1.00 0.00 H new ATOM 0 HD2 PHE A 48 165.486 0.350 4.471 1.00 0.00 H new ATOM 0 HE1 PHE A 48 163.218 -4.004 4.195 1.00 0.00 H new ATOM 0 HE2 PHE A 48 163.591 0.051 2.939 1.00 0.00 H new ATOM 0 HZ PHE A 48 162.454 -2.129 2.796 1.00 0.00 H new ATOM 804 N VAL A 49 168.739 -3.516 7.393 1.00 0.00 N ATOM 805 CA VAL A 49 170.118 -3.754 7.806 1.00 0.00 C ATOM 806 C VAL A 49 171.092 -3.429 6.681 1.00 0.00 C ATOM 807 O VAL A 49 171.321 -4.246 5.791 1.00 0.00 O ATOM 808 CB VAL A 49 170.336 -5.216 8.237 1.00 0.00 C ATOM 809 CG1 VAL A 49 171.741 -5.409 8.790 1.00 0.00 C ATOM 810 CG2 VAL A 49 169.294 -5.634 9.261 1.00 0.00 C ATOM 0 H VAL A 49 168.390 -4.173 6.695 1.00 0.00 H new ATOM 0 HA VAL A 49 170.306 -3.098 8.656 1.00 0.00 H new ATOM 0 HB VAL A 49 170.225 -5.851 7.358 1.00 0.00 H new ATOM 0 HG11 VAL A 49 171.875 -6.449 9.089 1.00 0.00 H new ATOM 0 HG12 VAL A 49 172.472 -5.155 8.023 1.00 0.00 H new ATOM 0 HG13 VAL A 49 171.884 -4.762 9.655 1.00 0.00 H new ATOM 0 HG21 VAL A 49 169.466 -6.670 9.553 1.00 0.00 H new ATOM 0 HG22 VAL A 49 169.369 -4.993 10.139 1.00 0.00 H new ATOM 0 HG23 VAL A 49 168.299 -5.539 8.827 1.00 0.00 H new ATOM 820 N ALA A 50 171.672 -2.235 6.728 1.00 0.00 N ATOM 821 CA ALA A 50 172.629 -1.812 5.715 1.00 0.00 C ATOM 822 C ALA A 50 174.046 -2.197 6.121 1.00 0.00 C ATOM 823 O ALA A 50 174.775 -1.394 6.700 1.00 0.00 O ATOM 824 CB ALA A 50 172.529 -0.311 5.488 1.00 0.00 C ATOM 0 H ALA A 50 171.496 -1.544 7.457 1.00 0.00 H new ATOM 0 HA ALA A 50 172.391 -2.321 4.781 1.00 0.00 H new ATOM 0 HB1 ALA A 50 173.250 -0.009 4.728 1.00 0.00 H new ATOM 0 HB2 ALA A 50 171.523 -0.060 5.153 1.00 0.00 H new ATOM 0 HB3 ALA A 50 172.743 0.213 6.420 1.00 0.00 H new ATOM 830 N ASP A 51 174.429 -3.433 5.820 1.00 0.00 N ATOM 831 CA ASP A 51 175.758 -3.926 6.163 1.00 0.00 C ATOM 832 C ASP A 51 176.722 -3.760 4.991 1.00 0.00 C ATOM 833 O ASP A 51 177.035 -4.722 4.291 1.00 0.00 O ATOM 834 CB ASP A 51 175.686 -5.398 6.577 1.00 0.00 C ATOM 835 CG ASP A 51 175.609 -5.571 8.081 1.00 0.00 C ATOM 836 OD1 ASP A 51 176.362 -4.880 8.798 1.00 0.00 O ATOM 837 OD2 ASP A 51 174.793 -6.398 8.542 1.00 0.00 O ATOM 0 H ASP A 51 173.838 -4.112 5.339 1.00 0.00 H new ATOM 0 HA ASP A 51 176.132 -3.337 7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 51 174.813 -5.860 6.115 1.00 0.00 H new ATOM 0 HB3 ASP A 51 176.563 -5.923 6.198 1.00 0.00 H new ATOM 842 N ALA A 52 177.183 -2.531 4.784 1.00 0.00 N ATOM 843 CA ALA A 52 178.107 -2.239 3.696 1.00 0.00 C ATOM 844 C ALA A 52 179.539 -2.106 4.206 1.00 0.00 C ATOM 845 O ALA A 52 179.848 -1.211 4.993 1.00 0.00 O ATOM 846 CB ALA A 52 177.682 -0.969 2.974 1.00 0.00 C ATOM 0 H ALA A 52 176.932 -1.723 5.354 1.00 0.00 H new ATOM 0 HA ALA A 52 178.078 -3.073 2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 52 178.380 -0.761 2.163 1.00 0.00 H new ATOM 0 HB2 ALA A 52 176.680 -1.101 2.566 1.00 0.00 H new ATOM 0 HB3 ALA A 52 177.681 -0.135 3.675 1.00 0.00 H new ATOM 852 N THR A 53 180.408 -2.999 3.748 1.00 0.00 N ATOM 853 CA THR A 53 181.809 -2.986 4.149 1.00 0.00 C ATOM 854 C THR A 53 182.703 -2.649 2.961 1.00 0.00 C ATOM 855 O THR A 53 182.833 -3.440 2.026 1.00 0.00 O ATOM 856 CB THR A 53 182.209 -4.341 4.736 1.00 0.00 C ATOM 857 OG1 THR A 53 181.092 -4.980 5.329 1.00 0.00 O ATOM 858 CG2 THR A 53 183.293 -4.242 5.787 1.00 0.00 C ATOM 0 H THR A 53 180.165 -3.745 3.096 1.00 0.00 H new ATOM 0 HA THR A 53 181.938 -2.219 4.913 1.00 0.00 H new ATOM 0 HB THR A 53 182.593 -4.918 3.895 1.00 0.00 H new ATOM 0 HG1 THR A 53 181.368 -5.845 5.697 1.00 0.00 H new ATOM 0 HG21 THR A 53 183.529 -5.238 6.161 1.00 0.00 H new ATOM 0 HG22 THR A 53 184.186 -3.799 5.348 1.00 0.00 H new ATOM 0 HG23 THR A 53 182.946 -3.618 6.610 1.00 0.00 H new ATOM 866 N ILE A 54 183.309 -1.470 3.001 1.00 0.00 N ATOM 867 CA ILE A 54 184.185 -1.022 1.924 1.00 0.00 C ATOM 868 C ILE A 54 185.651 -1.133 2.329 1.00 0.00 C ATOM 869 O ILE A 54 186.039 -0.689 3.409 1.00 0.00 O ATOM 870 CB ILE A 54 183.878 0.437 1.508 1.00 0.00 C ATOM 871 CG1 ILE A 54 182.586 0.927 2.176 1.00 0.00 C ATOM 872 CG2 ILE A 54 183.773 0.540 -0.008 1.00 0.00 C ATOM 873 CD1 ILE A 54 182.052 2.223 1.606 1.00 0.00 C ATOM 0 H ILE A 54 183.211 -0.805 3.768 1.00 0.00 H new ATOM 0 HA ILE A 54 183.997 -1.675 1.071 1.00 0.00 H new ATOM 0 HB ILE A 54 184.696 1.075 1.843 1.00 0.00 H new ATOM 0 HG12 ILE A 54 181.822 0.156 2.076 1.00 0.00 H new ATOM 0 HG13 ILE A 54 182.768 1.059 3.243 1.00 0.00 H new ATOM 0 HG21 ILE A 54 183.557 1.571 -0.289 1.00 0.00 H new ATOM 0 HG22 ILE A 54 184.716 0.231 -0.460 1.00 0.00 H new ATOM 0 HG23 ILE A 54 182.971 -0.108 -0.362 1.00 0.00 H new ATOM 0 HD11 ILE A 54 181.138 2.502 2.131 1.00 0.00 H new ATOM 0 HD12 ILE A 54 182.796 3.009 1.731 1.00 0.00 H new ATOM 0 HD13 ILE A 54 181.836 2.092 0.546 1.00 0.00 H new ATOM 885 N ASN A 55 186.457 -1.733 1.460 1.00 0.00 N ATOM 886 CA ASN A 55 187.878 -1.907 1.733 1.00 0.00 C ATOM 887 C ASN A 55 188.703 -0.773 1.132 1.00 0.00 C ATOM 888 O ASN A 55 189.042 -0.798 -0.052 1.00 0.00 O ATOM 889 CB ASN A 55 188.363 -3.251 1.186 1.00 0.00 C ATOM 890 CG ASN A 55 189.749 -3.613 1.686 1.00 0.00 C ATOM 891 OD1 ASN A 55 189.932 -3.573 3.001 1.00 0.00 O flip ATOM 892 ND2 ASN A 55 190.644 -3.926 0.901 1.00 0.00 N flip ATOM 0 H ASN A 55 186.151 -2.107 0.562 1.00 0.00 H new ATOM 0 HA ASN A 55 188.013 -1.889 2.814 1.00 0.00 H new ATOM 0 HB2 ASN A 55 187.660 -4.033 1.475 1.00 0.00 H new ATOM 0 HB3 ASN A 55 188.371 -3.215 0.097 1.00 0.00 H new ATOM 0 HD21 ASN A 55 190.460 -3.944 -0.102 1.00 0.00 H new ATOM 0 HD22 ASN A 55 191.570 -4.168 1.254 1.00 0.00 H new ATOM 899 N THR A 56 189.028 0.214 1.961 1.00 0.00 N ATOM 900 CA THR A 56 189.822 1.355 1.522 1.00 0.00 C ATOM 901 C THR A 56 191.306 1.104 1.780 1.00 0.00 C ATOM 902 O THR A 56 191.664 0.236 2.575 1.00 0.00 O ATOM 903 CB THR A 56 189.374 2.626 2.250 1.00 0.00 C ATOM 904 OG1 THR A 56 189.092 2.350 3.610 1.00 0.00 O ATOM 905 CG2 THR A 56 188.141 3.259 1.645 1.00 0.00 C ATOM 0 H THR A 56 188.753 0.246 2.943 1.00 0.00 H new ATOM 0 HA THR A 56 189.669 1.488 0.451 1.00 0.00 H new ATOM 0 HB THR A 56 190.205 3.324 2.152 1.00 0.00 H new ATOM 0 HG1 THR A 56 189.672 1.625 3.924 1.00 0.00 H new ATOM 0 HG21 THR A 56 187.878 4.154 2.208 1.00 0.00 H new ATOM 0 HG22 THR A 56 188.342 3.529 0.608 1.00 0.00 H new ATOM 0 HG23 THR A 56 187.313 2.551 1.682 1.00 0.00 H new ATOM 913 N PRO A 57 192.191 1.861 1.113 1.00 0.00 N ATOM 914 CA PRO A 57 193.641 1.712 1.277 1.00 0.00 C ATOM 915 C PRO A 57 194.084 1.855 2.732 1.00 0.00 C ATOM 916 O PRO A 57 195.166 1.406 3.106 1.00 0.00 O ATOM 917 CB PRO A 57 194.231 2.844 0.424 1.00 0.00 C ATOM 918 CG PRO A 57 193.092 3.770 0.155 1.00 0.00 C ATOM 919 CD PRO A 57 191.859 2.917 0.145 1.00 0.00 C ATOM 0 HA PRO A 57 193.975 0.720 0.974 1.00 0.00 H new ATOM 0 HB2 PRO A 57 195.037 3.355 0.951 1.00 0.00 H new ATOM 0 HB3 PRO A 57 194.652 2.458 -0.505 1.00 0.00 H new ATOM 0 HG2 PRO A 57 193.027 4.541 0.922 1.00 0.00 H new ATOM 0 HG3 PRO A 57 193.221 4.280 -0.799 1.00 0.00 H new ATOM 0 HD2 PRO A 57 190.975 3.479 0.446 1.00 0.00 H new ATOM 0 HD3 PRO A 57 191.656 2.510 -0.845 1.00 0.00 H new ATOM 927 N ASN A 58 193.244 2.486 3.548 1.00 0.00 N ATOM 928 CA ASN A 58 193.560 2.687 