USER MOD reduce.3.24.130724 H: found=0, std=0, add=974, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 971 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 NoAdj-H: B 219 HIS HE2 : B 219 HIS NE2 : B 300 ZNZN :(H bumps) USER MOD Set 1.1: B 214 SER OG : rot 180:sc= -0.011 USER MOD Set 1.2: B 215 HIS : no HD1:sc= 0 X(o=-0.011,f=-0.011) USER MOD Set 2.1: A 55 THR OG1 : rot -68:sc= 1.02 USER MOD Set 2.2: A 57 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= -1.17 USER MOD Set 3.2: A 25 ASN : amide:sc= -1.37 K(o=-2.5,f=-1.9!) USER MOD Set 4.1: A 7 THR OG1 : rot 119:sc= 1.24 USER MOD Set 4.2: A 9 THR OG1 : rot 180:sc= 1.07 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 178:sc= 1.22 (180deg=1.08) USER MOD Single : A 2 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.26) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -80:sc= 1.89 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -174:sc= 0.0184 (180deg=-0.00087) USER MOD Single : A 29 LYS NZ :NH3+ 138:sc= 0.0901 (180deg=-0.101) USER MOD Single : A 31 GLN : amide:sc= -0.954 X(o=-0.95,f=-1) USER MOD Single : A 33 LYS NZ :NH3+ 155:sc= -0.0503 (180deg=-1.03) USER MOD Single : A 40 GLN : amide:sc= -0.914 K(o=-0.91,f=-3.3!) USER MOD Single : A 41 GLN : amide:sc= -3.29! C(o=-3.3!,f=-11!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= 0.415 K(o=0.42,f=-3.3!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0.957 USER MOD Single : A 60 ASN : amide:sc= -0.0191 K(o=-0.019,f=-0.87) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 140:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=-0.0054) USER MOD Single : B 198 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : B 200 THR OG1 : rot 180:sc= 0 USER MOD Single : B 201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 210 ASN : amide:sc= -0.766 K(o=-0.77,f=-3!) USER MOD Single : B 217 ASN : amide:sc= -0.665 K(o=-0.66,f=-3.4!) USER MOD Single : B 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 222 SER OG : rot 180:sc= 0 USER MOD Single : B 225 SER OG : rot 102:sc= 1.24 USER MOD Single : B 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 230 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 232 SER OG : rot 180:sc= -0.0299 USER MOD Single : B 235 SER OG : rot 180:sc= 0 USER MOD Single : B 236 SER OG : rot 180:sc=0.000557 USER MOD Single : B 238 HIS : no HD1:sc= -2.33 K(o=-2.3,f=-4!) USER MOD Single : B 239 LYS NZ :NH3+ -165:sc=-0.00584 (180deg=-0.204) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 96.737 16.485 10.356 1.00 0.00 N ATOM 2 CA MET A 1 96.906 15.148 11.002 1.00 0.00 C ATOM 3 C MET A 1 98.152 14.477 10.448 1.00 0.00 C ATOM 4 O MET A 1 98.216 14.147 9.263 1.00 0.00 O ATOM 5 CB MET A 1 95.681 14.270 10.723 1.00 0.00 C ATOM 6 CG MET A 1 95.788 12.941 11.487 1.00 0.00 C ATOM 7 SD MET A 1 94.146 12.195 11.654 1.00 0.00 S ATOM 8 CE MET A 1 94.235 11.118 10.202 1.00 0.00 C ATOM 0 H1 MET A 1 95.867 16.933 10.708 1.00 0.00 H new ATOM 0 H2 MET A 1 97.553 17.087 10.585 1.00 0.00 H new ATOM 0 H3 MET A 1 96.673 16.367 9.325 1.00 0.00 H new ATOM 0 HA MET A 1 97.008 15.280 12.079 1.00 0.00 H new ATOM 0 HB2 MET A 1 94.774 14.796 11.021 1.00 0.00 H new ATOM 0 HB3 MET A 1 95.601 14.076 9.653 1.00 0.00 H new ATOM 0 HG2 MET A 1 96.455 12.260 10.958 1.00 0.00 H new ATOM 0 HG3 MET A 1 96.222 13.111 12.472 1.00 0.00 H new ATOM 0 HE1 MET A 1 93.307 10.553 10.111 1.00 0.00 H new ATOM 0 HE2 MET A 1 94.380 11.724 9.308 1.00 0.00 H new ATOM 0 HE3 MET A 1 95.071 10.427 10.312 1.00 0.00 H new ATOM 20 N GLN A 2 99.125 14.288 11.324 1.00 0.00 N ATOM 21 CA GLN A 2 100.379 13.645 10.937 1.00 0.00 C ATOM 22 C GLN A 2 100.234 12.144 11.072 1.00 0.00 C ATOM 23 O GLN A 2 99.921 11.634 12.151 1.00 0.00 O ATOM 24 CB GLN A 2 101.539 14.131 11.807 1.00 0.00 C ATOM 25 CG GLN A 2 102.870 13.608 11.251 1.00 0.00 C ATOM 26 CD GLN A 2 104.036 14.207 12.034 1.00 0.00 C ATOM 27 OE1 GLN A 2 104.190 15.426 12.086 1.00 0.00 O ATOM 28 NE2 GLN A 2 104.863 13.414 12.659 1.00 0.00 N ATOM 0 H GLN A 2 99.076 14.567 12.304 1.00 0.00 H new ATOM 0 HA GLN A 2 100.598 13.907 9.902 1.00 0.00 H new ATOM 0 HB2 GLN A 2 101.551 15.221 11.835 1.00 0.00 H new ATOM 0 HB3 GLN A 2 101.404 13.787 12.832 1.00 0.00 H new ATOM 0 HG2 GLN A 2 102.898 12.520 11.316 1.00 0.00 H new ATOM 0 HG3 GLN A 2 102.959 13.866 10.196 1.00 0.00 H new ATOM 0 HE21 GLN A 2 104.733 12.403 12.614 1.00 0.00 H new ATOM 0 HE22 GLN A 2 105.640 13.805 13.192 1.00 0.00 H new ATOM 37 N ILE A 3 100.463 11.451 9.967 1.00 0.00 N ATOM 38 CA ILE A 3 100.365 10.000 9.936 1.00 0.00 C ATOM 39 C ILE A 3 101.666 9.426 9.404 1.00 0.00 C ATOM 40 O ILE A 3 102.473 10.153 8.817 1.00 0.00 O ATOM 41 CB ILE A 3 99.178 9.551 9.064 1.00 0.00 C ATOM 42 CG1 ILE A 3 99.346 10.076 7.623 1.00 0.00 C ATOM 43 CG2 ILE A 3 97.873 10.093 9.671 1.00 0.00 C ATOM 44 CD1 ILE A 3 98.365 9.365 6.686 1.00 0.00 C ATOM 0 H ILE A 3 100.720 11.873 9.075 1.00 0.00 H new ATOM 0 HA ILE A 3 100.192 9.630 10.947 1.00 0.00 H new ATOM 0 HB ILE A 3 99.143 8.462 9.034 1.00 0.00 H new ATOM 0 HG12 ILE A 3 99.171 11.152 7.597 1.00 0.00 H new ATOM 0 HG13 ILE A 3 100.369 9.911 7.284 1.00 0.00 H new ATOM 0 HG21 ILE A 3 97.028 9.778 9.058 1.00 0.00 H new ATOM 0 HG22 ILE A 3 97.753 9.703 10.682 1.00 0.00 H new ATOM 0 HG23 ILE A 3 97.912 11.182 9.704 1.00 0.00 H new ATOM 0 HD11 ILE A 3 98.492 9.743 5.672 1.00 0.00 H new ATOM 0 HD12 ILE A 3 98.560 8.293 6.701 1.00 0.00 H new ATOM 0 HD13 ILE A 3 97.344 9.553 7.018 1.00 0.00 H new ATOM 56 N PHE A 4 101.864 8.134 9.614 1.00 0.00 N ATOM 57 CA PHE A 4 103.077 7.469 9.154 1.00 0.00 C ATOM 58 C PHE A 4 102.713 6.343 8.199 1.00 0.00 C ATOM 59 O PHE A 4 101.709 5.656 8.394 1.00 0.00 O ATOM 60 CB PHE A 4 103.846 6.888 10.347 1.00 0.00 C ATOM 61 CG PHE A 4 104.217 7.992 11.313 1.00 0.00 C ATOM 62 CD1 PHE A 4 103.366 8.300 12.382 1.00 0.00 C ATOM 63 CD2 PHE A 4 105.409 8.703 11.141 1.00 0.00 C ATOM 64 CE1 PHE A 4 103.706 9.321 13.275 1.00 0.00 C ATOM 65 CE2 PHE A 4 105.751 9.723 12.035 1.00 0.00 C ATOM 66 CZ PHE A 4 104.900 10.031 13.104 1.00 0.00 C ATOM 0 H PHE A 4 101.204 7.525 10.098 1.00 0.00 H new ATOM 0 HA PHE A 4 103.704 8.199 8.642 1.00 0.00 H new ATOM 0 HB2 PHE A 4 103.236 6.140 10.854 1.00 0.00 H new ATOM 0 HB3 PHE A 4 104.746 6.382 9.998 1.00 0.00 H new ATOM 0 HD1 PHE A 4 102.447 7.749 12.517 1.00 0.00 H new ATOM 0 HD2 PHE A 4 106.066 8.464 10.318 1.00 0.00 H new ATOM 0 HE1 PHE A 4 103.047 9.562 14.096 1.00 0.00 H new ATOM 0 HE2 PHE A 4 106.671 10.273 11.901 1.00 0.00 H new ATOM 0 HZ PHE A 4 105.165 10.816 13.796 1.00 0.00 H new ATOM 76 N VAL A 5 103.537 6.156 7.174 1.00 0.00 N ATOM 77 CA VAL A 5 103.306 5.096 6.194 1.00 0.00 C ATOM 78 C VAL A 5 104.543 4.204 6.165 1.00 0.00 C ATOM 79 O VAL A 5 105.674 4.699 6.150 1.00 0.00 O ATOM 80 CB VAL A 5 103.001 5.684 4.802 1.00 0.00 C ATOM 81 CG1 VAL A 5 102.714 4.556 3.803 1.00 0.00 C ATOM 82 CG2 VAL A 5 101.777 6.605 4.885 1.00 0.00 C ATOM 0 H VAL A 5 104.368 6.721 6.999 1.00 0.00 H new ATOM 0 HA VAL A 5 102.434 4.506 6.478 1.00 0.00 H new ATOM 0 HB VAL A 5 103.868 6.253 4.465 1.00 0.00 H new ATOM 0 HG11 VAL A 5 102.500 4.983 2.823 1.00 0.00 H new ATOM 0 HG12 VAL A 5 103.584 3.903 3.732 1.00 0.00 H new ATOM 0 HG13 VAL A 5 101.854 3.979 4.143 1.00 0.00 H new ATOM 0 HG21 VAL A 5 101.565 7.018 3.899 1.00 0.00 H new ATOM 0 HG22 VAL A 5 100.915 6.035 5.232 1.00 0.00 H new ATOM 0 HG23 VAL A 5 101.980 7.417 5.583 1.00 0.00 H new ATOM 92 N LYS A 6 104.316 2.893 6.176 1.00 0.00 N ATOM 93 CA LYS A 6 105.408 1.927 6.168 1.00 0.00 C ATOM 94 C LYS A 6 105.253 0.951 5.012 1.00 0.00 C ATOM 95 O LYS A 6 104.252 0.237 4.916 1.00 0.00 O ATOM 96 CB LYS A 6 105.431 1.157 7.491 1.00 0.00 C ATOM 97 CG LYS A 6 106.697 0.302 7.565 1.00 0.00 C ATOM 98 CD LYS A 6 106.747 -0.422 8.906 1.00 0.00 C ATOM 99 CE LYS A 6 108.022 -1.260 8.977 1.00 0.00 C ATOM 100 NZ LYS A 6 108.085 -1.953 10.293 1.00 0.00 N ATOM 0 H LYS A 6 103.385 2.476 6.190 1.00 0.00 H new ATOM 0 HA LYS A 6 106.346 2.468 6.045 1.00 0.00 H new ATOM 0 HB2 LYS A 6 105.401 1.853 8.329 1.00 0.00 H new ATOM 0 HB3 LYS A 6 104.547 0.524 7.570 1.00 0.00 H new ATOM 0 HG2 LYS A 6 106.708 -0.421 6.749 1.00 0.00 H new ATOM 0 HG3 LYS A 6 107.580 0.930 7.446 1.00 0.00 H new ATOM 0 HD2 LYS A 6 106.725 0.299 9.723 1.00 0.00 H new ATOM 0 HD3 LYS A 6 105.871 -1.060 9.021 1.00 0.00 H new ATOM 0 HE2 LYS A 6 108.036 -1.990 8.168 1.00 0.00 H new ATOM 0 HE3 LYS A 6 108.897 -0.623 8.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 108.953 -2.524 10.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 108.090 -1.247 11.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 107.256 -2.572 10.399 1.00 0.00 H new ATOM 114 N THR A 7 106.253 0.943 4.138 1.00 0.00 N ATOM 115 CA THR A 7 106.238 0.070 2.972 1.00 0.00 C ATOM 116 C THR A 7 106.649 -1.340 3.375 1.00 0.00 C ATOM 117 O THR A 7 107.173 -1.554 4.471 1.00 0.00 O ATOM 118 CB THR A 7 107.206 0.597 1.900 1.00 0.00 C ATOM 119 OG1 THR A 7 108.532 0.553 2.407 1.00 0.00 O ATOM 120 CG2 THR A 7 106.852 2.042 1.525 1.00 0.00 C ATOM 0 H THR A 7 107.083 1.531 4.215 1.00 0.00 H new ATOM 0 HA THR A 7 105.228 0.052 2.563 1.00 0.00 H new ATOM 0 HB THR A 7 107.125 -0.027 1.010 1.00 0.00 H new ATOM 0 HG1 THR A 7 109.076 -0.040 1.848 1.00 0.00 H new ATOM 0 HG21 THR A 7 107.546 2.401 0.765 1.00 0.00 H new ATOM 0 HG22 THR A 7 105.835 2.078 1.134 1.00 0.00 H new ATOM 0 HG23 THR A 7 106.923 2.675 2.409 1.00 0.00 H new ATOM 128 N LEU A 8 106.396 -2.291 2.484 1.00 0.00 N ATOM 129 CA LEU A 8 106.728 -3.693 2.736 1.00 0.00 C ATOM 130 C LEU A 8 108.240 -3.900 2.845 1.00 0.00 C ATOM 131 O LEU A 8 108.694 -4.875 3.449 1.00 0.00 O ATOM 132 CB LEU A 8 106.187 -4.564 1.598 1.00 0.00 C ATOM 133 CG LEU A 8 104.656 -4.464 1.537 1.00 0.00 C ATOM 134 CD1 LEU A 8 104.158 -5.091 0.234 1.00 0.00 C ATOM 135 CD2 LEU A 8 104.036 -5.204 2.727 1.00 0.00 C ATOM 0 H LEU A 8 105.961 -2.119 1.578 1.00 0.00 H new ATOM 0 HA LEU A 8 106.270 -3.979 3.683 1.00 0.00 H new ATOM 0 HB2 LEU A 8 106.618 -4.245 0.649 1.00 0.00 H new ATOM 0 HB3 LEU A 8 106.485 -5.601 1.750 1.00 0.00 H new ATOM 0 HG LEU A 8 104.364 -3.415 1.576 1.00 0.00 H new ATOM 0 HD11 LEU A 8 103.071 -5.021 0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 8 104.591 -4.561 -0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 8 104.456 -6.139 0.197 1.00 0.00 H new ATOM 0 HD21 LEU A 8 102.950 -5.128 2.677 1.00 0.00 H new ATOM 0 HD22 LEU A 8 104.329 -6.254 2.695 1.00 0.00 H new ATOM 0 HD23 LEU A 8 104.388 -4.757 3.657 1.00 0.00 H new ATOM 147 N THR A 9 109.004 -2.978 2.256 1.00 0.00 N ATOM 148 CA THR A 9 110.462 -3.050 2.286 1.00 0.00 C ATOM 149 C THR A 9 111.022 -2.621 3.650 1.00 0.00 C ATOM 150 O THR A 9 112.162 -2.956 3.981 1.00 0.00 O ATOM 151 CB THR A 9 111.036 -2.167 1.174 1.00 0.00 C ATOM 152 OG1 THR A 9 110.515 -0.853 1.302 1.00 0.00 O ATOM 153 CG2 THR A 9 110.644 -2.744 -0.195 1.00 0.00 C ATOM 0 H THR A 9 108.634 -2.172 1.752 1.00 0.00 H new ATOM 0 HA THR A 9 110.759 -4.086 2.124 1.00 0.00 H new ATOM 0 HB THR A 9 112.123 -2.138 1.255 1.00 0.00 H new ATOM 0 HG1 THR A 9 110.882 -0.285 0.592 1.00 0.00 H new ATOM 0 HG21 THR A 9 111.053 -2.115 -0.986 1.00 0.00 H new ATOM 0 HG22 THR A 9 111.043 -3.754 -0.292 1.00 0.00 H new ATOM 0 HG23 THR A 9 109.558 -2.773 -0.280 1.00 0.00 H new ATOM 161 N GLY A 10 110.217 -1.890 4.429 1.00 0.00 N ATOM 162 CA GLY A 10 110.640 -1.427 5.754 1.00 0.00 C ATOM 163 C GLY A 10 110.830 0.094 5.809 1.00 0.00 C ATOM 164 O GLY A 10 111.006 0.652 6.896 1.00 0.00 O ATOM 0 H GLY A 10 109.273 -1.608 4.166 1.00 0.00 H new ATOM 0 HA2 GLY A 10 109.897 -1.725 6.494 1.00 0.00 H new ATOM 0 HA3 GLY A 10 111.575 -1.917 6.026 1.00 0.00 H new ATOM 168 N LYS A 11 110.792 0.757 4.645 1.00 0.00 N ATOM 169 CA LYS A 11 110.961 2.206 4.593 1.00 0.00 C ATOM 170 C LYS A 11 109.851 2.886 5.387 1.00 0.00 C ATOM 171 O LYS A 11 108.741 2.355 5.497 1.00 0.00 O ATOM 172 CB LYS A 11 110.936 2.695 3.143 1.00 0.00 C ATOM 173 CG LYS A 11 111.344 4.172 3.093 1.00 0.00 C ATOM 174 CD LYS A 11 111.358 4.643 1.644 1.00 0.00 C ATOM 175 CE LYS A 11 111.785 6.110 1.585 1.00 0.00 C ATOM 176 NZ LYS A 11 111.833 6.556 0.163 1.00 0.00 N ATOM 0 H LYS A 11 110.647 0.314 3.738 1.00 0.00 H new ATOM 0 HA LYS A 11 111.926 2.461 5.032 1.00 0.00 H new ATOM 0 HB2 LYS A 11 111.616 2.098 2.535 1.00 0.00 H new ATOM 0 HB3 LYS A 11 109.938 2.568 2.723 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.647 4.774 3.676 1.00 0.00 H new ATOM 0 HG3 LYS A 11 112.329 4.304 3.540 1.00 0.00 H new ATOM 0 HD2 LYS A 11 112.044 4.030 1.059 1.00 0.00 H new ATOM 0 HD3 LYS A 11 110.368 4.524 1.203 1.00 0.00 H new ATOM 0 HE2 LYS A 11 111.084 6.727 2.147 1.00 0.00 H new ATOM 0 HE3 LYS A 11 112.763 6.234 2.