4.959 1.00 0.00 C ATOM 929 C ASN A 58 192.869 1.648 5.842 1.00 0.00 C ATOM 930 O ASN A 58 193.092 1.607 7.053 1.00 0.00 O ATOM 931 CB ASN A 58 193.153 4.095 5.403 1.00 0.00 C ATOM 932 CG ASN A 58 193.501 5.155 4.376 1.00 0.00 C ATOM 933 OD1 ASN A 58 192.480 5.744 3.764 1.00 0.00 O flip ATOM 934 ND2 ASN A 58 194.674 5.440 4.134 1.00 0.00 N flip ATOM 0 H ASN A 58 192.343 2.866 3.258 1.00 0.00 H new ATOM 0 HA ASN A 58 194.638 2.569 5.073 1.00 0.00 H new ATOM 0 HB2 ASN A 58 192.080 4.116 5.592 1.00 0.00 H new ATOM 0 HB3 ASN A 58 193.647 4.332 6.345 1.00 0.00 H new ATOM 0 HD21 ASN A 58 195.427 4.962 4.628 1.00 0.00 H new ATOM 0 HD22 ASN A 58 194.892 6.154 3.439 1.00 0.00 H new ATOM 941 N GLY A 59 192.029 0.810 5.239 1.00 0.00 N ATOM 942 CA GLY A 59 191.326 -0.209 6.000 1.00 0.00 C ATOM 943 C GLY A 59 189.916 -0.436 5.497 1.00 0.00 C ATOM 944 O GLY A 59 189.541 0.068 4.441 1.00 0.00 O ATOM 0 H GLY A 59 191.823 0.818 4.240 1.00 0.00 H new ATOM 0 HA2 GLY A 59 191.882 -1.145 5.949 1.00 0.00 H new ATOM 0 HA3 GLY A 59 191.292 0.084 7.049 1.00 0.00 H new ATOM 948 N VAL A 60 189.135 -1.199 6.251 1.00 0.00 N ATOM 949 CA VAL A 60 187.760 -1.494 5.867 1.00 0.00 C ATOM 950 C VAL A 60 186.775 -0.607 6.627 1.00 0.00 C ATOM 951 O VAL A 60 186.788 -0.556 7.856 1.00 0.00 O ATOM 952 CB VAL A 60 187.428 -2.992 6.093 1.00 0.00 C ATOM 953 CG1 VAL A 60 186.396 -3.189 7.200 1.00 0.00 C ATOM 954 CG2 VAL A 60 186.954 -3.635 4.797 1.00 0.00 C ATOM 0 H VAL A 60 189.429 -1.624 7.130 1.00 0.00 H new ATOM 0 HA VAL A 60 187.661 -1.279 4.803 1.00 0.00 H new ATOM 0 HB VAL A 60 188.346 -3.484 6.415 1.00 0.00 H new ATOM 0 HG11 VAL A 60 186.194 -4.253 7.324 1.00 0.00 H new ATOM 0 HG12 VAL A 60 186.782 -2.782 8.134 1.00 0.00 H new ATOM 0 HG13 VAL A 60 185.474 -2.673 6.934 1.00 0.00 H new ATOM 0 HG21 VAL A 60 186.726 -4.686 4.975 1.00 0.00 H new ATOM 0 HG22 VAL A 60 186.059 -3.124 4.443 1.00 0.00 H new ATOM 0 HG23 VAL A 60 187.738 -3.556 4.044 1.00 0.00 H new ATOM 964 N LEU A 61 185.918 0.084 5.882 1.00 0.00 N ATOM 965 CA LEU A 61 184.921 0.962 6.482 1.00 0.00 C ATOM 966 C LEU A 61 183.600 0.225 6.667 1.00 0.00 C ATOM 967 O LEU A 61 182.966 -0.185 5.695 1.00 0.00 O ATOM 968 CB LEU A 61 184.711 2.201 5.611 1.00 0.00 C ATOM 969 CG LEU A 61 185.992 2.844 5.077 1.00 0.00 C ATOM 970 CD1 LEU A 61 185.698 3.659 3.828 1.00 0.00 C ATOM 971 CD2 LEU A 61 186.635 3.713 6.146 1.00 0.00 C ATOM 0 H LEU A 61 185.894 0.053 4.863 1.00 0.00 H new ATOM 0 HA LEU A 61 185.285 1.276 7.460 1.00 0.00 H new ATOM 0 HB2 LEU A 61 184.080 1.929 4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 61 184.164 2.945 6.190 1.00 0.00 H new ATOM 0 HG LEU A 61 186.692 2.052 4.811 1.00 0.00 H new ATOM 0 HD11 LEU A 61 186.621 4.109 3.462 1.00 0.00 H new ATOM 0 HD12 LEU A 61 185.281 3.009 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 61 184.981 4.444 4.066 1.00 0.00 H new ATOM 0 HD21 LEU A 61 187.545 4.163 5.750 1.00 0.00 H new ATOM 0 HD22 LEU A 61 185.941 4.499 6.442 1.00 0.00 H new ATOM 0 HD23 LEU A 61 186.881 3.101 7.013 1.00 0.00 H new ATOM 983 N VAL A 62 183.194 0.053 7.920 1.00 0.00 N ATOM 984 CA VAL A 62 181.951 -0.640 8.228 1.00 0.00 C ATOM 985 C VAL A 62 180.769 0.325 8.220 1.00 0.00 C ATOM 986 O VAL A 62 180.549 1.065 9.180 1.00 0.00 O ATOM 987 CB VAL A 62 182.041 -1.367 9.592 1.00 0.00 C ATOM 988 CG1 VAL A 62 180.682 -1.443 10.279 1.00 0.00 C ATOM 989 CG2 VAL A 62 182.622 -2.761 9.405 1.00 0.00 C ATOM 0 H VAL A 62 183.707 0.384 8.737 1.00 0.00 H new ATOM 0 HA VAL A 62 181.791 -1.387 7.451 1.00 0.00 H new ATOM 0 HB VAL A 62 182.703 -0.789 10.237 1.00 0.00 H new ATOM 0 HG11 VAL A 62 180.785 -1.960 11.233 1.00 0.00 H new ATOM 0 HG12 VAL A 62 180.304 -0.435 10.451 1.00 0.00 H new ATOM 0 HG13 VAL A 62 179.984 -1.989 9.644 1.00 0.00 H new ATOM 0 HG21 VAL A 62 182.681 -3.263 10.371 1.00 0.00 H new ATOM 0 HG22 VAL A 62 181.982 -3.335 8.736 1.00 0.00 H new ATOM 0 HG23 VAL A 62 183.620 -2.684 8.975 1.00 0.00 H new ATOM 999 N ALA A 63 180.014 0.308 7.128 1.00 0.00 N ATOM 1000 CA ALA A 63 178.853 1.175 6.984 1.00 0.00 C ATOM 1001 C ALA A 63 177.582 0.464 7.436 1.00 0.00 C ATOM 1002 O ALA A 63 176.726 0.126 6.620 1.00 0.00 O ATOM 1003 CB ALA A 63 178.719 1.636 5.543 1.00 0.00 C ATOM 0 H ALA A 63 180.187 -0.299 6.327 1.00 0.00 H new ATOM 0 HA ALA A 63 178.996 2.048 7.621 1.00 0.00 H new ATOM 0 HB1 ALA A 63 177.847 2.284 5.448 1.00 0.00 H new ATOM 0 HB2 ALA A 63 179.614 2.187 5.252 1.00 0.00 H new ATOM 0 HB3 ALA A 63 178.600 0.769 4.893 1.00 0.00 H new ATOM 1009 N SER A 64 177.466 0.238 8.740 1.00 0.00 N ATOM 1010 CA SER A 64 176.299 -0.436 9.294 1.00 0.00 C ATOM 1011 C SER A 64 175.195 0.564 9.620 1.00 0.00 C ATOM 1012 O SER A 64 175.346 1.403 10.507 1.00 0.00 O ATOM 1013 CB SER A 64 176.682 -1.220 10.552 1.00 0.00 C ATOM 1014 OG SER A 64 177.880 -1.949 10.353 1.00 0.00 O ATOM 0 H SER A 64 178.165 0.511 9.431 1.00 0.00 H new ATOM 0 HA SER A 64 175.924 -1.131 8.543 1.00 0.00 H new ATOM 0 HB2 SER A 64 176.805 -0.533 11.389 1.00 0.00 H new ATOM 0 HB3 SER A 64 175.876 -1.904 10.817 1.00 0.00 H new ATOM 0 HG SER A 64 178.104 -2.440 11.171 1.00 0.00 H new ATOM 1020 N GLY A 65 174.084 0.466 8.897 1.00 0.00 N ATOM 1021 CA GLY A 65 172.969 1.366 9.123 1.00 0.00 C ATOM 1022 C GLY A 65 171.673 0.624 9.382 1.00 0.00 C ATOM 1023 O GLY A 65 171.268 -0.228 8.591 1.00 0.00 O ATOM 0 H GLY A 65 173.936 -0.221 8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 65 173.192 2.011 9.973 1.00 0.00 H new ATOM 0 HA3 GLY A 65 172.847 2.014 8.255 1.00 0.00 H new ATOM 1027 N LYS A 66 171.020 0.947 10.495 1.00 0.00 N ATOM 1028 CA LYS A 66 169.763 0.303 10.858 1.00 0.00 C ATOM 1029 C LYS A 66 168.626 1.319 10.911 1.00 0.00 C ATOM 1030 O LYS A 66 168.699 2.308 11.640 1.00 0.00 O ATOM 1031 CB LYS A 66 169.900 -0.403 12.210 1.00 0.00 C ATOM 1032 CG LYS A 66 169.373 -1.828 12.208 1.00 0.00 C ATOM 1033 CD LYS A 66 168.605 -2.142 13.483 1.00 0.00 C ATOM 1034 CE LYS A 66 167.333 -1.315 13.587 1.00 0.00 C ATOM 1035 NZ LYS A 66 167.523 -0.103 14.432 1.00 0.00 N ATOM 0 H LYS A 66 171.341 1.651 11.160 1.00 0.00 H new ATOM 0 HA LYS A 66 169.527 -0.437 10.093 1.00 0.00 H new ATOM 0 HB2 LYS A 66 170.951 -0.413 12.500 1.00 0.00 H new ATOM 0 HB3 LYS A 66 169.366 0.172 12.967 1.00 0.00 H new ATOM 0 HG2 LYS A 66 168.723 -1.975 11.345 1.00 0.00 H new ATOM 0 HG3 LYS A 66 170.205 -2.524 12.103 1.00 0.00 H new ATOM 0 HD2 LYS A 66 168.353 -3.202 13.505 1.00 0.00 H new ATOM 0 HD3 LYS A 66 169.239 -1.946 14.348 1.00 0.00 H new ATOM 0 HE2 LYS A 66 167.013 -1.015 12.589 1.00 0.00 H new ATOM 0 HE3 LYS A 66 166.535 -1.928 14.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 166.834 -0.111 15.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 168.487 -0.100 14.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 167.381 0.749 13.853 1.00 0.00 H new ATOM 1049 N HIS A 67 167.575 1.071 10.134 1.00 0.00 N ATOM 1050 CA HIS A 67 166.426 1.970 10.100 1.00 0.00 C ATOM 1051 C HIS A 67 165.315 1.409 9.217 1.00 0.00 C ATOM 1052 O HIS A 67 165.580 0.748 8.214 1.00 0.00 O ATOM 1053 CB HIS A 67 166.848 3.351 9.595 1.00 0.00 C ATOM 1054 CG HIS A 67 165.974 4.460 10.092 1.00 0.00 C ATOM 1055 ND1 HIS A 67 165.018 5.184 9.462 1.00 0.00 N flip ATOM 1056 CD2 HIS A 67 166.027 4.942 11.382 1.00 0.00 C flip ATOM 1057 CE1 HIS A 67 164.519 6.080 10.374 1.00 0.00 C flip ATOM 1058 NE2 HIS A 67 165.143 5.913 11.525 1.00 0.00 N flip ATOM 0 H HIS A 67 167.495 0.259 9.522 1.00 0.00 H new ATOM 0 HA HIS A 67 166.042 2.063 11.116 1.00 0.00 H new ATOM 0 HB2 HIS A 67 167.876 3.543 9.902 1.00 0.00 H new ATOM 0 HB3 HIS A 67 166.836 3.350 8.505 1.00 0.00 H new ATOM 0 HD2 HIS A 67 166.689 4.582 12.156 1.00 0.00 H new ATOM 0 HE1 HIS A 67 163.742 6.804 10.181 1.00 0.00 H new ATOM 0 HE2 HIS A 67 164.972 6.443 12.379 1.00 0.00 H new ATOM 1067 N GLU A 68 164.070 1.679 9.600 1.00 0.00 N ATOM 1068 CA GLU A 68 162.916 1.201 8.845 1.00 0.00 C ATOM 1069 C GLU A 68 162.847 1.857 7.470 1.00 0.00 C ATOM 1070 O GLU A 68 162.525 1.204 6.478 1.00 0.00 O ATOM 1071 CB GLU A 68 161.626 1.476 9.619 1.00 0.00 C ATOM 1072 CG GLU A 68 160.377 0.956 8.923 1.00 0.00 C ATOM 1073 CD GLU A 68 159.633 2.045 8.174 1.00 0.00 C ATOM 1074 OE1 GLU A 68 160.228 2.650 7.259 1.00 0.00 O ATOM 1075 OE2 GLU A 68 158.454 2.292 8.504 1.00 0.00 O ATOM 0 H GLU A 68 163.835 2.226 10.428 1.00 0.00 H new ATOM 0 HA GLU A 68 163.028 0.126 8.705 1.00 0.00 H new ATOM 0 HB2 GLU A 68 161.699 1.019 10.606 1.00 0.00 H new ATOM 0 HB3 GLU A 68 161.526 2.551 9.772 1.00 0.00 H new ATOM 0 HG2 GLU A 68 160.656 0.166 8.226 1.00 0.00 H new ATOM 0 HG3 GLU A 68 159.712 0.509 9.662 1.00 0.00 H new ATOM 1082 N ASP A 69 163.152 3.149 7.418 1.00 0.00 N ATOM 1083 CA ASP A 69 163.121 3.885 6.160 1.00 0.00 C ATOM 1084 C ASP A 69 164.261 3.436 5.250 1.00 0.00 C ATOM 1085 O ASP A 69 165.365 3.156 5.716 1.00 0.00 O ATOM 1086 CB ASP A 69 163.212 5.389 6.415 1.00 0.00 C ATOM 1087 CG ASP A 69 162.168 6.169 5.640 1.00 0.00 C ATOM 1088 OD1 ASP A 69 162.311 6.287 4.405 1.00 0.00 O ATOM 1089 OD2 ASP A 69 161.207 6.662 6.267 1.00 0.00 O ATOM 0 H ASP A 69 163.422 3.706 8.229 1.00 0.00 H new ATOM 0 HA ASP A 69 162.174 3.673 5.664 1.00 0.00 H new ATOM 0 HB2 ASP A 69 163.090 5.582 7.481 1.00 0.00 H new ATOM 0 HB3 ASP A 69 164.205 5.743 6.139 1.00 0.00 H new ATOM 1094 N MET A 70 163.982 3.361 3.955 1.00 0.00 N ATOM 1095 CA MET A 70 164.982 2.935 2.986 1.00 0.00 C ATOM 1096 C MET A 70 166.096 3.974 2.848 1.00 0.00 C ATOM 1097 O MET A 70 167.259 3.676 3.113 1.00 0.00 O ATOM 1098 CB MET A 70 164.304 2.622 1.632 1.00 0.00 C ATOM 1099 CG MET A 70 164.822 3.399 0.423 1.00 0.00 C ATOM 1100 SD MET A 70 163.729 4.754 -0.050 1.00 0.00 S ATOM 1101 CE MET A 70 162.180 3.881 -0.256 1.00 0.00 C ATOM 0 H MET A 70 163.073 3.589 3.552 1.00 0.00 H new ATOM 0 HA MET A 70 165.454 2.020 3.343 1.00 0.00 H new ATOM 0 HB2 MET A 70 164.418 1.557 1.430 1.00 0.00 H new ATOM 0 HB3 MET A 70 163.236 2.815 1.731 1.00 0.00 H new ATOM 0 HG2 MET A 70 165.812 3.797 0.648 1.00 0.00 H new ATOM 0 HG3 MET A 70 164.936 2.718 -0.420 1.00 0.00 H new ATOM 0 HE1 MET A 70 161.622 4.320 -1.083 1.00 0.00 H new ATOM 0 HE2 MET A 70 162.380 2.831 -0.470 1.00 0.00 H new ATOM 0 HE3 MET A 70 161.594 3.959 0.660 1.00 0.00 H new ATOM 1111 N TYR A 71 165.741 5.186 2.436 1.00 0.00 N ATOM 1112 CA TYR A 71 166.730 6.245 2.263 1.00 0.00 C ATOM 1113 C TYR A 71 167.444 6.555 3.572 1.00 0.00 C ATOM 1114 O TYR A 71 168.673 6.626 3.612 1.00 0.00 O ATOM 1115 CB TYR A 71 166.077 7.515 1.702 1.00 0.00 C ATOM 1116 CG TYR A 71 166.053 7.594 0.185 1.00 0.00 C ATOM 1117 CD1 TYR A 71 166.859 6.776 -0.603 1.00 0.00 C ATOM 1118 CD2 TYR A 71 165.220 8.502 -0.460 1.00 0.00 C ATOM 1119 CE1 TYR A 71 166.836 6.861 -1.980 1.00 0.00 C ATOM 1120 CE2 TYR A 71 165.191 8.593 -1.838 1.00 0.00 C ATOM 1121 CZ TYR A 71 166.001 7.771 -2.593 1.00 0.00 C ATOM 1122 OH TYR A 71 165.976 7.859 -3.967 1.00 0.00 O ATOM 0 H TYR A 71 164.783 5.459 2.217 1.00 0.00 H new ATOM 0 HA TYR A 71 167.471 5.888 1.548 1.00 0.00 H new ATOM 0 HB2 TYR A 71 165.054 7.576 2.073 1.00 0.00 H new ATOM 0 HB3 TYR A 71 166.609 8.384 2.090 1.00 0.00 H new ATOM 0 HD1 TYR A 71 167.514 6.062 -0.127 1.00 0.00 H new ATOM 0 HD2 TYR A 71 164.584 9.148 0.127 1.00 0.00 H new ATOM 0 HE1 TYR A 71 167.469 6.218 -2.574 1.00 0.00 H new ATOM 0 HE2 TYR A 71 164.538 9.304 -2.322 1.00 0.00 H new ATOM 0 HH TYR A 71 165.334 8.548 -4.239 1.00 0.00 H new ATOM 1132 N THR A 72 166.680 6.733 4.646 1.00 0.00 N ATOM 1133 CA THR A 72 167.270 7.026 5.947 1.00 0.00 C ATOM 1134 C THR A 72 168.310 5.970 6.301 1.00 0.00 C ATOM 1135 O THR A 72 169.351 6.276 6.885 1.00 0.00 O ATOM 1136 CB THR A 72 166.194 7.082 7.032 1.00 0.00 C ATOM 1137 OG1 THR A 72 165.148 7.963 6.661 1.00 0.00 O ATOM 1138 CG2 THR A 72 166.725 7.542 8.372 1.00 0.00 C ATOM 0 H THR A 72 165.661 6.680 4.642 1.00 0.00 H new ATOM 0 HA THR A 72 167.754 8.001 5.890 1.00 0.00 H new ATOM 0 HB THR A 72 165.830 6.059 7.131 1.00 0.00 H new ATOM 0 HG1 THR A 72 164.470 7.982 7.368 1.00 0.00 H new ATOM 0 HG21 THR A 72 165.913 7.560 9.098 1.00 0.00 H new ATOM 0 HG22 THR A 72 167.500 6.855 8.712 1.00 0.00 H new ATOM 0 HG23 THR A 72 167.145 8.543 8.273 1.00 0.00 H new ATOM 1146 N ALA A 73 168.027 4.724 5.924 1.00 0.00 N ATOM 1147 CA ALA A 73 168.943 3.624 6.184 1.00 0.00 C ATOM 1148 C ALA A 73 170.271 3.864 5.475 1.00 0.00 C ATOM 1149 O ALA A 73 171.311 4.004 6.115 1.00 0.00 O ATOM 1150 CB ALA A 73 168.329 2.306 5.736 1.00 0.00 C ATOM 0 H ALA A 73 167.171 4.455 5.439 1.00 0.00 H new ATOM 0 HA ALA A 73 169.128 3.570 7.257 1.00 0.00 H new ATOM 0 HB1 ALA A 73 169.026 1.493 5.937 1.00 0.00 H new ATOM 0 HB2 ALA A 73 167.402 2.132 6.282 1.00 0.00 H new ATOM 0 HB3 ALA A 73 168.118 2.347 4.667 1.00 0.00 H new ATOM 1156 N ILE A 74 170.221 3.923 4.147 1.00 0.00 N ATOM 1157 CA ILE A 74 171.425 4.164 3.355 1.00 0.00 C ATOM 1158 C ILE A 74 171.980 5.566 3.613 1.00 0.00 C ATOM 1159 O ILE A 74 173.119 5.861 3.260 1.00 0.00 O ATOM 1160 CB ILE A 74 171.188 3.990 1.833 1.00 0.00 C ATOM 1161 CG1 ILE A 74 169.772 4.440 1.429 1.00 0.00 C ATOM 1162 CG2 ILE A 74 171.447 2.547 1.421 1.00 0.00 C ATOM 1163 CD1 ILE A 74 168.840 3.306 1.051 1.00 0.00 C ATOM 0 H ILE A 74 169.368 3.808 3.600 1.00 0.00 H new ATOM 0 HA ILE A 74 172.147 3.412 3.674 1.00 0.00 H new ATOM 0 HB ILE A 74 171.892 4.631 1.303 1.00 0.00 H new ATOM 0 HG12 ILE A 74 169.331 4.997 2.256 1.00 0.00 H new ATOM 0 HG13 ILE A 74 169.849 5.128 0.587 1.00 0.00 H new ATOM 0 HG21 ILE A 74 171.277 2.438 0.350 1.00 0.00 H new ATOM 0 HG22 ILE A 74 172.478 2.282 1.653 1.00 0.00 H new ATOM 0 HG23 ILE A 74 170.771 1.887 1.964 1.00 0.00 H new ATOM 0 HD11 ILE A 74 167.865 3.711 0.780 1.00 0.00 H new ATOM 0 HD12 ILE A 74 169.255 2.761 0.203 1.00 0.00 H new ATOM 0 HD13 ILE A 74 168.729 2.629 1.898 1.00 0.00 H new ATOM 1175 N ASN A 75 171.176 6.425 4.235 1.00 0.00 N ATOM 1176 CA ASN A 75 171.607 7.787 4.540 1.00 0.00 C ATOM 1177 C ASN A 75 172.453 7.811 5.809 1.00 0.00 C ATOM 1178 O ASN A 75 173.436 8.549 5.901 1.00 0.00 O ATOM 1179 CB ASN A 75 170.394 8.705 4.703 1.00 0.00 C ATOM 1180 CG ASN A 75 170.032 9.421 3.416 1.00 0.00 C ATOM 1181 OD1 ASN A 75 170.894 9.699 2.584 1.00 0.00 O ATOM 1182 ND2 ASN A 75 168.750 9.724 3.249 1.00 0.00 N ATOM 0 H ASN A 75 170.227 6.204 4.536 1.00 0.00 H new ATOM 0 HA ASN A 75 172.214 8.147 3.709 1.00 0.00 H new ATOM 0 HB2 ASN A 75 169.540 8.118 5.041 1.00 0.00 H new ATOM 0 HB3 ASN A 75 170.601 9.442 5.479 1.00 0.00 