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 112.123 7.554 0.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 112.518 5.974 -0.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 110.891 6.452 -0.266 1.00 0.00 H new ATOM 190 N THR A 12 110.168 4.054 5.945 1.00 0.00 N ATOM 191 CA THR A 12 109.198 4.807 6.742 1.00 0.00 C ATOM 192 C THR A 12 109.138 6.263 6.288 1.00 0.00 C ATOM 193 O THR A 12 110.167 6.933 6.177 1.00 0.00 O ATOM 194 CB THR A 12 109.575 4.748 8.227 1.00 0.00 C ATOM 195 OG1 THR A 12 109.831 3.400 8.595 1.00 0.00 O ATOM 196 CG2 THR A 12 108.415 5.285 9.071 1.00 0.00 C ATOM 0 H THR A 12 111.083 4.498 5.861 1.00 0.00 H new ATOM 0 HA THR A 12 108.217 4.354 6.599 1.00 0.00 H new ATOM 0 HB THR A 12 110.465 5.353 8.398 1.00 0.00 H new ATOM 0 HG1 THR A 12 110.074 3.360 9.544 1.00 0.00 H new ATOM 0 HG21 THR A 12 108.683 5.243 10.127 1.00 0.00 H new ATOM 0 HG22 THR A 12 108.208 6.318 8.790 1.00 0.00 H new ATOM 0 HG23 THR A 12 107.527 4.677 8.898 1.00 0.00 H new ATOM 204 N ILE A 13 107.921 6.732 6.041 1.00 0.00 N ATOM 205 CA ILE A 13 107.685 8.107 5.606 1.00 0.00 C ATOM 206 C ILE A 13 106.550 8.718 6.426 1.00 0.00 C ATOM 207 O ILE A 13 105.495 8.102 6.590 1.00 0.00 O ATOM 208 CB ILE A 13 107.338 8.138 4.099 1.00 0.00 C ATOM 209 CG1 ILE A 13 107.040 9.589 3.644 1.00 0.00 C ATOM 210 CG2 ILE A 13 106.121 7.238 3.821 1.00 0.00 C ATOM 211 CD1 ILE A 13 106.861 9.646 2.123 1.00 0.00 C ATOM 0 H ILE A 13 107.072 6.174 6.135 1.00 0.00 H new ATOM 0 HA ILE A 13 108.591 8.693 5.763 1.00 0.00 H new ATOM 0 HB ILE A 13 108.193 7.764 3.536 1.00 0.00 H new ATOM 0 HG12 ILE A 13 106.138 9.953 4.137 1.00 0.00 H new ATOM 0 HG13 ILE A 13 107.856 10.246 3.945 1.00 0.00 H new ATOM 0 HG21 ILE A 13 105.883 7.266 2.758 1.00 0.00 H new ATOM 0 HG22 ILE A 13 106.351 6.214 4.115 1.00 0.00 H new ATOM 0 HG23 ILE A 13 105.265 7.596 4.393 1.00 0.00 H new ATOM 0 HD11 ILE A 13 106.652 10.672 1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 13 107.774 9.302 1.636 1.00 0.00 H new ATOM 0 HD13 ILE A 13 106.030 9.005 1.830 1.00 0.00 H new ATOM 223 N THR A 14 106.766 9.943 6.900 1.00 0.00 N ATOM 224 CA THR A 14 105.739 10.645 7.664 1.00 0.00 C ATOM 225 C THR A 14 104.987 11.561 6.720 1.00 0.00 C ATOM 226 O THR A 14 105.588 12.400 6.045 1.00 0.00 O ATOM 227 CB THR A 14 106.352 11.460 8.800 1.00 0.00 C ATOM 228 OG1 THR A 14 107.258 10.649 9.536 1.00 0.00 O ATOM 229 CG2 THR A 14 105.240 11.954 9.731 1.00 0.00 C ATOM 0 H THR A 14 107.633 10.465 6.770 1.00 0.00 H new ATOM 0 HA THR A 14 105.063 9.915 8.110 1.00 0.00 H new ATOM 0 HB THR A 14 106.887 12.314 8.384 1.00 0.00 H new ATOM 0 HG1 THR A 14 106.757 10.080 10.157 1.00 0.00 H new ATOM 0 HG21 THR A 14 105.677 12.536 10.543 1.00 0.00 H new ATOM 0 HG22 THR A 14 104.546 12.579 9.169 1.00 0.00 H new ATOM 0 HG23 THR A 14 104.705 11.099 10.145 1.00 0.00 H new ATOM 237 N LEU A 15 103.681 11.349 6.641 1.00 0.00 N ATOM 238 CA LEU A 15 102.837 12.109 5.732 1.00 0.00 C ATOM 239 C LEU A 15 101.810 12.933 6.489 1.00 0.00 C ATOM 240 O LEU A 15 101.143 12.432 7.397 1.00 0.00 O ATOM 241 CB LEU A 15 102.134 11.127 4.786 1.00 0.00 C ATOM 242 CG LEU A 15 101.384 11.872 3.677 1.00 0.00 C ATOM 243 CD1 LEU A 15 102.375 12.567 2.730 1.00 0.00 C ATOM 244 CD2 LEU A 15 100.554 10.861 2.889 1.00 0.00 C ATOM 0 H LEU A 15 103.182 10.655 7.197 1.00 0.00 H new ATOM 0 HA LEU A 15 103.457 12.803 5.165 1.00 0.00 H new ATOM 0 HB2 LEU A 15 102.869 10.454 4.344 1.00 0.00 H new ATOM 0 HB3 LEU A 15 101.435 10.510 5.351 1.00 0.00 H new ATOM 0 HG LEU A 15 100.740 12.631 4.122 1.00 0.00 H new ATOM 0 HD11 LEU A 15 101.825 13.091 1.949 1.00 0.00 H new ATOM 0 HD12 LEU A 15 102.976 13.282 3.293 1.00 0.00 H new ATOM 0 HD13 LEU A 15 103.028 11.822 2.276 1.00 0.00 H new ATOM 0 HD21 LEU A 15 100.013 11.375 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 15 101.213 10.111 2.453 1.00 0.00 H new ATOM 0 HD23 LEU A 15 99.843 10.375 3.557 1.00 0.00 H new ATOM 256 N GLU A 16 101.693 14.195 6.093 1.00 0.00 N ATOM 257 CA GLU A 16 100.746 15.107 6.718 1.00 0.00 C ATOM 258 C GLU A 16 99.463 15.166 5.906 1.00 0.00 C ATOM 259 O GLU A 16 99.472 15.587 4.748 1.00 0.00 O ATOM 260 CB GLU A 16 101.350 16.506 6.811 1.00 0.00 C ATOM 261 CG GLU A 16 102.520 16.505 7.806 1.00 0.00 C ATOM 262 CD GLU A 16 103.190 17.890 7.878 1.00 0.00 C ATOM 263 OE1 GLU A 16 104.152 18.011 8.617 1.00 0.00 O ATOM 264 OE2 GLU A 16 102.738 18.810 7.204 1.00 0.00 O ATOM 0 H GLU A 16 102.243 14.609 5.341 1.00 0.00 H new ATOM 0 HA GLU A 16 100.522 14.742 7.720 1.00 0.00 H new ATOM 0 HB2 GLU A 16 101.697 16.828 5.829 1.00 0.00 H new ATOM 0 HB3 GLU A 16 100.590 17.219 7.130 1.00 0.00 H new ATOM 0 HG2 GLU A 16 102.160 16.220 8.795 1.00 0.00 H new ATOM 0 HG3 GLU A 16 103.255 15.758 7.507 1.00 0.00 H new ATOM 271 N VAL A 17 98.366 14.736 6.521 1.00 0.00 N ATOM 272 CA VAL A 17 97.067 14.736 5.850 1.00 0.00 C ATOM 273 C VAL A 17 95.973 15.164 6.823 1.00 0.00 C ATOM 274 O VAL A 17 96.264 15.535 7.960 1.00 0.00 O ATOM 275 CB VAL A 17 96.758 13.339 5.276 1.00 0.00 C ATOM 276 CG1 VAL A 17 97.807 12.983 4.223 1.00 0.00 C ATOM 277 CG2 VAL A 17 96.773 12.288 6.397 1.00 0.00 C ATOM 0 H VAL A 17 98.348 14.384 7.478 1.00 0.00 H new ATOM 0 HA VAL A 17 97.100 15.448 5.025 1.00 0.00 H new ATOM 0 HB VAL A 17 95.768 13.351 4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 17 97.592 11.996 3.815 1.00 0.00 H new ATOM 0 HG12 VAL A 17 97.782 13.721 3.421 1.00 0.00 H new ATOM 0 HG13 VAL A 17 98.796 12.979 4.682 1.00 0.00 H new ATOM 0 HG21 VAL A 17 96.553 11.306 5.978 1.00 0.00 H new ATOM 0 HG22 VAL A 17 97.757 12.271 6.866 1.00 0.00 H new ATOM 0 HG23 VAL A 17 96.020 12.541 7.143 1.00 0.00 H new ATOM 287 N GLU A 18 94.717 15.096 6.374 