H new ATOM 0 HD21 ASN A 75 168.446 10.207 2.404 1.00 0.00 H new ATOM 0 HD22 ASN A 75 168.069 9.474 3.966 1.00 0.00 H new ATOM 1189 N GLU A 76 172.065 6.999 6.784 1.00 0.00 N ATOM 1190 CA GLU A 76 172.791 6.925 8.046 1.00 0.00 C ATOM 1191 C GLU A 76 174.095 6.151 7.876 1.00 0.00 C ATOM 1192 O GLU A 76 175.104 6.469 8.506 1.00 0.00 O ATOM 1193 CB GLU A 76 171.925 6.258 9.117 1.00 0.00 C ATOM 1194 CG GLU A 76 170.771 7.125 9.593 1.00 0.00 C ATOM 1195 CD GLU A 76 170.065 6.545 10.802 1.00 0.00 C ATOM 1196 OE1 GLU A 76 170.237 5.336 11.067 1.00 0.00 O ATOM 1197 OE2 GLU A 76 169.339 7.299 11.484 1.00 0.00 O ATOM 0 H GLU A 76 171.254 6.384 6.726 1.00 0.00 H new ATOM 0 HA GLU A 76 173.029 7.941 8.362 1.00 0.00 H new ATOM 0 HB2 GLU A 76 171.527 5.324 8.721 1.00 0.00 H new ATOM 0 HB3 GLU A 76 172.552 6.001 9.971 1.00 0.00 H new ATOM 0 HG2 GLU A 76 171.145 8.119 9.838 1.00 0.00 H new ATOM 0 HG3 GLU A 76 170.054 7.246 8.781 1.00 0.00 H new ATOM 1204 N LEU A 77 174.066 5.134 7.021 1.00 0.00 N ATOM 1205 CA LEU A 77 175.246 4.313 6.771 1.00 0.00 C ATOM 1206 C LEU A 77 176.290 5.089 5.964 1.00 0.00 C ATOM 1207 O LEU A 77 177.481 5.033 6.268 1.00 0.00 O ATOM 1208 CB LEU A 77 174.838 3.002 6.071 1.00 0.00 C ATOM 1209 CG LEU A 77 175.473 2.729 4.702 1.00 0.00 C ATOM 1210 CD1 LEU A 77 175.384 1.247 4.362 1.00 0.00 C ATOM 1211 CD2 LEU A 77 174.796 3.563 3.627 1.00 0.00 C ATOM 0 H LEU A 77 173.240 4.859 6.490 1.00 0.00 H new ATOM 0 HA LEU A 77 175.707 4.055 7.725 1.00 0.00 H new ATOM 0 HB2 LEU A 77 175.084 2.171 6.733 1.00 0.00 H new ATOM 0 HB3 LEU A 77 173.755 3.003 5.950 1.00 0.00 H new ATOM 0 HG LEU A 77 176.525 3.011 4.745 1.00 0.00 H new ATOM 0 HD11 LEU A 77 175.839 1.069 3.388 1.00 0.00 H new ATOM 0 HD12 LEU A 77 175.911 0.668 5.120 1.00 0.00 H new ATOM 0 HD13 LEU A 77 174.338 0.942 4.335 1.00 0.00 H new ATOM 0 HD21 LEU A 77 175.259 3.357 2.662 1.00 0.00 H new ATOM 0 HD22 LEU A 77 173.737 3.310 3.583 1.00 0.00 H new ATOM 0 HD23 LEU A 77 174.906 4.621 3.864 1.00 0.00 H new ATOM 1223 N ILE A 78 175.845 5.819 4.941 1.00 0.00 N ATOM 1224 CA ILE A 78 176.764 6.602 4.120 1.00 0.00 C ATOM 1225 C ILE A 78 177.465 7.662 4.961 1.00 0.00 C ATOM 1226 O ILE A 78 178.676 7.856 4.850 1.00 0.00 O ATOM 1227 CB ILE A 78 176.058 7.299 2.934 1.00 0.00 C ATOM 1228 CG1 ILE A 78 174.779 7.999 3.396 1.00 0.00 C ATOM 1229 CG2 ILE A 78 175.755 6.301 1.825 1.00 0.00 C ATOM 1230 CD1 ILE A 78 174.928 9.498 3.541 1.00 0.00 C ATOM 0 H ILE A 78 174.865 5.884 4.664 1.00 0.00 H new ATOM 0 HA ILE A 78 177.490 5.895 3.718 1.00 0.00 H new ATOM 0 HB ILE A 78 176.734 8.056 2.536 1.00 0.00 H new ATOM 0 HG12 ILE A 78 173.982 7.789 2.683 1.00 0.00 H new ATOM 0 HG13 ILE A 78 174.470 7.579 4.353 1.00 0.00 H new ATOM 0 HG21 ILE A 78 175.258 6.813 1.001 1.00 0.00 H new ATOM 0 HG22 ILE A 78 176.686 5.859 1.469 1.00 0.00 H new ATOM 0 HG23 ILE A 78 175.104 5.516 2.210 1.00 0.00 H new ATOM 0 HD11 ILE A 78 173.982 9.927 3.872 1.00 0.00 H new ATOM 0 HD12 ILE A 78 175.703 9.717 4.276 1.00 0.00 H new ATOM 0 HD13 ILE A 78 175.207 9.931 2.580 1.00 0.00 H new ATOM 1242 N ASN A 79 176.696 8.347 5.803 1.00 0.00 N ATOM 1243 CA ASN A 79 177.245 9.386 6.667 1.00 0.00 C ATOM 1244 C ASN A 79 178.359 8.821 7.549 1.00 0.00 C ATOM 1245 O ASN A 79 179.426 9.422 7.683 1.00 0.00 O ATOM 1246 CB ASN A 79 176.127 10.013 7.518 1.00 0.00 C ATOM 1247 CG ASN A 79 176.363 9.896 9.015 1.00 0.00 C ATOM 1248 OD1 ASN A 79 177.068 10.711 9.609 1.00 0.00 O ATOM 1249 ND2 ASN A 79 175.772 8.877 9.630 1.00 0.00 N ATOM 0 H ASN A 79 175.692 8.201 5.905 1.00 0.00 H new ATOM 0 HA ASN A 79 177.679 10.168 6.044 1.00 0.00 H new ATOM 0 HB2 ASN A 79 176.029 11.066 7.255 1.00 0.00 H new ATOM 0 HB3 ASN A 79 175.180 9.533 7.269 1.00 0.00 H new ATOM 0 HD21 ASN A 79 175.895 8.747 10.634 1.00 0.00 H new ATOM 0 HD22 ASN A 79 175.196 8.225 9.098 1.00 0.00 H new ATOM 1256 N LYS A 80 178.103 7.661 8.146 1.00 0.00 N ATOM 1257 CA LYS A 80 179.081 7.014 9.014 1.00 0.00 C ATOM 1258 C LYS A 80 180.394 6.776 8.272 1.00 0.00 C ATOM 1259 O LYS A 80 181.475 7.021 8.809 1.00 0.00 O ATOM 1260 CB LYS A 80 178.533 5.686 9.537 1.00 0.00 C ATOM 1261 CG LYS A 80 177.189 5.816 10.235 1.00 0.00 C ATOM 1262 CD LYS A 80 177.331 5.715 11.746 1.00 0.00 C ATOM 1263 CE LYS A 80 176.378 6.661 12.461 1.00 0.00 C ATOM 1264 NZ LYS A 80 175.781 6.035 13.671 1.00 0.00 N ATOM 0 H LYS A 80 177.226 7.150 8.045 1.00 0.00 H new ATOM 0 HA LYS A 80 179.274 7.677 9.857 1.00 0.00 H new ATOM 0 HB2 LYS A 80 178.435 4.990 8.704 1.00 0.00 H new ATOM 0 HB3 LYS A 80 179.253 5.253 10.231 1.00 0.00 H new ATOM 0 HG2 LYS A 80 176.734 6.772 9.975 1.00 0.00 H new ATOM 0 HG3 LYS A 80 176.516 5.035 9.879 1.00 0.00 H new ATOM 0 HD2 LYS A 80 177.134 4.691 12.063 1.00 0.00 H new ATOM 0 HD3 LYS A 80 178.357 5.946 12.032 1.00 0.00 H new ATOM 0 HE2 LYS A 80 176.912 7.567 12.747 1.00 0.00 H new ATOM 0 HE3 LYS A 80 175.584 6.961 11.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 175.138 6.711 14.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 175.250 5.184 13.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 176.537 5.771 14.335 1.00 0.00 H new ATOM 1278 N LEU A 81 180.293 6.295 7.038 1.00 0.00 N ATOM 1279 CA LEU A 81 181.472 6.023 6.222 1.00 0.00 C ATOM 1280 C LEU A 81 182.302 7.287 6.025 1.00 0.00 C ATOM 1281 O LEU A 81 183.522 7.271 6.182 1.00 0.00 O ATOM 1282 CB LEU A 81 181.057 5.462 4.860 1.00 0.00 C ATOM 1283 CG LEU A 81 180.542 4.022 4.880 1.00 0.00 C ATOM 1284 CD1 LEU A 81 179.647 3.763 3.678 1.00 0.00 C ATOM 1285 CD2 LEU A 81 181.707 3.041 4.903 1.00 0.00 C ATOM 0 H LEU A 81 179.406 6.085 6.580 1.00 0.00 H new ATOM 0 HA LEU A 81 182.080 5.285 6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 81 180.281 6.103 4.442 1.00 0.00 H new ATOM 0 HB3 LEU A 81 181.912 5.516 4.186 1.00 0.00 H new ATOM 0 HG LEU A 81 179.953 3.876 5.785 1.00 0.00 H new ATOM 0 HD11 LEU A 81 179.288 2.734 3.706 1.00 0.00 H new ATOM 0 HD12 LEU A 81 178.797 4.444 3.704 1.00 0.00 H new ATOM 0 HD13 LEU A 81 180.214 3.925 2.761 1.00 0.00 H new ATOM 0 HD21 LEU A 81 181.323 2.021 4.917 1.00 0.00 H new ATOM 0 HD22 LEU A 81 182.322 3.185 4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 81 182.311 3.214 5.794 1.00 0.00 H new ATOM 1297 N GLU A 82 181.631 8.380 5.674 1.00 0.00 N ATOM 1298 CA GLU A 82 182.300 9.657 5.447 1.00 0.00 C ATOM 1299 C GLU A 82 183.212 10.021 6.615 1.00 0.00 C ATOM 1300 O GLU A 82 184.405 10.260 6.432 1.00 0.00 O ATOM 1301 CB GLU A 82 181.268 10.765 5.228 1.00 0.00 C ATOM 1302 CG GLU A 82 180.792 10.877 3.789 1.00 0.00 C ATOM 1303 CD GLU A 82 180.247 12.254 3.460 1.00 0.00 C ATOM 1304 OE1 GLU A 82 179.790 12.949 4.391 1.00 0.00 O ATOM 1305 OE2 GLU A 82 180.278 12.635 2.271 1.00 0.00 O ATOM 0 H GLU A 82 180.620 8.407 5.540 1.00 0.00 H new ATOM 0 HA GLU A 82 182.915 9.556 4.553 1.00 0.00 H new ATOM 0 HB2 GLU A 82 180.409 10.582 5.873 1.00 0.00 H new ATOM 0 HB3 GLU A 82 181.700 11.718 5.534 1.00 0.00 H new ATOM 0 HG2 GLU A 82 181.620 10.648 3.118 1.00 0.00 H new ATOM 0 HG3 GLU A 82 180.018 10.131 3.607 1.00 0.00 H new ATOM 1312 N ARG A 83 182.643 10.064 7.815 1.00 0.00 N ATOM 1313 CA ARG A 83 183.406 10.403 9.010 1.00 0.00 C ATOM 1314 C ARG A 83 184.571 9.432 9.206 1.00 0.00 