1.00 0.00 N ATOM 288 CA GLU A 18 93.591 15.463 7.226 1.00 0.00 C ATOM 289 C GLU A 18 92.441 14.454 7.067 1.00 0.00 C ATOM 290 O GLU A 18 92.316 13.835 6.014 1.00 0.00 O ATOM 291 CB GLU A 18 93.094 16.867 6.880 1.00 0.00 C ATOM 292 CG GLU A 18 94.133 17.901 7.317 1.00 0.00 C ATOM 293 CD GLU A 18 93.660 19.302 6.948 1.00 0.00 C ATOM 294 OE1 GLU A 18 94.169 19.843 5.981 1.00 0.00 O ATOM 295 OE2 GLU A 18 92.794 19.815 7.639 1.00 0.00 O ATOM 0 H GLU A 18 94.459 14.793 5.435 1.00 0.00 H new ATOM 0 HA GLU A 18 93.932 15.451 8.261 1.00 0.00 H new ATOM 0 HB2 GLU A 18 92.916 16.947 5.808 1.00 0.00 H new ATOM 0 HB3 GLU A 18 92.143 17.060 7.377 1.00 0.00 H new ATOM 0 HG2 GLU A 18 94.295 17.834 8.393 1.00 0.00 H new ATOM 0 HG3 GLU A 18 95.089 17.693 6.837 1.00 0.00 H new ATOM 302 N PRO A 19 91.593 14.279 8.078 1.00 0.00 N ATOM 303 CA PRO A 19 90.441 13.322 7.999 1.00 0.00 C ATOM 304 C PRO A 19 89.539 13.610 6.794 1.00 0.00 C ATOM 305 O PRO A 19 88.944 12.699 6.214 1.00 0.00 O ATOM 306 CB PRO A 19 89.684 13.548 9.314 1.00 0.00 C ATOM 307 CG PRO A 19 90.692 14.115 10.253 1.00 0.00 C ATOM 308 CD PRO A 19 91.629 14.954 9.400 1.00 0.00 C ATOM 0 HA PRO A 19 90.773 12.292 7.868 1.00 0.00 H new ATOM 0 HB2 PRO A 19 88.847 14.233 9.174 1.00 0.00 H new ATOM 0 HB3 PRO A 19 89.271 12.614 9.696 1.00 0.00 H new ATOM 0 HG2 PRO A 19 90.213 14.723 11.020 1.00 0.00 H new ATOM 0 HG3 PRO A 19 91.236 13.323 10.767 1.00 0.00 H new ATOM 0 HD2 PRO A 19 91.292 15.988 9.332 1.00 0.00 H new ATOM 0 HD3 PRO A 19 92.638 14.974 9.813 1.00 0.00 H new ATOM 316 N SER A 20 89.452 14.891 6.435 1.00 0.00 N ATOM 317 CA SER A 20 88.631 15.326 5.305 1.00 0.00 C ATOM 318 C SER A 20 89.261 14.930 3.966 1.00 0.00 C ATOM 319 O SER A 20 88.551 14.765 2.968 1.00 0.00 O ATOM 320 CB SER A 20 88.453 16.844 5.348 1.00 0.00 C ATOM 321 OG SER A 20 87.574 17.186 6.411 1.00 0.00 O ATOM 0 H SER A 20 89.942 15.648 6.912 1.00 0.00 H new ATOM 0 HA SER A 20 87.663 14.832 5.388 1.00 0.00 H new ATOM 0 HB2 SER A 20 89.418 17.331 5.489 1.00 0.00 H new ATOM 0 HB3 SER A 20 88.051 17.201 4.400 1.00 0.00 H new ATOM 0 HG SER A 20 87.460 18.159 6.441 1.00 0.00 H new ATOM 327 N ASP A 21 90.593 14.792 3.947 1.00 0.00 N ATOM 328 CA ASP A 21 91.306 14.433 2.726 1.00 0.00 C ATOM 329 C ASP A 21 90.925 13.031 2.284 1.00 0.00 C ATOM 330 O ASP A 21 90.786 12.125 3.111 1.00 0.00 O ATOM 331 CB ASP A 21 92.822 14.503 2.955 1.00 0.00 C ATOM 332 CG ASP A 21 93.311 15.958 2.980 1.00 0.00 C ATOM 333 OD1 ASP A 21 92.659 16.809 2.390 1.00 0.00 O ATOM 334 OD2 ASP A 21 94.333 16.200 3.600 1.00 0.00 O ATOM 0 H ASP A 21 91.192 14.924 4.762 1.00 0.00 H new ATOM 0 HA ASP A 21 91.028 15.142 1.946 1.00 0.00 H new ATOM 0 HB2 ASP A 21 93.073 14.015 3.897 1.00 0.00 H new ATOM 0 HB3 ASP A 21 93.338 13.956 2.166 1.00 0.00 H new ATOM 339 N THR A 22 90.752 12.866 0.975 1.00 0.00 N ATOM 340 CA THR A 22 90.378 11.577 0.413 1.00 0.00 C ATOM 341 C THR A 22 91.611 10.714 0.192 1.00 0.00 C ATOM 342 O THR A 22 92.726 11.224 0.115 1.00 0.00 O ATOM 343 CB THR A 22 89.644 11.782 -0.916 1.00 0.00 C ATOM 344 OG1 THR A 22 90.488 12.488 -1.814 1.00 0.00 O ATOM 345 CG2 THR A 22 88.355 12.575 -0.685 1.00 0.00 C ATOM 0 H THR A 22 90.865 13.610 0.286 1.00 0.00 H new ATOM 0 HA THR A 22 89.718 11.069 1.116 1.00 0.00 H new ATOM 0 HB THR A 22 89.389 10.811 -1.341 1.00 0.00 H new ATOM 0 HG1 THR A 22 90.022 12.620 -2.666 1.00 0.00 H new ATOM 0 HG21 THR A 22 87.839 12.716 -1.635 1.00 0.00 H new ATOM 0 HG22 THR A 22 87.709 12.027 0.001 1.00 0.00 H new ATOM 0 HG23 THR A 22 88.598 13.547 -0.256 1.00 0.00 H new ATOM 353 N ILE A 23 91.398 9.407 0.120 1.00 0.00 N ATOM 354 CA ILE A 23 92.500 8.463 -0.062 1.00 0.00 C ATOM 355 C ILE A 23 93.224 8.767 -1.372 1.00 0.00 C ATOM 356 O ILE A 23 94.459 8.760 -1.419 1.00 0.00 O ATOM 357 CB ILE A 23 91.974 7.010 -0.047 1.00 0.00 C ATOM 358 CG1 ILE A 23 91.140 6.744 1.243 1.00 0.00 C ATOM 359 CG2 ILE A 23 93.151 6.017 -0.141 1.00 0.00 C ATOM 360 CD1 ILE A 23 91.980 6.910 2.527 1.00 0.00 C ATOM 0 H ILE A 23 90.477 8.974 0.184 1.00 0.00 H new ATOM 0 HA ILE A 23 93.206 8.572 0.762 1.00 0.00 H new ATOM 0 HB ILE A 23 91.325 6.866 -0.911 1.00 0.00 H new ATOM 0 HG12 ILE A 23 90.294 7.430 1.274 1.00 0.00 H new ATOM 0 HG13 ILE A 23 90.731 5.734 1.207 1.00 0.00 H new ATOM 0 HG21 ILE A 23 92.768 4.997 -0.130 1.00 0.00 H new ATOM 0 HG22 ILE A 23 93.699 6.189 -1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 23 93.819 6.163 0.708 1.00 0.00 H new ATOM 0 HD11 ILE A 23 91.355 6.714 3.398 1.00 0.00 H new ATOM 0 HD12 ILE A 23 92.812 6.206 2.511 1.00 0.00 H new ATOM 0 HD13 ILE A 23 92.367 7.927 2.579 1.00 0.00 H new ATOM 372 N GLU A 24 92.455 9.048 -2.427 1.00 0.00 N ATOM 373 CA GLU A 24 93.040 9.375 -3.729 1.00 0.00 C ATOM 374 C GLU A 24 93.914 10.632 -3.621 1.00 0.00 C ATOM 375 O GLU A 24 94.957 10.735 -4.276 1.00 0.00 O ATOM 376 CB GLU A 24 91.922 9.619 -4.745 1.00 0.00 C ATOM 377 CG GLU A 24 92.522 9.761 -6.151 1.00 0.00 C ATOM 378 CD GLU A 24 91.430 9.963 -7.211 1.00 0.00 C ATOM 379 OE1 GLU A 24 90.310 10.304 -6.850 1.00 0.00 O ATOM 380 OE2 GLU A 24 91.733 9.767 -8.374 1.00 0.00 O ATOM 0 H GLU A 24 91.435 9.056 -2.406 1.00 0.00 H new ATOM 0 HA GLU A 24 93.660 8.540 -4.056 1.00 0.00 H new ATOM 0 HB2 GLU A 24 91.212 8.792 -4.724 1.00 0.00 H new ATOM 0 HB3 GLU A 24 91.369 10.521 -4.482 1.00 0.00 H new ATOM 0 HG2 GLU A 24 93.210 10.606 -6.170 1.00 0.00 H new ATOM 0 HG3 GLU A 24 93.103 8.871 -6.391 1.00 0.00 H new ATOM 387 N ASN A 25 93.491 11.561 -2.761 1.00 0.00 N ATOM 388 CA ASN A 25 94.242 12.794 -2.528 1.00 0.00 C ATOM 389 C ASN A 25 95.572 12.489 -1.839 1.00 0.00 C ATOM 390 O ASN A 25 96.598 13.098 -2.152 1.00 0.00 O ATOM 391 CB ASN A 25 93.423 13.774 -1.676 1.00 0.00 C ATOM 392 CG ASN A 25 92.387 14.505 -2.536 1.00 0.00 C ATOM 393 OD1 ASN A 25 92.532 14.599 -3.757 1.00 0.00 O ATOM 394 ND2 ASN A 25 91.344 15.041 -1.963 1.00 0.00 N ATOM 0 H ASN A 25 92.633 11.482 -2.215 1.00 0.00 H new ATOM 0 HA ASN A 25 94.444 13.256 -3.494 1.00 0.00 H new ATOM 0 HB2 ASN A 25 92.921 13.234 -0.874 1.00 0.00 H new ATOM 0 HB3 ASN A 25 94.088 14.498 -1.205 1.00 0.00 H new ATOM 0 HD21 ASN A 25 90.651 15.536 -2.525 1.00 0.00 H new ATOM 0 HD22 ASN A 25 91.221 14.965 -0.953 1.00 0.00 H new ATOM 401 N VAL A 26 95.535 11.547 -0.892 1.00 0.00 N ATOM 402 CA VAL A 26 96.728 11.154 -0.137 1.00 0.00 C ATOM 403 C VAL A 26 97.791 10.578 -1.073 1.00 0.00 C ATOM 404 O VAL A 26 98.977 10.895 -0.938 1.00 0.00 O ATOM 405 CB VAL A 26 96.353 10.110 0.941 1.00 0.00 C ATOM 406 CG1 VAL A 26 97.603 9.663 1.719 1.00 0.00 C ATOM 407 CG2 VAL A 26 95.345 10.723 1.925 1.00 0.00 C ATOM 0 H VAL A 26 94.689 11.041 -0.630 1.00 0.00 H new ATOM 0 HA VAL A 26 97.136 12.040 0.350 1.00 0.00 H new ATOM 0 HB VAL A 26 95.913 9.245 0.445 1.00 0.00 H new ATOM 0 HG11 VAL A 26 97.319 8.929 2.473 1.00 0.00 H new ATOM 0 HG12 VAL A 26 98.320 9.217 1.030 1.00 0.00 H new ATOM 0 HG13 VAL A 26 98.056 10.526 2.206 1.00 0.00 H new ATOM 0 HG21 VAL A 26 95.082 9.986 2.683 1.00 0.00 H new ATOM 0 HG22 VAL A 26 95.789 11.595 2.405 1.00 0.00 H new ATOM 0 HG23 VAL A 26 94.447 11.024 1.386 1.00 0.00 H new ATOM 417 N LYS A 27 97.367 9.712 -1.998 1.00 0.00 N ATOM 418 CA LYS A 27 98.309 9.080 -2.920 1.00 0.00 C ATOM 419 C LYS A 27 99.115 10.142 -3.663 1.00 0.00 C ATOM 420 O LYS A 27 100.342 10.043 -3.752 1.00 0.00 O ATOM 421 CB LYS A 27 97.565 8.192 -3.920 1.00 0.00 C ATOM 422 CG LYS A 27 96.965 6.993 -3.184 1.00 0.00 C ATOM 423 CD LYS A 27 96.223 6.101 -4.180 1.00 0.00 C ATOM 424 CE LYS A 27 95.631 4.898 -3.443 1.00 0.00 C ATOM 425 NZ LYS A 27 94.913 4.026 -4.414 1.00 0.00 N ATOM 0 H LYS A 27 96.393 9.437 -2.126 1.00 0.00 H new ATOM 0 HA LYS A 27 98.993 8.458 -2.342 1.00 0.00 H new ATOM 0 HB2 LYS A 27 96.777 8.761 -4.413 1.00 0.00 H new ATOM 0 HB3 LYS A 27 98.247 7.851 -4.699 1.00 0.00 H new ATOM 0 HG2 LYS A 27 97.753 6.426 -2.689 1.00 0.00 H new ATOM 0 HG3 LYS A 27 96.282 7.335 -2.407 1.00 0.00 H new ATOM 0 HD2 LYS A 27 95.431 6.666 -4.671 1.00 0.00 H new ATOM 0 HD3 LYS A 27 96.905 5.764 -4.961 1.00 0.00 H new ATOM 0 HE2 LYS A 27 96.423 4.335 -2.949 1.00 0.00 H new ATOM 0 HE3 LYS A 27 94.946 5.235 -2.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 94.425 3.264 -3.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 94.216 4.592 -4.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 95.596 3.613 -5.080 1.00 0.00 H new ATOM 439 N ALA A 28 98.421 11.149 -4.198 1.00 0.00 N ATOM 440 CA ALA A 28 99.085 12.225 -4.936 1.00 0.00 C ATOM 441 C ALA A 28 100.176 12.871 -4.083 1.00 0.00 C ATOM 442 O ALA A 28 101.256 13.186 -4.592 1.00 0.00 O ATOM 443 CB ALA A 28 98.063 13.283 -5.354 1.00 0.00 C ATOM 0 H ALA A 28 97.407 11.242 -4.135 1.00 0.00 H new ATOM 0 HA ALA A 28 99.545 11.797 -5.826 1.00 0.00 H new ATOM 0 HB1 ALA A 28 98.567 14.079 -5.902 1.00 0.00 H new ATOM 0 HB2 ALA A 28 97.306 12.826 -5.992 1.00 0.00 H new ATOM 0 HB3 ALA A 28 97.586 13.699 -4.466 1.00 0.00 H new ATOM 449 N LYS A 29 99.896 13.048 -2.788 1.00 0.00 N ATOM 450 CA LYS A 29 100.874 13.640 -1.872 1.00 0.00 C ATOM 451 C LYS A 29 102.108 12.744 -1.783 1.00 0.00 C ATOM 452 O LYS A 29 103.245 13.228 -1.783 1.00 0.00 O ATOM 453 CB LYS A 29 100.267 13.804 -0.476 1.00 0.00 C ATOM 454 CG LYS A 29 99.153 14.852 -0.513 1.00 0.00 C ATOM 455 CD LYS A 29 98.531 14.981 0.879 1.00 0.00 C ATOM 456 CE LYS A 29 97.413 16.026 0.848 1.00 0.00 C ATOM 457 NZ LYS A 29 96.809 16.147 2.206 1.00 0.00 N ATOM 0 H LYS A 29 99.009 12.792 -2.354 1.00 0.00 H new ATOM 0 HA LYS A 29 101.158 14.620 -2.255 1.00 0.00 H new ATOM 0 HB2 LYS A 29 99.870 12.850 -0.128 1.00 0.00 H new ATOM 0 HB3 LYS A 29 101.039 14.105 0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 29 99.553 15.813 -0.835 1.00 0.00 H new ATOM 0 HG3 LYS A 29 98.392 14.564 -1.238 1.00 0.00 H new ATOM 0 HD2 LYS A 29 98.134 14.018 1.201 1.00 0.00 H new ATOM 0 HD3 LYS A 29 99.293 15.270 1.603 1.00 0.00 H new ATOM 0 HE2 LYS A 29 97.810 16.989 0.527 1.00 0.00 H new ATOM 0 HE3 LYS A 29 96.651 15.738 0.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 96.642 17.150 2.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 95.906 15.632 2.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 97.458 15.743 2.912 1.00 0.00 H new ATOM 471 N ILE A 30 101.864 11.432 -1.717 1.00 0.00 N ATOM 472 CA ILE A 30 102.942 10.451 -1.639 1.00 0.00 C ATOM 473 C ILE A 30 103.780 10.508 -2.918 1.00 0.00 C ATOM 474 O ILE A 30 105.007 10.441 -2.862 1.00 0.00 O ATOM 475 CB ILE A 30 102.360 9.036 -1.437 1.00 0.00 C ATOM 476 CG1 ILE A 30 101.676 8.970 -0.062 1.00 0.00 C ATOM 477 CG2 ILE A 30 103.487 7.982 -1.488 1.00 0.00 C ATOM 478 CD1 ILE A 30 100.804 7.712 0.030 1.00 0.00 C ATOM 0 H ILE A 30 100.928 11.028 -1.716 1.00 0.00 H new ATOM 0 HA ILE A 30 103.580 10.684 -0.787 1.00 0.00 H new ATOM 0 HB ILE A 30 101.641 8.828 -2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 30 102.428 8.960 0.727 1.00 0.00 H new ATOM 0 HG13 ILE A 30 101.064 9.859 0.092 1.00 0.00 H new ATOM 0 HG21 ILE A 30 103.063 6.988 -1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 30 103.984 8.027 -2.457 1.00 0.00 H new ATOM 0 HG23 ILE A 30 104.211 8.185 -0.699 1.00 0.00 H new ATOM 0 HD11 ILE A 30 100.323 7.673 1.007 1.00 0.00 H new ATOM 0 HD12 ILE A 30 100.042 7.740 -0.749 1.00 0.00 H new ATOM 0 HD13 ILE A 30 101.426 6.827 -0.103 1.00 0.00 H new ATOM 490 N GLN A 31 103.103 10.615 -4.065 1.00 0.00 N ATOM 491 CA GLN A 31 103.788 10.659 -5.360 1.00 0.00 C ATOM 492 C GLN A 31 104.901 11.707 -5.342 1.00 0.00 C ATOM 493 O GLN A 31 105.983 11.475 -5.875 1.00 0.00 O ATOM 494 CB GLN A 31 102.777 10.988 -6.472 1.00 0.00 C ATOM 495 CG GLN A 31 103.465 10.953 -7.845 1.00 0.00 C ATOM 496 CD GLN A 31 102.479 11.336 -8.943 1.00 0.00 C ATOM 497 OE1 GLN A 31 101.656 12.230 -8.757 1.00 0.00 O ATOM 498 NE2 GLN A 31 102.528 10.716 -10.088 1.00 0.00 N ATOM 0 H GLN A 31 102.086 10.673 -4.123 1.00 0.00 H new ATOM 0 HA GLN A 31 104.233 9.683 -5.554 1.00 0.00 H new ATOM 0 HB2 GLN A 31 101.956 10.271 -6.450 1.00 0.00 H new ATOM 0 HB3 GLN A 31 102.344 11.973 -6.300 1.00 0.00 H new ATOM 0 HG2 GLN A 31 104.312 11.639 -7.852 1.00 0.00 H new ATOM 0 HG3 GLN A 31 103.861 9.956 -8.035 1.00 0.00 H new ATOM 0 HE21 GLN A 31 103.213 9.975 -10.238 1.00 0.00 H new ATOM 0 HE22 GLN A 31 101.882 10.972 -10.835 1.00 0.00 