C ATOM 1315 O ARG A 83 185.715 9.848 9.386 1.00 0.00 O ATOM 1316 CB ARG A 83 182.482 10.412 10.240 1.00 0.00 C ATOM 1317 CG ARG A 83 182.930 9.505 11.381 1.00 0.00 C ATOM 1318 CD ARG A 83 182.029 9.648 12.598 1.00 0.00 C ATOM 1319 NE ARG A 83 181.739 11.047 12.908 1.00 0.00 N ATOM 1320 CZ ARG A 83 180.718 11.728 12.390 1.00 0.00 C ATOM 1321 NH1 ARG A 83 179.889 11.149 11.529 1.00 0.00 N ATOM 1322 NH2 ARG A 83 180.527 12.995 12.733 1.00 0.00 N ATOM 0 H ARG A 83 181.657 9.868 7.986 1.00 0.00 H new ATOM 0 HA ARG A 83 183.826 11.401 8.885 1.00 0.00 H new ATOM 0 HB2 ARG A 83 182.407 11.433 10.614 1.00 0.00 H new ATOM 0 HB3 ARG A 83 181.481 10.113 9.928 1.00 0.00 H new ATOM 0 HG2 ARG A 83 182.926 8.468 11.045 1.00 0.00 H new ATOM 0 HG3 ARG A 83 183.956 9.747 11.657 1.00 0.00 H new ATOM 0 HD2 ARG A 83 181.095 9.115 12.421 1.00 0.00 H new ATOM 0 HD3 ARG A 83 182.506 9.178 13.458 1.00 0.00 H new ATOM 0 HE ARG A 83 182.356 11.531 13.560 1.00 0.00 H new ATOM 0 HH11 ARG A 83 180.032 10.176 11.260 1.00 0.00 H new ATOM 0 HH12 ARG A 83 179.110 11.678 11.137 1.00 0.00 H new ATOM 0 HH21 ARG A 83 181.161 13.446 13.392 1.00 0.00 H new ATOM 0 HH22 ARG A 83 179.746 13.518 12.337 1.00 0.00 H new ATOM 1336 N GLN A 84 184.269 8.138 9.171 1.00 0.00 N ATOM 1337 CA GLN A 84 185.289 7.110 9.346 1.00 0.00 C ATOM 1338 C GLN A 84 186.358 7.207 8.260 1.00 0.00 C ATOM 1339 O GLN A 84 187.535 6.955 8.513 1.00 0.00 O ATOM 1340 CB GLN A 84 184.649 5.720 9.323 1.00 0.00 C ATOM 1341 CG GLN A 84 183.654 5.490 10.449 1.00 0.00 C ATOM 1342 CD GLN A 84 182.609 4.450 10.100 1.00 0.00 C ATOM 1343 OE1 GLN A 84 181.423 4.624 10.382 1.00 0.00 O ATOM 1344 NE2 GLN A 84 183.045 3.356 9.485 1.00 0.00 N ATOM 0 H GLN A 84 183.327 7.776 9.023 1.00 0.00 H new ATOM 0 HA GLN A 84 185.766 7.270 10.313 1.00 0.00 H new ATOM 0 HB2 GLN A 84 184.144 5.578 8.368 1.00 0.00 H new ATOM 0 HB3 GLN A 84 185.434 4.966 9.384 1.00 0.00 H new ATOM 0 HG2 GLN A 84 184.190 5.175 11.344 1.00 0.00 H new ATOM 0 HG3 GLN A 84 183.159 6.431 10.689 1.00 0.00 H new ATOM 0 HE21 GLN A 84 184.037 3.253 9.270 1.00 0.00 H new ATOM 0 HE22 GLN A 84 182.388 2.619 9.228 1.00 0.00 H new ATOM 1353 N LEU A 85 185.939 7.573 7.054 1.00 0.00 N ATOM 1354 CA LEU A 85 186.863 7.700 5.932 1.00 0.00 C ATOM 1355 C LEU A 85 187.942 8.737 6.229 1.00 0.00 C ATOM 1356 O LEU A 85 189.135 8.446 6.142 1.00 0.00 O ATOM 1357 CB LEU A 85 186.102 8.083 4.659 1.00 0.00 C ATOM 1358 CG LEU A 85 186.149 7.039 3.539 1.00 0.00 C ATOM 1359 CD1 LEU A 85 184.778 6.872 2.903 1.00 0.00 C ATOM 1360 CD2 LEU A 85 187.180 7.428 2.490 1.00 0.00 C ATOM 0 H LEU A 85 184.968 7.787 6.828 1.00 0.00 H new ATOM 0 HA LEU A 85 187.347 6.735 5.780 1.00 0.00 H new ATOM 0 HB2 LEU A 85 185.060 8.269 4.919 1.00 0.00 H new ATOM 0 HB3 LEU A 85 186.508 9.020 4.279 1.00 0.00 H new ATOM 0 HG LEU A 85 186.443 6.084 3.974 1.00 0.00 H new ATOM 0 HD11 LEU A 85 184.833 6.126 2.110 1.00 0.00 H new ATOM 0 HD12 LEU A 85 184.064 6.546 3.659 1.00 0.00 H new ATOM 0 HD13 LEU A 85 184.453 7.824 2.484 1.00 0.00 H new ATOM 0 HD21 LEU A 85 187.200 6.675 1.702 1.00 0.00 H new ATOM 0 HD22 LEU A 85 186.916 8.395 2.061 1.00 0.00 H new ATOM 0 HD23 LEU A 85 188.164 7.493 2.954 1.00 0.00 H new ATOM 1372 N ASN A 86 187.515 9.947 6.577 1.00 0.00 N ATOM 1373 CA ASN A 86 188.445 11.030 6.886 1.00 0.00 C ATOM 1374 C ASN A 86 189.457 10.603 7.946 1.00 0.00 C ATOM 1375 O ASN A 86 190.656 10.844 7.808 1.00 0.00 O ATOM 1376 CB ASN A 86 187.680 12.264 7.366 1.00 0.00 C ATOM 1377 CG ASN A 86 186.878 12.915 6.255 1.00 0.00 C ATOM 1378 OD1 ASN A 86 187.361 13.072 5.135 1.00 0.00 O ATOM 1379 ND2 ASN A 86 185.645 13.296 6.564 1.00 0.00 N ATOM 0 H ASN A 86 186.531 10.203 6.652 1.00 0.00 H new ATOM 0 HA ASN A 86 188.988 11.275 5.973 1.00 0.00 H new ATOM 0 HB2 ASN A 86 187.009 11.980 8.176 1.00 0.00 H new ATOM 0 HB3 ASN A 86 188.384 12.989 7.775 1.00 0.00 H new ATOM 0 HD21 ASN A 86 185.056 13.739 5.859 1.00 0.00 H new ATOM 0 HD22 ASN A 86 185.286 13.146 7.507 1.00 0.00 H new ATOM 1386 N LYS A 87 188.965 9.968 9.004 1.00 0.00 N ATOM 1387 CA LYS A 87 189.825 9.508 10.088 1.00 0.00 C ATOM 1388 C LYS A 87 190.879 8.531 9.572 1.00 0.00 C ATOM 1389 O LYS A 87 192.070 8.844 9.546 1.00 0.00 O ATOM 1390 CB LYS A 87 188.988 8.848 11.190 1.00 0.00 C ATOM 1391 CG LYS A 87 189.811 8.135 12.255 1.00 0.00 C ATOM 1392 CD LYS A 87 191.014 8.960 12.687 1.00 0.00 C ATOM 1393 CE LYS A 87 191.869 8.213 13.699 1.00 0.00 C ATOM 1394 NZ LYS A 87 193.325 8.371 13.426 1.00 0.00 N ATOM 0 H LYS A 87 187.975 9.760 9.134 1.00 0.00 H new ATOM 0 HA LYS A 87 190.337 10.375 10.505 1.00 0.00 H new ATOM 0 HB2 LYS A 87 188.374 9.610 11.670 1.00 0.00 H new ATOM 0 HB3 LYS A 87 188.306 8.131 10.733 1.00 0.00 H new ATOM 0 HG2 LYS A 87 189.183 7.928 13.121 1.00 0.00 H new ATOM 0 HG3 LYS A 87 190.150 7.173 11.869 1.00 0.00 H new ATOM 0 HD2 LYS A 87 191.617 9.210 11.814 1.00 0.00 H new ATOM 0 HD3 LYS A 87 190.674 9.901 13.120 1.00 0.00 H new ATOM 0 HE2 LYS A 87 191.647 8.579 14.701 1.00 0.00 H new ATOM 0 HE3 LYS A 87 191.610 7.154 13.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 193.871 7.846 14.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 193.543 7.999 12.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 193.579 9.379 13.468 1.00 0.00 H new ATOM 1408 N LEU A 88 190.434 7.347 9.168 1.00 0.00 N ATOM 1409 CA LEU A 88 191.339 6.321 8.657 1.00 0.00 C ATOM 1410 C LEU A 88 192.198 6.857 7.514 1.00 0.00 C ATOM 1411 O LEU A 88 193.270 6.323 7.230 1.00 0.00 O ATOM 1412 CB LEU A 88 190.541 5.101 8.188 1.00 0.00 C ATOM 1413 CG LEU A 88 190.770 3.826 9.001 1.00 0.00 C ATOM 1414 CD1 LEU A 88 192.251 3.488 9.057 1.00 0.00 C ATOM 1415 CD2 LEU A 88 190.204 3.981 10.404 1.00 0.00 C ATOM 0 H LEU A 88 189.452 7.072 9.184 1.00 0.00 H new ATOM 0 HA LEU A 88 192.004 6.025 9.468 1.00 0.00 H new ATOM 0 HB2 LEU A 88 189.480 5.347 8.218 1.00 0.00 H new ATOM 0 HB3 LEU A 88 190.793 4.900 7.147 1.00 0.00 H new ATOM 0 HG LEU A 88 190.249 3.005 8.508 1.00 0.00 H new ATOM 0 HD11 LEU A 88 192.395 2.578 9.640 1.00 0.00 H new ATOM 0 HD12 LEU A 88 192.628 3.335 8.046 1.00 0.00 H new ATOM 0 HD13 LEU A 88 192.794 4.309 9.526 1.00 0.00 H new ATOM 0 HD21 LEU A 88 190.376 3.065 10.969 1.00 0.00 H new ATOM 0 HD22 LEU A 88 190.697 4.814 10.905 1.00 0.00 H new ATOM 0 HD23 LEU A 88 189.133 4.176 10.345 1.00 0.00 H new ATOM 1427 N GLN A 89 191.726 7.915 6.862 1.00 0.00 N ATOM 1428 CA GLN A 89 192.458 8.515 5.751 1.00 0.00 C ATOM 1429 C GLN A 89 193.745 9.172 6.238 1.00 0.00 C ATOM 1430 O GLN A 89 194.800 9.032 5.617 1.00 0.00 O ATOM 1431 CB GLN A 89 191.586 9.545 5.032 1.00 0.00 C ATOM 1432 CG GLN A 89 192.273 10.205 3.848 1.00 0.00 C ATOM 1433 CD GLN A 89 192.541 9.235 2.715 1.00 0.00 C ATOM 1434 OE1 GLN A 89 191.479 8.791 2.053 1.00 0.00 O flip ATOM 1435 NE2 GLN A 89 193.688 8.888 2.436 1.00 0.00 N flip ATOM 0 H GLN A 89 190.842 8.374 7.083 1.00 0.00 H new ATOM 0 HA GLN A 89 192.719 7.721 5.052 1.00 0.00 H new ATOM 0 HB2 GLN A 89 190.674 9.058 4.687 1.00 0.00 H new ATOM 0 HB3 GLN A 89 191.287 10.315 5.743 1.00 0.00 H new ATOM 0 HG2 GLN A 89 191.652 11.023 3.482 1.00 0.00 H new ATOM 0 HG3 GLN A 89 193.215 10.643 4.177 1.00 0.00 H new ATOM 0 HE21 GLN A 89 194.476 