H new ATOM 507 N ASP A 32 104.616 12.856 -4.739 1.00 0.00 N ATOM 508 CA ASP A 32 105.593 13.941 -4.665 1.00 0.00 C ATOM 509 C ASP A 32 106.794 13.581 -3.786 1.00 0.00 C ATOM 510 O ASP A 32 107.921 13.989 -4.080 1.00 0.00 O ATOM 511 CB ASP A 32 104.917 15.203 -4.125 1.00 0.00 C ATOM 512 CG ASP A 32 104.242 15.962 -5.266 1.00 0.00 C ATOM 513 OD1 ASP A 32 104.849 16.082 -6.320 1.00 0.00 O ATOM 514 OD2 ASP A 32 103.122 16.404 -5.073 1.00 0.00 O ATOM 0 H ASP A 32 103.721 13.062 -4.295 1.00 0.00 H new ATOM 0 HA ASP A 32 105.968 14.116 -5.673 1.00 0.00 H new ATOM 0 HB2 ASP A 32 104.179 14.935 -3.369 1.00 0.00 H new ATOM 0 HB3 ASP A 32 105.655 15.841 -3.639 1.00 0.00 H new ATOM 519 N LYS A 33 106.547 12.851 -2.692 1.00 0.00 N ATOM 520 CA LYS A 33 107.624 12.480 -1.761 1.00 0.00 C ATOM 521 C LYS A 33 108.460 11.286 -2.231 1.00 0.00 C ATOM 522 O LYS A 33 109.687 11.314 -2.119 1.00 0.00 O ATOM 523 CB LYS A 33 107.046 12.160 -0.383 1.00 0.00 C ATOM 524 CG LYS A 33 106.516 13.440 0.263 1.00 0.00 C ATOM 525 CD LYS A 33 105.923 13.122 1.635 1.00 0.00 C ATOM 526 CE LYS A 33 105.425 14.415 2.284 1.00 0.00 C ATOM 527 NZ LYS A 33 104.309 14.979 1.473 1.00 0.00 N ATOM 0 H LYS A 33 105.623 12.508 -2.430 1.00 0.00 H new ATOM 0 HA LYS A 33 108.286 13.345 -1.716 1.00 0.00 H new ATOM 0 HB2 LYS A 33 106.243 11.429 -0.476 1.00 0.00 H new ATOM 0 HB3 LYS A 33 107.813 11.713 0.249 1.00 0.00 H new ATOM 0 HG2 LYS A 33 107.322 14.167 0.365 1.00 0.00 H new ATOM 0 HG3 LYS A 33 105.757 13.893 -0.375 1.00 0.00 H new ATOM 0 HD2 LYS A 33 105.101 12.413 1.533 1.00 0.00 H new ATOM 0 HD3 LYS A 33 106.674 12.650 2.268 1.00 0.00 H new ATOM 0 HE2 LYS A 33 105.086 14.217 3.301 1.00 0.00 H new ATOM 0 HE3 LYS A 33 106.239 15.137 2.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 103.705 15.571 2.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 104.698 15.557 0.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 103.744 14.203 1.073 1.00 0.00 H new ATOM 541 N GLU A 34 107.794 10.241 -2.718 1.00 0.00 N ATOM 542 CA GLU A 34 108.493 9.029 -3.164 1.00 0.00 C ATOM 543 C GLU A 34 108.697 9.000 -4.678 1.00 0.00 C ATOM 544 O GLU A 34 109.387 8.115 -5.189 1.00 0.00 O ATOM 545 CB GLU A 34 107.691 7.800 -2.740 1.00 0.00 C ATOM 546 CG GLU A 34 107.696 7.673 -1.209 1.00 0.00 C ATOM 547 CD GLU A 34 106.816 6.496 -0.747 1.00 0.00 C ATOM 548 OE1 GLU A 34 106.273 5.792 -1.590 1.00 0.00 O ATOM 549 OE2 GLU A 34 106.695 6.319 0.455 1.00 0.00 O ATOM 0 H GLU A 34 106.779 10.205 -2.815 1.00 0.00 H new ATOM 0 HA GLU A 34 109.479 9.027 -2.699 1.00 0.00 H new ATOM 0 HB2 GLU A 34 106.666 7.881 -3.103 1.00 0.00 H new ATOM 0 HB3 GLU A 34 108.119 6.904 -3.189 1.00 0.00 H new ATOM 0 HG2 GLU A 34 108.717 7.528 -0.856 1.00 0.00 H new ATOM 0 HG3 GLU A 34 107.333 8.599 -0.763 1.00 0.00 H new ATOM 556 N GLY A 35 108.110 9.966 -5.391 1.00 0.00 N ATOM 557 CA GLY A 35 108.248 10.036 -6.840 1.00 0.00 C ATOM 558 C GLY A 35 107.600 8.837 -7.530 1.00 0.00 C ATOM 559 O GLY A 35 107.968 8.509 -8.661 1.00 0.00 O ATOM 0 H GLY A 35 107.537 10.706 -4.985 1.00 0.00 H new ATOM 0 HA2 GLY A 35 107.791 10.956 -7.205 1.00 0.00 H new ATOM 0 HA3 GLY A 35 109.305 10.079 -7.103 1.00 0.00 H new ATOM 563 N ILE A 36 106.648 8.176 -6.851 1.00 0.00 N ATOM 564 CA ILE A 36 105.986 7.004 -7.433 1.00 0.00 C ATOM 565 C ILE A 36 104.526 7.330 -7.809 1.00 0.00 C ATOM 566 O ILE A 36 103.808 7.929 -7.002 1.00 0.00 O ATOM 567 CB ILE A 36 106.027 5.801 -6.467 1.00 0.00 C ATOM 568 CG1 ILE A 36 107.487 5.486 -6.107 1.00 0.00 C ATOM 569 CG2 ILE A 36 105.398 4.569 -7.147 1.00 0.00 C ATOM 570 CD1 ILE A 36 107.536 4.586 -4.872 1.00 0.00 C ATOM 0 H ILE A 36 106.326 8.429 -5.917 1.00 0.00 H new ATOM 0 HA ILE A 36 106.530 6.735 -8.338 1.00 0.00 H new ATOM 0 HB ILE A 36 105.468 6.045 -5.564 1.00 0.00 H new ATOM 0 HG12 ILE A 36 107.980 4.994 -6.946 1.00 0.00 H new ATOM 0 HG13 ILE A 36 108.031 6.411 -5.916 1.00 0.00 H new ATOM 0 HG21 ILE A 36 105.428 3.721 -6.463 1.00 0.00 H new ATOM 0 HG22 ILE A 36 104.363 4.787 -7.409 1.00 0.00 H new ATOM 0 HG23 ILE A 36 105.958 4.327 -8.050 1.00 0.00 H new ATOM 0 HD11 ILE A 36 108.574 4.367 -4.623 1.00 0.00 H new ATOM 0 HD12 ILE A 36 107.061 5.094 -4.033 1.00 0.00 H new ATOM 0 HD13 ILE A 36 107.008 3.655 -5.079 1.00 0.00 H new ATOM 582 N PRO A 37 104.064 6.944 -9.002 1.00 0.00 N ATOM 583 CA PRO A 37 102.663 7.216 -9.442 1.00 0.00 C ATOM 584 C PRO A 37 101.609 6.662 -8.459 1.00 0.00 C ATOM 585 O PRO A 37 101.838 5.617 -7.844 1.00 0.00 O ATOM 586 CB PRO A 37 102.549 6.530 -10.811 1.00 0.00 C ATOM 587 CG PRO A 37 103.693 5.578 -10.879 1.00 0.00 C ATOM 588 CD PRO A 37 104.800 6.214 -10.059 1.00 0.00 C ATOM 0 HA PRO A 37 102.466 8.287 -9.485 1.00 0.00 H new ATOM 0 HB2 PRO A 37 101.598 6.007 -10.909 1.00 0.00 H new ATOM 0 HB3 PRO A 37 102.597 7.259 -11.620 1.00 0.00 H new ATOM 0 HG2 PRO A 37 103.417 4.603 -10.476 1.00 0.00 H new ATOM 0 HG3 PRO A 37 104.010 5.419 -11.910 1.00 0.00 H new ATOM 0 HD2 PRO A 37 105.470 5.465 -9.638 1.00 0.00 H new ATOM 0 HD3 PRO A 37 105.411 6.886 -10.661 1.00 0.00 H new ATOM 596 N PRO A 38 100.461 7.331 -8.300 1.00 0.00 N ATOM 597 CA PRO A 38 99.384 6.862 -7.370 1.00 0.00 C ATOM 598 C PRO A 38 98.769 5.532 -7.813 1.00 0.00 C ATOM 599 O PRO A 38 98.320 4.742 -6.981 1.00 0.00 O ATOM 600 CB PRO A 38 98.343 7.989 -7.404 1.00 0.00 C ATOM 601 CG PRO A 38 98.578 8.718 -8.683 1.00 0.00 C ATOM 602 CD PRO A 38 100.064 8.585 -8.984 1.00 0.00 C ATOM 0 HA PRO A 38 99.772 6.670 -6.369 1.00 0.00 H new ATOM 0 HB2 PRO A 38 97.330 7.588 -7.363 1.00 0.00 H new ATOM 0 HB3 PRO A 38 98.458 8.654 -6.548 1.00 0.00 H new ATOM 0 HG2 PRO A 38 97.979 8.293 -9.488 1.00 0.00 H new ATOM 0 HG3 PRO A 38 98.292 9.766 -8.591 1.00 0.00 H new ATOM 0 HD2 PRO A 38 100.250 8.530 -10.057 1.00 0.00 H new ATOM 0 HD3 PRO A 38 100.625 9.440 -8.607 1.00 0.00 H new ATOM 610 N ASP A 39 98.757 5.301 -9.127 1.00 0.00 N ATOM 611 CA ASP A 39 98.196 4.072 -9.690 1.00 0.00 C ATOM 612 C ASP A 39 99.004 2.845 -9.267 1.00 0.00 C ATOM 613 O ASP A 39 98.442 1.763 -9.080 1.00 0.00 O ATOM 614 CB ASP A 39 98.169 4.161 -11.218 1.00 0.00 C ATOM 615 CG ASP A 39 96.906 4.882 -11.677 1.00 0.00 C ATOM 616 OD1 ASP A 39 97.033 5.852 -12.404 1.00 0.00 O ATOM 617 OD2 ASP A 39 95.829 4.452 -11.294 1.00 0.00 O ATOM 0 H ASP A 39 99.129 5.949 -9.821 1.00 0.00 H new ATOM 0 HA ASP A 39 97.181 3.964 -9.308 1.00 0.00 H new ATOM 0 HB2 ASP A 39 99.051 4.693 -11.575 1.00 0.00 H new ATOM 0 HB3 ASP A 39 98.203 3.161 -11.649 1.00 0.00 H new ATOM 622 N GLN A 40 100.324 3.016 -9.138 1.00 0.00 N ATOM 623 CA GLN A 40 101.205 1.906 -8.756 1.00 0.00 C ATOM 624 C GLN A 40 101.235 1.696 -7.233 1.00 0.00 C ATOM 625 O GLN A 40 101.846 0.735 -6.753 1.00 0.00 O ATOM 626 CB GLN A 40 102.628 2.173 -9.267 1.00 0.00 C ATOM 627 CG GLN A 40 103.421 0.861 -9.294 1.00 0.00 C ATOM 628 CD GLN A 40 104.821 1.092 -9.848 1.00 0.00 C ATOM 629 OE1 GLN A 40 105.602 1.857 -9.282 1.00 0.00 O ATOM 630 NE2 GLN A 40 105.189 0.458 -10.928 1.00 0.00 N ATOM 0 H GLN A 40 100.803 3.904 -9.291 1.00 0.00 H new ATOM 0 HA GLN A 40 100.809 0.998 -9.211 1.00 0.00 H new ATOM 0 HB2 GLN A 40 102.591 2.607 -10.266 1.00 0.00 H new ATOM 0 HB3 GLN A 40 103.126 2.897 -8.623 1.00 0.00 H new ATOM 0 HG2 GLN A 40 103.486 0.448 -8.287 1.00 0.00 H new ATOM 0 HG3 GLN A 40 102.898 0.126 -9.907 1.00 0.00 H new ATOM 0 HE21 GLN A 40 104.539 -0.175 -11.394 1.00 0.00 H new ATOM 0 HE22 GLN A 40 106.126 0.596 -11.306 1.00 0.00 H new ATOM 639 N GLN A 41 100.587 2.591 -6.478 1.00 0.00 N ATOM 640 CA GLN A 41 100.565 2.485 -5.022 1.00 0.00 C ATOM 641 C GLN A 41 99.185 2.095 -4.514 1.00 0.00 C ATOM 642 O GLN A 41 98.187 2.751 -4.824 1.00 0.00 O ATOM 643 CB GLN A 41 100.971 3.817 -4.396 1.00 0.00 C ATOM 644 CG GLN A 41 102.423 4.127 -4.755 1.00 0.00 C ATOM 645 CD GLN A 41 102.838 5.453 -4.134 1.00 0.00 C ATOM 646 OE1 GLN A 41 102.833 5.596 -2.913 1.00 0.00 O ATOM 647 NE2 GLN A 41 103.181 6.442 -4.909 1.00 0.00 N ATOM 0 H GLN A 41 100.075 3.390 -6.852 1.00 0.00 H new ATOM 0 HA GLN A 41 101.272 1.707 -4.736 1.00 0.00 H new ATOM 0 HB2 GLN A 41 100.319 4.613 -4.754 1.00 0.00 H new ATOM 0 HB3 GLN A 41 100.854 3.773 -3.313 1.00 0.00 H new ATOM 0 HG2 GLN A 41 103.074 3.329 -4.398 1.00 0.00 H new ATOM 0 HG3 GLN A 41 102.538 4.171 -5.838 1.00 0.00 H new ATOM 0 HE21 GLN A 41 103.184 6.319 -5.922 1.00 0.00 H new ATOM 0 HE22 GLN A 41 103.447 7.339 -4.503 1.00 0.00 H new ATOM 656 N ARG A 42 99.151 1.029 -3.718 1.00 0.00 N ATOM 657 CA ARG A 42 97.910 0.541 -3.130 1.00 0.00 C ATOM 658 C ARG A 42 98.050 0.539 -1.617 1.00 0.00 C ATOM 659 O ARG A 42 98.928 -0.135 -1.076 1.00 0.00 O ATOM 660 CB ARG A 42 97.615 -0.877 -3.618 1.00 0.00 C ATOM 661 CG ARG A 42 97.353 -0.855 -5.124 1.00 0.00 C ATOM 662 CD ARG A 42 97.158 -2.284 -5.623 1.00 0.00 C ATOM 663 NE ARG A 42 95.938 -2.853 -5.039 1.00 0.00 N ATOM 664 CZ ARG A 42 95.564 -4.132 -5.225 1.00 0.00 C ATOM 665 NH1 ARG A 42 96.286 -4.965 -5.939 1.00 0.00 N ATOM 666 NH2 ARG A 42 94.458 -4.554 -4.680 1.00 0.00 N ATOM 0 H ARG A 42 99.976 0.485 -3.465 1.00 0.00 H new ATOM 0 HA ARG A 42 97.088 1.192 -3.429 1.00 0.00 H new ATOM 0 HB2 ARG A 42 98.457 -1.532 -3.394 1.00 0.00 H new ATOM 0 HB3 ARG A 42 96.749 -1.280 -3.093 1.00 0.00 H new ATOM 0 HG2 ARG A 42 96.468 -0.257 -5.342 1.00 0.00 H new ATOM 0 HG3 ARG A 42 98.189 -0.387 -5.643 1.00 0.00 H new ATOM 0 HD2 ARG A 42 97.090 -2.293 -6.711 1.00 0.00 H new ATOM 0 HD3 ARG A 42 98.020 -2.894 -5.353 1.00 0.00 H new ATOM 0 HE ARG A 42 95.346 -2.251 -4.466 1.00 0.00 H new ATOM 0 HH11 ARG A 42 97.155 -4.647 -6.369 1.00 0.00 H new ATOM 0 HH12 ARG A 42 95.978 -5.929 -6.063 1.00 0.00 H new ATOM 0 HH21 ARG A 42 93.889 -3.917 -4.122 1.00 0.00 H new ATOM 0 HH22 ARG A 42 94.161 -5.521 -4.812 1.00 0.00 H new ATOM 680 N LEU A 43 97.199 1.310 -0.944 1.00 0.00 N ATOM 681 CA LEU A 43 97.250 1.412 0.510 1.00 0.00 C ATOM 682 C LEU A 43 96.257 0.464 1.171 1.00 0.00 C ATOM 683 O LEU A 43 95.104 0.363 0.748 1.00 0.00 O ATOM 684 CB LEU A 43 96.929 2.849 0.933 1.00 0.00 C ATOM 685 CG LEU A 43 98.138 3.761 0.674 1.00 0.00 C ATOM 686 CD1 LEU A 43 97.695 5.226 0.719 1.00 0.00 C ATOM 687 CD2 LEU A 43 99.200 3.525 1.757 1.00 0.00 C ATOM 0 H LEU A 43 96.468 1.871 -1.382 1.00 0.00 H new ATOM 0 HA LEU A 43 98.254 1.136 0.832 1.00 0.00 H new ATOM 0 HB2 LEU A 43 96.064 3.214 0.380 1.00 0.00 H new ATOM 0 HB3 LEU A 43 96.665 2.874 1.990 1.00 0.00 H new ATOM 0 HG LEU A 43 98.555 3.534 -0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 43 98.554 5.872 0.535 1.00 0.00 H new ATOM 0 HD12 LEU A 43 96.939 5.401 -0.046 1.00 0.00 H new ATOM 0 HD13 LEU A 43 97.277 5.450 1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 43 100.058 4.172 1.573 1.00 0.00 H new ATOM 0 HD22 LEU A 43 98.778 3.752 2.736 1.00 0.00 H new ATOM 0 HD23 LEU A 43 99.520 2.483 1.732 1.00 0.00 H new ATOM 699 N ILE A 44 96.720 -0.204 2.230 1.00 0.00 N ATOM 700 CA ILE A 44 95.880 -1.121 2.990 1.00 0.00 C ATOM 701 C ILE A 44 95.952 -0.756 4.464 1.00 0.00 C ATOM 702 O ILE A 44 97.016 -0.418 4.990 1.00 0.00 O ATOM 703 CB ILE A 44 96.289 -2.591 2.771 1.00 0.00 C ATOM 704 CG1 ILE A 44 96.085 -2.935 1.285 1.00 0.00 C ATOM 705 CG2 ILE A 44 95.417 -3.522 3.647 1.00 0.00 C ATOM 706 CD1 ILE A 44 96.620 -4.337 0.981 1.00 0.00 C ATOM 0 H ILE A 44 97.675 -0.124 2.578 1.00 0.00 H new ATOM 0 HA ILE A 44 94.853 -1.024 2.637 1.00 0.00 H new ATOM 0 HB ILE A 44 97.333 -2.731 3.051 1.00 0.00 H new ATOM 0 HG12 ILE A 44 95.025 -2.882 1.035 1.00 0.00 H new ATOM 0 HG13 ILE A 44 96.596 -2.201 0.662 1.00 0.00 H new ATOM 0 HG21 ILE A 44 95.714 -4.558 3.485 1.00 0.00 H new ATOM 0 HG22 ILE A 44 95.553 -3.266 4.698 1.00 0.00 H new ATOM 0 HG23 ILE A 44 94.368 -3.399 3.377 1.00 0.00 H new ATOM 0 HD11 ILE A 44 96.468 -4.564 -0.074 1.00 0.00 H new ATOM 0 HD12 ILE A 44 97.685 -4.378 1.211 1.00 0.00 H new ATOM 0 HD13 ILE A 44 96.089 -5.069 1.590 1.00 0.00 H new ATOM 718 N PHE A 45 94.799 -0.841 5.107 1.00 0.00 N ATOM 719 CA PHE A 45 94.687 -0.533 6.522 1.00 0.00 C ATOM 720 C PHE A 45 93.716 -1.494 7.192 1.00 0.00 C ATOM 721 O PHE A 45 92.545 -1.566 6.825 1.00 0.00 O ATOM 722 CB PHE A 45 94.200 0.915 6.696 1.00 0.00 C ATOM 723 CG PHE A 45 94.180 1.298 8.164 1.00 0.00 C ATOM 724 CD1 PHE A 45 92.958 1.474 8.830 1.00 0.00 C ATOM 725 CD2 PHE A 45 95.383 1.473 8.859 1.00 0.00 C ATOM 726 