9.254 2.971 1.00 0.00 H new ATOM 0 HE22 GLN A 89 193.851 8.235 1.670 1.00 0.00 H new ATOM 1444 N HIS A 90 193.652 9.890 7.353 1.00 0.00 N ATOM 1445 CA HIS A 90 194.810 10.570 7.924 1.00 0.00 C ATOM 1446 C HIS A 90 195.936 9.584 8.217 1.00 0.00 C ATOM 1447 O HIS A 90 195.953 8.940 9.266 1.00 0.00 O ATOM 1448 CB HIS A 90 194.415 11.306 9.205 1.00 0.00 C ATOM 1449 CG HIS A 90 193.643 12.564 8.959 1.00 0.00 C ATOM 1450 ND1 HIS A 90 193.404 13.505 9.940 1.00 0.00 N ATOM 1451 CD2 HIS A 90 193.056 13.038 7.835 1.00 0.00 C ATOM 1452 CE1 HIS A 90 192.701 14.500 9.429 1.00 0.00 C ATOM 1453 NE2 HIS A 90 192.479 14.243 8.155 1.00 0.00 N ATOM 0 H HIS A 90 192.787 10.016 7.879 1.00 0.00 H new ATOM 0 HA HIS A 90 195.169 11.293 7.192 1.00 0.00 H new ATOM 0 HB2 HIS A 90 193.819 10.639 9.828 1.00 0.00 H new ATOM 0 HB3 HIS A 90 195.316 11.547 9.768 1.00 0.00 H new ATOM 0 HD2 HIS A 90 193.044 12.558 6.867 1.00 0.00 H new ATOM 0 HE1 HIS A 90 192.365 15.376 9.964 1.00 0.00 H new ATOM 0 HE2 HIS A 90 191.962 14.842 7.511 1.00 0.00 H new ATOM 1462 N LYS A 91 196.876 9.472 7.283 1.00 0.00 N ATOM 1463 CA LYS A 91 198.008 8.564 7.442 1.00 0.00 C ATOM 1464 C LYS A 91 198.961 8.672 6.255 1.00 0.00 C ATOM 1465 O LYS A 91 200.020 9.290 6.350 1.00 0.00 O ATOM 1466 CB LYS A 91 197.516 7.123 7.592 1.00 0.00 C ATOM 1467 CG LYS A 91 197.810 6.520 8.956 1.00 0.00 C ATOM 1468 CD LYS A 91 197.259 5.107 9.072 1.00 0.00 C ATOM 1469 CE LYS A 91 195.903 5.094 9.758 1.00 0.00 C ATOM 1470 NZ LYS A 91 196.022 4.823 11.217 1.00 0.00 N ATOM 0 H LYS A 91 196.877 9.998 6.409 1.00 0.00 H new ATOM 0 HA LYS A 91 198.549 8.849 8.345 1.00 0.00 H new ATOM 0 HB2 LYS A 91 196.441 7.094 7.415 1.00 0.00 H new ATOM 0 HB3 LYS A 91 197.982 6.507 6.823 1.00 0.00 H new ATOM 0 HG2 LYS A 91 198.887 6.507 9.124 1.00 0.00 H new ATOM 0 HG3 LYS A 91 197.373 7.147 9.734 1.00 0.00 H new ATOM 0 HD2 LYS A 91 197.170 4.667 8.079 1.00 0.00 H new ATOM 0 HD3 LYS A 91 197.958 4.487 9.633 1.00 0.00 H new ATOM 0 HE2 LYS A 91 195.410 6.054 9.606 1.00 0.00 H new ATOM 0 HE3 LYS A 91 195.271 4.335 9.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 195.076 4.822 11.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 196.469 3.895 11.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 196.604 5.562 11.661 1.00 0.00 H new ATOM 1484 N GLY A 92 198.575 8.065 5.136 1.00 0.00 N ATOM 1485 CA GLY A 92 199.405 8.104 3.946 1.00 0.00 C ATOM 1486 C GLY A 92 198.634 7.740 2.692 1.00 0.00 C ATOM 1487 O GLY A 92 197.871 6.775 2.683 1.00 0.00 O ATOM 0 H GLY A 92 197.702 7.547 5.033 1.00 0.00 H new ATOM 0 HA2 GLY A 92 199.827 9.103 3.833 1.00 0.00 H new ATOM 0 HA3 GLY A 92 200.242 7.416 4.067 1.00 0.00 H new ATOM 1491 N GLU A 93 198.831 8.517 1.632 1.00 0.00 N ATOM 1492 CA GLU A 93 198.144 8.273 0.368 1.00 0.00 C ATOM 1493 C GLU A 93 199.109 7.735 -0.683 1.00 0.00 C ATOM 1494 O GLU A 93 200.217 8.245 -0.845 1.00 0.00 O ATOM 1495 CB GLU A 93 197.486 9.557 -0.137 1.00 0.00 C ATOM 1496 CG GLU A 93 196.666 9.364 -1.402 1.00 0.00 C ATOM 1497 CD GLU A 93 195.638 8.257 -1.267 1.00 0.00 C ATOM 1498 OE1 GLU A 93 194.898 8.253 -0.260 1.00 0.00 O ATOM 1499 OE2 GLU A 93 195.572 7.395 -2.167 1.00 0.00 O ATOM 0 H GLU A 93 199.460 9.320 1.623 1.00 0.00 H new ATOM 0 HA GLU A 93 197.373 7.523 0.544 1.00 0.00 H new ATOM 0 HB2 GLU A 93 196.842 9.957 0.646 1.00 0.00 H new ATOM 0 HB3 GLU A 93 198.259 10.302 -0.325 1.00 0.00 H new ATOM 0 HG2 GLU A 93 196.159 10.297 -1.648 1.00 0.00 H new ATOM 0 HG3 GLU A 93 197.334 9.135 -2.232 1.00 0.00 H new ATOM 1506 N ALA A 94 198.676 6.701 -1.397 1.00 0.00 N ATOM 1507 CA ALA A 94 199.494 6.091 -2.438 1.00 0.00 C ATOM 1508 C ALA A 94 198.628 5.315 -3.424 1.00 0.00 C ATOM 1509 O ALA A 94 197.799 4.497 -3.026 1.00 0.00 O ATOM 1510 CB ALA A 94 200.542 5.178 -1.819 1.00 0.00 C ATOM 0 H ALA A 94 197.761 6.267 -1.273 1.00 0.00 H new ATOM 0 HA ALA A 94 200.001 6.886 -2.984 1.00 0.00 H new ATOM 0 HB1 ALA A 94 201.145 4.729 -2.608 1.00 0.00 H new ATOM 0 HB2 ALA A 94 201.184 5.758 -1.156 1.00 0.00 H new ATOM 0 HB3 ALA A 94 200.048 4.391 -1.248 1.00 0.00 H new ATOM 1516 N ARG A 95 198.823 5.579 -4.713 1.00 0.00 N ATOM 1517 CA ARG A 95 198.055 4.904 -5.753 1.00 0.00 C ATOM 1518 C ARG A 95 198.404 3.421 -5.815 1.00 0.00 C ATOM 1519 O ARG A 95 199.107 2.973 -6.723 1.00 0.00 O ATOM 1520 CB ARG A 95 198.309 5.558 -7.113 1.00 0.00 C ATOM 1521 CG ARG A 95 197.532 4.920 -8.257 1.00 0.00 C ATOM 1522 CD ARG A 95 196.079 4.663 -7.880 1.00 0.00 C ATOM 1523 NE ARG A 95 195.322 4.073 -8.982 1.00 0.00 N ATOM 1524 CZ ARG A 95 194.639 4.781 -9.879 1.00 0.00 C ATOM 1525 NH1 ARG A 95 194.621 6.106 -9.824 1.00 0.00 N ATOM 1526 NH2 ARG A 95 193.970 4.158 -10.842 1.00 0.00 N ATOM 0 H ARG A 95 199.504 6.254 -5.061 1.00 0.00 H new ATOM 0 HA ARG A 95 196.998 4.999 -5.505 1.00 0.00 H new ATOM 0 HB2 ARG A 95 198.046 6.614 -7.052 1.00 0.00 H new ATOM 0 HB3 ARG A 95 199.375 5.507 -7.337 1.00 0.00 H new ATOM 0 HG2 ARG A 95 197.571 5.571 -9.130 1.00 0.00 H new ATOM 0 HG3 ARG A 95 198.006 3.980 -8.539 1.00 0.00 H new ATOM 0 HD2 ARG A 95 196.041 3.998 -7.017 1.00 0.00 H new ATOM 0 HD3 ARG A 95 195.611 5.601 -7.580 1.00 0.00 H new ATOM 0 HE ARG A 95 195.317 3.057 -9.069 1.00 0.00 H new ATOM 0 HH11 ARG A 95 195.134 6.593 -9.089 1.00 0.00 H new ATOM 0 HH12 ARG A 95 194.094 6.638 -10.517 1.00 0.00 H new ATOM 0 HH21 ARG A 95 193.980 3.139 -10.893 1.00 0.00 H new ATOM 0 HH22 ARG A 95 193.446 4.698 -11.530 1.00 0.00 H new ATOM 1540 N ARG A 96 197.904 2.661 -4.846 1.00 0.00 N ATOM 1541 CA ARG A 96 198.158 1.226 -4.791 1.00 0.00 C ATOM 1542 C ARG A 96 197.076 0.456 -5.540 1.00 0.00 C ATOM 1543 O ARG A 96 196.170 1.051 -6.127 1.00 0.00 O ATOM 1544 CB ARG A 96 198.225 0.755 -3.337 1.00 0.00 C ATOM 1545 CG ARG A 96 199.337 -0.249 -3.071 1.00 0.00 C ATOM 1546 CD ARG A 96 198.790 -1.593 -2.611 1.00 0.00 C ATOM 1547 NE ARG A 96 199.178 -1.901 -1.237 1.00 0.00 N ATOM 1548 CZ ARG A 96 198.555 -1.423 -0.163 1.00 0.00 C ATOM 1549 NH1 ARG A 96 197.510 -0.613 -0.297 1.00 0.00 N ATOM 1550 NH2 ARG A 96 198.975 -1.755 1.051 1.00 0.00 N ATOM 0 H ARG A 96 197.320 3.015 -4.088 1.00 0.00 H new ATOM 0 HA ARG A 96 199.117 1.031 -5.272 1.00 0.00 H new ATOM 0 HB2 ARG A 96 198.366 1.621 -2.690 1.00 0.00 H new ATOM 0 HB3 ARG A 96 197.270 0.306 -3.065 1.00 0.00 H new ATOM 0 HG2 ARG A 96 199.925 -0.388 -3.978 1.00 0.00 H new ATOM 0 HG3 ARG A 96 200.011 0.148 -2.312 1.00 0.00 H new ATOM 0 HD2 ARG A 96 197.703 -1.587 -2.688 1.00 0.00 H new ATOM 0 HD3 ARG A 96 199.152 -2.378 -3.275 1.00 0.00 H new ATOM 0 HE ARG A 96 199.975 -2.520 -1.092 1.00 0.00 H new ATOM 0 HH11 ARG A 96 197.181 -0.354 -1.227 1.00 0.00 H new ATOM 0 HH12 ARG A 96 197.037 -0.250 0.530 1.00 0.00 H new ATOM 0 HH21 ARG A 96 199.776 -2.377 1.161 1.00 0.00 H new ATOM 0 HH22 ARG A 96 198.497 -1.388 1.874 1.00 0.00 H new ATOM 1564 N ALA A 97 197.172 -0.869 -5.517 1.00 0.00 N ATOM 1565 CA ALA A 97 196.200 -1.717 -6.193 1.00 0.00 C ATOM 1566 C ALA A 97 196.485 -3.193 -5.939 1.00 0.00 C ATOM 1567 O ALA A 97 197.539 -3.550 -5.409 1.00 0.00 O ATOM 1568 CB ALA A 97 196.196 -1.427 -7.688 1.00 0.00 C ATOM 0 H ALA A 97 197.914 -1.378 -5.037 1.00 0.00 H new ATOM 0 HA ALA A 97 195.214 -1.491 -5.787 1.00 0.00 H new ATOM 0 HB1 ALA A 97 195.465 -2.068 -8.181 1.00 0.00 H new ATOM 0 HB2 ALA A 97 195.934 -0.382 -7.855 1.00 0.00 H new ATOM 0 HB3 ALA A 97 197.186 -1.623 -8.099 1.00 0.00 H new ATOM 1574 N ALA A 98 195.540 -4.047 -6.317 1.00 0.00 N ATOM 1575 CA ALA A 98 195.688 -5.485 -6.131 1.00 0.00 C ATOM 1576 C ALA A 98 196.181 -6.155 -7.410 1.00 0.00 C ATOM 1577 O ALA A 98 195.403 -6.409 -8.329 1.00 0.00 O ATOM 1578 CB ALA A 98 194.370 -6.098 -5.686 1.00 0.00 C ATOM 0 H ALA A 98 194.662 -3.767 -6.755 1.00 0.00 H new ATOM 0 HA ALA A 98 196.433 -5.652 -5.353 1.00 0.00 H new ATOM 0 HB1 ALA A 98 194.496 -7.172 -5.551 1.00 0.00 H new ATOM 0 HB2 ALA A 98 194.059 -5.648 -4.743 1.00 0.00 H new ATOM 0 HB3 ALA A 98 193.609 -5.914 -6.444 1.00 0.00 H new ATOM 1584 N THR A 99 197.478 -6.439 -7.461 1.00 0.00 N ATOM 1585 CA THR A 99 198.074 -7.080 -8.628 1.00 0.00 C ATOM 1586 C THR A 99 197.458 -8.456 -8.867 1.00 0.00 C ATOM 1587 O THR A 99 197.670 -9.384 -8.088 1.00 0.00 O ATOM 1588 CB THR A 99 199.587 -7.209 -8.446 1.00 0.00 C ATOM 1589 OG1 THR A 99 200.157 -5.963 -8.089 1.00 0.00 O ATOM 1590 CG2 THR A 99 200.299 -7.700 -9.688 1.00 0.00 C ATOM 0 H THR A 99 198.136 -6.236 -6.709 1.00 0.00 H new ATOM 0 HA THR A 99 197.872 -6.456 -9.499 1.00 0.00 H new ATOM 0 HB THR A 99 199.721 -7.946 -7.654 1.00 0.00 H new ATOM 0 HG1 THR A 99 201.125 -6.067 -7.975 1.00 0.00 H new ATOM 0 HG21 THR A 99 201.369 -7.769 -9.491 1.00 0.00 H new ATOM 0 HG22 THR A 99 199.916 -8.683 -9.962 1.00 0.00 H new ATOM 0 HG23 THR A 99 200.125 -7.002 -10.507 1.00 0.00 H new ATOM 1598 N SER A 100 196.697 -8.576 -9.948 1.00 0.00 N ATOM 1599 CA SER A 100 196.048 -9.838 -10.292 1.00 0.00 C ATOM 1600 C SER A 100 196.940 -10.677 -11.203 1.00 0.00 C ATOM 1601 O SER A 100 196.499 -11.164 -12.245 1.00 0.00 O ATOM 1602 CB SER A 100 194.704 -9.575 -10.971 1.00 0.00 C ATOM 1603 OG SER A 100 194.187 -8.306 -10.606 1.00 0.00 O ATOM 0 H SER A 100 196.513 -7.815 -10.602 1.00 0.00 H new ATOM 0 HA SER A 100 195.877 -10.395 -9.371 1.00 0.00 H new ATOM 0 HB2 SER A 100 194.824 -9.625 -12.053 1.00 0.00 H new ATOM 0 HB3 SER A 100 193.994 -10.354 -10.693 1.00 0.00 H new ATOM 0 HG SER A 100 193.328 -8.161 -11.055 1.00 0.00 H new ATOM 1609 N VAL A 101 198.195 -10.848 -10.799 1.00 0.00 N ATOM 1610 CA VAL A 101 199.148 -11.632 -11.575 1.00 0.00 C ATOM 1611 C VAL A 101 198.629 -13.056 -11.788 1.00 0.00 C ATOM 1612 O VAL A 101 197.505 -13.375 -11.401 1.00 0.00 O ATOM 1613 CB VAL A 101 200.532 -11.664 -10.882 1.00 0.00 C ATOM 1614 CG1 VAL A 101 200.625 -12.802 -9.872 1.00 0.00 C ATOM 1615 CG2 VAL A 101 201.648 -11.765 -11.914 1.00 0.00 C ATOM 0 H VAL A 101 198.575 -10.454 -9.938 1.00 0.00 H new ATOM 0 HA VAL A 101 199.262 -11.154 -12.548 1.00 0.00 H new ATOM 0 HB VAL A 101 200.651 -10.728 -10.336 1.00 0.00 H new ATOM 0 HG11 VAL A 101 201.610 -12.794 -9.405 1.00 0.00 H new ATOM 0 HG12 VAL A 101 199.859 -12.673 -9.107 1.00 0.00 H new ATOM 0 HG13 VAL A 101 200.472 -13.754 -10.381 1.00 0.00 H new ATOM 0 HG21 VAL A 101 202.612 -11.786 -11.406 1.00 0.00 H new ATOM 0 HG22 VAL A 101 201.524 -12.678 -12.496 1.00 0.00 H new ATOM 0 HG23 VAL A 101 201.607 -10.903 -12.580 1.00 0.00 H new ATOM 1625 N LYS A 102 199.449 -13.904 -12.403 1.00 0.00 N ATOM 1626 CA LYS A 102 199.062 -15.286 -12.660 1.00 0.00 C ATOM 1627 C LYS A 102 198.883 -16.050 -11.350 1.00 0.00 C ATOM 1628 O LYS A 102 199.733 -16.853 -10.966 1.00 0.00 O ATOM 1629 CB LYS A 102 200.112 -15.979 -13.530 1.00 0.00 C ATOM 1630 CG LYS A 102 199.695 -17.365 -13.998 1.00 0.00 C ATOM 1631 CD LYS A 102 199.599 -17.439 -15.514 1.00 0.00 C ATOM 1632 CE LYS A 102 198.166 -17.264 -15.990 1.00 0.00 C ATOM 1633 NZ LYS A 102 197.779 -15.829 -16.073 1.00 0.00 N ATOM 0 H LYS A 102 200.383 -13.658 -12.731 1.00 0.00 H new ATOM 0 HA LYS A 102 198.110 -15.280 -13.191 1.00 0.00 H new ATOM 0 HB2 LYS A 102 200.318 -15.357 -14.401 1.00 0.00 H new ATOM 0 HB3 LYS A 102 201.042 -16.059 -12.968 1.00 0.00 H new ATOM 0 HG2 LYS A 102 200.415 -18.102 -13.642 1.00 0.00 H new ATOM 0 HG3 LYS A 102 198.731 -17.623 -13.559 1.00 0.00 H new ATOM 0 HD2 LYS A 102 200.228 -16.667 -15.958 1.00 0.00 H new ATOM 0 HD3 LYS A 102 199.983 -18.399 -15.858 1.00 0.00 H new ATOM 0 HE2 LYS A 102 198.050 -17.728 -16.969 1.00 0.00 H new ATOM 0 HE3 LYS A 102 197.491 -17.783 -15.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 196.829 -15.702 -15.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 198.462 -15.254 -15.540 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 197.775 -15.527 -17.068 1.00 0.00 H new ATOM 1647 N ASP A 103 197.771 -15.793 -10.669 1.00 0.00 N ATOM 1648 CA ASP A 103 197.478 -16.453 -9.402 1.00 0.00 C ATOM 1649 C ASP A 103 196.696 -17.743 -9.631 1.00 0.00 C ATOM 1650 O ASP A 103 197.242 -18.840 -9.514 1.00 0.00 O ATOM 1651 CB ASP A 103 196.690 -15.509 -8.488 1.00 0.00 C ATOM 1652 CG ASP A 103 196.283 -16.167 -7.183 1.00 0.00 C ATOM 1653 OD1 ASP A 103 197.059 -16.999 -6.669 1.00 0.00 O ATOM 1654 OD2 ASP A 103 195.185 -15.850 -6.676 1.00 0.00 O ATOM 0 H ASP A 103 197.057 -15.131 -10.974 1.00 0.00 H new ATOM 0 HA ASP A 103 198.422 -16.708 -8.920 1.00 0.00 H new ATOM 0 HB2 ASP A 103 197.295 -14.628 -8.273 1.00 0.00 H new ATOM 0 HB3 ASP A 103 195.798 -15.164 -9.011 1.00 0.00 H new ATOM 1659 N ALA A 104 195.416 -17.606 -9.959 1.00 0.00 N ATOM 1660 CA ALA A 104 194.563 -18.762 -10.204 1.00 0.00 C ATOM 1661 C ALA A 104 194.782 -19.319 -11.606 1.00 0.00 C ATOM 1662 O ALA A 104 193.999 -19.057 -12.518 1.00 0.00 O ATOM 1663 CB ALA A 104 193.101 -18.391 -10.004 1.00 0.00 C ATOM 0 H ALA A 104 194.947 -16.706 -10.061 1.00 0.00 H new ATOM 0 HA ALA A 104 194.831 -19.538 -9.487 1.00 0.00 H new ATOM 0 HB1 ALA A 104 192.475 -19.264 -10.190 1.00 0.00 H new ATOM 0 HB2 ALA A 104 192.949 -18.048 -8.981 1.00 0.00 H new ATOM 0 HB3 ALA A 104 192.829 -17.595 -10.698 1.00 0.00 H new ATOM 1669 N ASN A 105 195.855 -20.086 -11.772 1.00 0.00 N ATOM 1670 CA ASN A 105 196.180 -20.680 -13.065 1.00 0.00 C ATOM 1671 C ASN A 105 195.263 -21.862 -13.382 1.00 0.00 C ATOM 1672 O ASN A 105 195.720 -22.990 -13.566 1.00 0.00 O ATOM 1673 CB ASN A 105 197.657 -21.108 -13.096 1.00 0.00 C ATOM 1674 CG ASN A 105 197.948 -22.404 -12.346 1.00 0.00 C ATOM 1675 OD1 ASN A 105 197.106 -22.750 -11.373 1.00 0.00 O flip ATOM 1676 ND2 ASN A 105 198.927 -23.089 -12.640 1.00 0.00 N flip ATOM 0 H ASN A 105 196.515 -20.311 -11.027 1.00 0.00 H new ATOM 0 HA ASN A 105 196.019 -19.926 -13.836 1.00 0.00 H new ATOM 0 HB2 ASN A 105 197.968 -21.224 -14.134 1.00 0.00 H new ATOM 0 HB3 ASN A 105 198.264 -20.310 -12.669 1.00 0.00 H new ATOM 0 HD21 ASN A 105 199.550 -22.792 -13.391 1.00 0.00 H new ATOM 0 HD22 ASN A 105 199.116 -23.953 -12.133 1.00 0.00 H new ATOM 1683 N PHE A 106 193.962 -21.594 -13.449 1.00 0.00 N ATOM 1684 CA PHE A 106 192.983 -22.633 -13.747 1.00 0.00 C ATOM 1685 C PHE A 106 192.719 -22.718 -15.246 1.00 0.00 C ATOM 1686 O PHE A 106 191.630 -22.385 -15.717 1.00 0.00 O ATOM 1687 CB PHE A 106 191.677 -22.360 -12.997 1.00 0.00 C ATOM 1688 CG PHE A 106 191.641 -22.947 -11.615 1.00 0.00 C ATOM 1689 CD1 PHE A 106 192.744 -22.852 -10.780 1.00 0.00 C ATOM 1690 CD2 PHE A 106 190.506 -23.591 -11.151 1.00 0.00 C ATOM 1691 CE1 PHE A 106 192.715 -23.392 -9.507 1.00 0.00 C ATOM 1692 CE2 PHE A 106 190.471 -24.132 -9.879 1.00 0.00 C ATOM 1693 CZ PHE A 106 191.576 -24.031 -9.056 1.00 0.00 C ATOM 0 H PHE A 106 193.562 -20.667 -13.301 1.00 0.00 H new ATOM 0 HA PHE A 106 193.389 -23.589 -13.416 1.00 0.00 H new ATOM 0 HB2 PHE A 106 191.526 -21.283 -12.929 1.00 0.00 H new ATOM 0 HB3 PHE A 106 190.845 -22.763 -13.575 1.00 0.00 H new ATOM 0 HD1 PHE A 106 193.635 -22.351 -11.127 1.00 0.00 H new ATOM 0 HD2 PHE A 106 189.639 -23.671 -11.790 1.00 0.00 H new ATOM 0 HE1 PHE A 106 193.581 -23.314 -8.867 1.00 0.00 H new ATOM 0 HE2 PHE A 106 189.581 -24.633 -9.529 1.00 0.00 H new ATOM 0 HZ PHE A 106 191.550 -24.451 -8.061 1.00 0.00 H new ATOM 1703 N VAL A 107 193.723 -23.166 -15.994 1.00 0.00 N ATOM 1704 CA VAL A 107 193.600 -23.296 -17.441 1.00 0.00 C ATOM 1705 C VAL A 107 193.125 -24.693 -17.828 1.00 0.00 C ATOM 1706 O VAL A 107 193.337 -25.656 -17.091 1.00 0.00 O ATOM 1707 CB VAL A 107 194.938 -23.001 -18.148 1.00 0.00 C ATOM 1708 CG1 VAL A 107 196.005 -23.998 -17.716 1.00 0.00 C ATOM 1709 CG2 VAL A 107 194.762 -23.017 -19.658 1.00 0.00 C ATOM 0 H VAL A 107 194.631 -23.445 -15.621 1.00 0.00 H new ATOM 0 HA VAL A 107 192.861 -22.563 -17.764 1.00 0.00 H new ATOM 0 HB VAL A 107 195.267 -22.004 -17.856 1.00 0.00 H new ATOM 0 HG11 VAL A 107 196.941 -23.773 -18.226 1.00 0.00 H new ATOM 0 HG12 VAL A 107 196.153 -23.928 -16.638 1.00 0.00 H new ATOM 0 HG13 VAL A 107 195.685 -25.008 -17.974 1.00 0.00 H new ATOM 0 HG21 VAL A 107 195.718 -22.807 -20.138 1.00 0.00 H new ATOM 0 HG22 VAL A 107 194.406 -23.998 -19.972 1.00 0.00 H new ATOM 0 HG23 VAL A 107 194.036 -22.258 -19.948 1.00 0.00 H new ATOM 1719 N GLU A 108 192.481 -24.795 -18.986 1.00 0.00 N ATOM 1720 CA GLU A 108 191.977 -26.074 -19.467 1.00 0.00 C ATOM 1721 C GLU A 108 191.335 -25.918 -20.841 1.00 0.00 C ATOM 1722 O GLU A 108 191.251 -24.815 -21.381 1.00 0.00 O ATOM 1723 CB GLU A 108 190.962 -26.651 -18.479 1.00 0.00 C ATOM 1724 CG GLU A 108 191.157 -28.134 -18.203 1.00 0.00 C ATOM 1725 CD GLU A 108 189.905 -28.796 -17.658 1.00 0.00 C ATOM 1726 OE1 GLU A 108 188.795 -28.378 -18.049 1.00 0.00 O ATOM 1727 OE2 GLU A 108 190.037 -29.730 -16.841 1.00 0.00 O ATOM 0 H GLU A 108 192.296 -24.008 -19.607 1.00 0.00 H new ATOM 0 HA GLU A 108 192.819 -26.761 -19.552 1.00 0.00 H new ATOM 0 HB2 GLU A 108 191.030 -26.103 -17.539 1.00 0.00 H new ATOM 0 HB3 GLU A 108 189.957 -26.492 -18.869 1.00 0.00 H new ATOM 0 HG2 GLU A 108 191.457 -28.635 -19.124 1.00 0.00 H new ATOM 0 HG3 GLU A 108 191.971 -28.263 -17.490 1.00 0.00 H new ATOM 1734 N GLU A 109 190.885 -27.034 -21.398 1.00 0.00 N ATOM 1735 CA GLU A 109 190.247 -27.036 -22.710 1.00 0.00 C ATOM 1736 C GLU A 109 188.745 -26.760 -22.577 1.00 0.00 C ATOM 1737 O GLU A 109 188.322 -26.058 -21.658 1.00 0.00 O ATOM 1738 CB GLU A 109 190.499 -28.377 -23.408 1.00 0.00 C ATOM 1739 CG GLU A 109 189.789 -29.552 -22.755 1.00 0.00 C ATOM 1740 CD GLU A 109 190.712 -30.379 -21.880 1.00 0.00 C ATOM 1741 OE1 GLU A 109 191.929 -30.411 -22.167 1.00 0.00 O ATOM 1742 OE2 GLU A 109 190.221 -30.992 -20.910 1.00 0.00 O ATOM 0 H GLU A 109 190.950 -27.953 -20.961 1.00 0.00 H new ATOM 0 HA GLU A 109 190.680 -26.242 -23.318 1.00 0.00 H new ATOM 0 HB2 GLU A 109 190.177 -28.302 -24.447 1.00 0.00 H new ATOM 0 HB3 GLU A 109 191.571 -28.574 -23.420 1.00 0.00 H new ATOM 0 HG2 GLU A 109 188.959 -29.181 -22.153 1.00 0.00 H new ATOM 0 HG3 GLU A 109 189.361 -30.189 -23.529 1.00 0.00 H new ATOM 1749 N VAL A 110 187.944 -27.308 -23.493 1.00 0.00 N ATOM 1750 CA VAL A 110 186.494 -27.112 -23.468 1.00 0.00 C ATOM 1751 C VAL A 110 185.933 -27.251 -22.055 1.00 0.00 C ATOM 1752 O VAL A 110 186.025 -28.314 -21.441 1.00 0.00 O ATOM 1753 CB VAL A 110 185.779 -28.116 -24.390 1.00 0.00 C ATOM 1754 CG1 VAL A 110 185.970 -27.732 -25.849 1.00 0.00 C ATOM 1755 CG2 VAL A 110 186.277 -29.530 -24.133 1.00 0.00 C ATOM 0 H VAL A 110 188.276 -27.891 -24.261 1.00 0.00 H new ATOM 0 HA VAL A 110 186.311 -26.099 -23.825 1.00 0.00 H new ATOM 0 HB VAL A 110 184.712 -28.087 -24.167 1.00 0.00 H new ATOM 0 HG11 VAL A 110 185.457 -28.453 -26.485 1.00 0.00 H new ATOM 0 HG12 VAL A 110 185.556 -26.738 -26.021 1.00 0.00 H new ATOM 0 HG13 VAL A 110 187.033 -27.729 -26.088 1.00 0.00 H new ATOM 0 HG21 VAL A 110 185.759 -30.224 -24.795 1.00 0.00 H new ATOM 0 HG22 VAL A 110 187.349 -29.578 -24.324 1.00 0.00 H new ATOM 0 HG23 VAL A 110 186.080 -29.802 -23.096 1.00 0.00 H new ATOM 1765 N GLU A 111 185.353 -26.169 -21.546 1.00 0.00 N ATOM 1766 CA GLU A 111 184.780 -26.165 -20.206 1.00 0.00 C ATOM 1767 C GLU A 111 183.390 -26.796 -20.209 1.00 0.00 C ATOM 1768 O GLU A 111 182.392 -26.127 -19.935 1.00 0.00 O ATOM 1769 CB GLU A 111 184.707 -24.737 -19.665 1.00 0.00 C ATOM 1770 CG GLU A 111 184.538 -24.666 -18.155 1.00 0.00 C ATOM 1771 CD GLU A 111 183.184 -24.124 -17.742 1.00 0.00 C ATOM 1772 OE1 GLU A 111 182.622 -23.298 -18.492 1.00 0.00 O ATOM 1773 OE2 GLU A 111 182.685 -24.527 -16.671 1.00 0.00 O ATOM 0 H GLU A 111 185.268 -25.282 -22.043 1.00 0.00 H new ATOM 0 HA GLU A 111 185.426 -26.757 -19.557 1.00 0.00 H new ATOM 0 HB2 GLU A 111 185.615 -24.204 -19.946 1.00 0.00 H new ATOM 0 HB3 GLU A 111 183.874 -24.219 -20.140 1.00 0.00 H new ATOM 0 HG2 GLU A 111 184.671 -25.662 -17.732 1.00 0.00 H new ATOM 0 HG3 GLU A 111 185.321 -24.034 -17.735 1.00 0.00 H new ATOM 1780 N GLU A 112 183.332 -28.086 -20.520 1.00 0.00 N ATOM 1781 CA GLU A 112 182.065 -28.807 -20.558 1.00 0.00 C ATOM 1782 C GLU A 112 181.511 -29.006 -19.149 1.00 0.00 C ATOM 1783 O GLU A 112 181.509 -30.119 -18.621 1.00 0.00 O ATOM 1784 CB GLU A 112 182.245 -30.158 -21.255 1.00 0.00 C ATOM 1785 CG GLU A 112 181.181 -30.446 -22.303 1.00 0.00 C ATOM 1786 CD GLU A 112 181.394 -29.658 -23.580 1.00 0.00 C ATOM 1787 OE1 GLU A 112 181.448 -28.411 -23.506 1.00 0.00 O ATOM 1788 OE2 GLU A 112 181.505 -30.284 -24.654 1.00 0.00 O ATOM 0 H GLU A 112 184.148 -28.654 -20.749 1.00 0.00 H new ATOM 0 HA GLU A 112 181.349 -28.212 -21.125 1.00 0.00 H new ATOM 0 HB2 GLU A 112 183.227 -30.186 -21.728 1.00 0.00 H new ATOM 0 HB3 GLU A 112 182.229 -30.949 -20.506 1.00 0.00 H new ATOM 0 HG2 GLU A 112 181.182 -31.511 -22.533 1.00 0.00 H new ATOM 0 HG3 GLU A 112 180.199 -30.209 -21.893 1.00 0.00 H new ATOM 1795 N GLU A 113 181.046 -27.918 -18.544 1.00 0.00 N ATOM 1796 CA GLU A 113 180.491 -27.970 -17.197 1.00 0.00 C ATOM 1797 C GLU A 113 179.313 -28.938 -17.128 1.00 0.00 C ATOM 1798 O GLU A 113 179.385 -29.900 -16.334 1.00 0.00 O ATOM 1799 CB GLU A 113 180.047 -26.575 -16.751 1.00 0.00 C ATOM 1800 CG GLU A 113 178.907 -26.007 -17.579 1.00 0.00 C ATOM 1801 CD GLU A 113 178.721 -24.516 -17.370 1.00 0.00 C ATOM 1802 OE1 GLU A 113 178.468 -24.107 -16.217 1.00 0.00 O ATOM 1803 OE2 GLU A 113 178.828 -23.760 -18.357 1.00 0.00 O ATOM 1804 OXT GLU A 113 178.330 -28.726 -17.867 1.00 0.00 O ATOM 0 H GLU A 113 181.043 -26.989 -18.966 1.00 0.00 H new ATOM 0 HA GLU A 113 181.271 -28.328 -16.525 1.00 0.00 H new ATOM 0 HB2 GLU A 113 179.740 -26.617 -15.706 1.00 0.00 H new ATOM 0 HB3 GLU A 113 180.898 -25.897 -16.806 1.00 0.00 H new ATOM 0 HG2 GLU A 113 179.098 -26.201 -18.634 1.00 0.00 H new ATOM 0 HG3 GLU A 113 177.983 -26.524 -17.321 1.00 0.00 H new TER 1811 GLU A 113