CE1 PHE A 45 92.942 1.828 10.184 1.00 0.00 C ATOM 727 CE2 PHE A 45 95.365 1.826 10.214 1.00 0.00 C ATOM 728 CZ PHE A 45 94.145 2.002 10.877 1.00 0.00 C ATOM 0 H PHE A 45 93.923 -1.123 4.668 1.00 0.00 H new ATOM 0 HA PHE A 45 95.665 -0.642 6.991 1.00 0.00 H new ATOM 0 HB2 PHE A 45 94.853 1.593 6.146 1.00 0.00 H new ATOM 0 HB3 PHE A 45 93.201 1.022 6.273 1.00 0.00 H new ATOM 0 HD1 PHE A 45 92.029 1.336 8.297 1.00 0.00 H new ATOM 0 HD2 PHE A 45 96.325 1.336 8.350 1.00 0.00 H new ATOM 0 HE1 PHE A 45 92.000 1.967 10.694 1.00 0.00 H new ATOM 0 HE2 PHE A 45 96.294 1.963 10.748 1.00 0.00 H new ATOM 0 HZ PHE A 45 94.132 2.272 11.923 1.00 0.00 H new ATOM 738 N ALA A 46 94.223 -2.219 8.186 1.00 0.00 N ATOM 739 CA ALA A 46 93.418 -3.184 8.946 1.00 0.00 C ATOM 740 C ALA A 46 93.050 -4.413 8.099 1.00 0.00 C ATOM 741 O ALA A 46 92.021 -5.056 8.339 1.00 0.00 O ATOM 742 CB ALA A 46 92.138 -2.513 9.472 1.00 0.00 C ATOM 0 H ALA A 46 95.195 -2.159 8.489 1.00 0.00 H new ATOM 0 HA ALA A 46 94.023 -3.524 9.786 1.00 0.00 H new ATOM 0 HB1 ALA A 46 91.551 -3.240 10.033 1.00 0.00 H new ATOM 0 HB2 ALA A 46 92.405 -1.681 10.123 1.00 0.00 H new ATOM 0 HB3 ALA A 46 91.550 -2.142 8.632 1.00 0.00 H new ATOM 748 N GLY A 47 93.905 -4.751 7.129 1.00 0.00 N ATOM 749 CA GLY A 47 93.673 -5.920 6.272 1.00 0.00 C ATOM 750 C GLY A 47 92.700 -5.635 5.119 1.00 0.00 C ATOM 751 O GLY A 47 92.259 -6.568 4.443 1.00 0.00 O ATOM 0 H GLY A 47 94.760 -4.236 6.917 1.00 0.00 H new ATOM 0 HA2 GLY A 47 94.625 -6.258 5.862 1.00 0.00 H new ATOM 0 HA3 GLY A 47 93.280 -6.736 6.878 1.00 0.00 H new ATOM 755 N LYS A 48 92.373 -4.358 4.897 1.00 0.00 N ATOM 756 CA LYS A 48 91.450 -3.977 3.817 1.00 0.00 C ATOM 757 C LYS A 48 92.000 -2.785 3.041 1.00 0.00 C ATOM 758 O LYS A 48 92.690 -1.934 3.609 1.00 0.00 O ATOM 759 CB LYS A 48 90.061 -3.634 4.380 1.00 0.00 C ATOM 760 CG LYS A 48 90.171 -2.521 5.432 1.00 0.00 C ATOM 761 CD LYS A 48 88.779 -2.154 5.947 1.00 0.00 C ATOM 762 CE LYS A 48 88.902 -1.055 7.006 1.00 0.00 C ATOM 763 NZ LYS A 48 87.547 -0.688 7.506 1.00 0.00 N ATOM 0 H LYS A 48 92.729 -3.574 5.444 1.00 0.00 H new ATOM 0 HA LYS A 48 91.353 -4.828 3.142 1.00 0.00 H new ATOM 0 HB2 LYS A 48 89.402 -3.316 3.572 1.00 0.00 H new ATOM 0 HB3 LYS A 48 89.613 -4.522 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 48 90.799 -2.851 6.259 1.00 0.00 H new ATOM 0 HG3 LYS A 48 90.651 -1.644 4.998 1.00 0.00 H new ATOM 0 HD2 LYS A 48 88.153 -1.812 5.123 1.00 0.00 H new ATOM 0 HD3 LYS A 48 88.294 -3.032 6.373 1.00 0.00 H new ATOM 0 HE2 LYS A 48 89.524 -1.400 7.832 1.00 0.00 H new ATOM 0 HE3 LYS A 48 89.393 -0.180 6.581 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 87.633 0.058 8.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 86.967 -0.342 6.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 87.094 -1.524 7.927 1.00 0.00 H new ATOM 777 N GLN A 49 91.684 -2.722 1.746 1.00 0.00 N ATOM 778 CA GLN A 49 92.148 -1.627 0.903 1.00 0.00 C ATOM 779 C GLN A 49 91.329 -0.367 1.143 1.00 0.00 C ATOM 780 O GLN A 49 90.144 -0.438 1.481 1.00 0.00 O ATOM 781 CB GLN A 49 92.042 -2.021 -0.569 1.00 0.00 C ATOM 782 CG GLN A 49 92.811 -1.012 -1.425 1.00 0.00 C ATOM 783 CD GLN A 49 92.782 -1.435 -2.893 1.00 0.00 C ATOM 784 OE1 GLN A 49 92.617 -2.618 -3.208 1.00 0.00 O ATOM 785 NE2 GLN A 49 92.930 -0.534 -3.822 1.00 0.00 N ATOM 0 H GLN A 49 91.111 -3.414 1.263 1.00 0.00 H new ATOM 0 HA GLN A 49 93.188 -1.424 1.159 1.00 0.00 H new ATOM 0 HB2 GLN A 49 92.446 -3.023 -0.718 1.00 0.00 H new ATOM 0 HB3 GLN A 49 90.996 -2.050 -0.874 1.00 0.00 H new ATOM 0 HG2 GLN A 49 92.370 -0.021 -1.316 1.00 0.00 H new ATOM 0 HG3 GLN A 49 93.842 -0.942 -1.079 1.00 0.00 H new ATOM 0 HE21 GLN A 49 93.066 0.444 -3.567 1.00 0.00 H new ATOM 0 HE22 GLN A 49 92.909 -0.807 -4.805 1.00 0.00 H new ATOM 794 N LEU A 50 91.977 0.782 0.953 1.00 0.00 N ATOM 795 CA LEU A 50 91.324 2.069 1.136 1.00 0.00 C ATOM 796 C LEU A 50 90.698 2.532 -0.172 1.00 0.00 C ATOM 797 O LEU A 50 91.363 2.567 -1.212 1.00 0.00 O ATOM 798 CB LEU A 50 92.345 3.099 1.625 1.00 0.00 C ATOM 799 CG LEU A 50 92.820 2.732 3.037 1.00 0.00 C ATOM 800 CD1 LEU A 50 94.067 3.547 3.379 1.00 0.00 C ATOM 801 CD2 LEU A 50 91.720 3.049 4.059 1.00 0.00 C ATOM 0 H LEU A 50 92.956 0.843 0.672 1.00 0.00 H new ATOM 0 HA LEU A 50 90.535 1.966 1.881 1.00 0.00 H new ATOM 0 HB2 LEU A 50 93.195 3.134 0.943 1.00 0.00 H new ATOM 0 HB3 LEU A 50 91.899 4.093 1.629 1.00 0.00 H new ATOM 0 HG LEU A 50 93.049 1.667 3.070 1.00 0.00 H new ATOM 0 HD11 LEU A 50 94.407 3.288 4.382 1.00 0.00 H new ATOM 0 HD12 LEU A 50 94.855 3.325 2.660 1.00 0.00 H new ATOM 0 HD13 LEU A 50 93.829 4.610 3.339 1.00 0.00 H new ATOM 0 HD21 LEU A 50 92.065 2.785 5.059 1.00 0.00 H new ATOM 0 HD22 LEU A 50 91.487 4.113 4.024 1.00 0.00 H new ATOM 0 HD23 LEU A 50 90.825 2.474 3.821 1.00 0.00 H new ATOM 813 N GLU A 51 89.414 2.869 -0.106 1.00 0.00 N ATOM 814 CA GLU A 51 88.678 3.317 -1.283 1.00 0.00 C ATOM 815 C GLU A 51 89.063 4.746 -1.649 1.00 0.00 C ATOM 816 O GLU A 51 88.994 5.649 -0.812 1.00 0.00 O ATOM 817 CB GLU A 51 87.174 3.243 -1.010 1.00 0.00 C ATOM 818 CG GLU A 51 86.398 3.428 -2.321 1.00 0.00 C ATOM 819 CD GLU A 51 86.546 2.201 -3.233 1.00 0.00 C ATOM 820 OE1 GLU A 51 87.102 1.200 -2.798 1.00 0.00 O ATOM 821 OE2 GLU A 51 86.102 2.283 -4.367 1.00 0.00 O ATOM 0 H GLU A 51 88.861 2.840 0.751 1.00 0.00 H new ATOM 0 HA GLU A 51 88.931 2.665 -2.119 1.00 0.00 H new ATOM 0 HB2 GLU A 51 86.923 2.282 -0.561 1.00 0.00 H new ATOM 0 HB3 GLU A 51 86.887 4.014 -0.295 1.00 0.00 H new ATOM 0 HG2 GLU A 51 85.344 3.596 -2.102 1.00 0.00 H new ATOM 0 HG3 GLU A 51 86.761 4.315 -2.839 1.00 0.00 H new ATOM 828 N ASP A 52 89.475 4.928 -2.900 1.00 0.00 N ATOM 829 CA ASP A 52 89.890 6.241 -3.392 1.00 0.00 C ATOM 830 C ASP A 52 88.766 7.268 -3.267 1.00 0.00 C ATOM 831 O ASP A 52 89.028 8.439 -2.979 1.00 0.00 O ATOM 832 CB ASP A 52 90.326 6.132 -4.856 1.00 0.00 C ATOM 833 CG ASP A 52 91.791 5.702 -4.946 1.00 0.00 C ATOM 834 OD1 ASP A 52 92.587 6.189 -4.158 1.00 0.00 O ATOM 835 OD2 ASP A 52 92.098 4.894 -5.808 1.00 0.00 O ATOM 0 H ASP A 52 89.531 4.182 -3.594 1.00 0.00 H new ATOM 0 HA ASP A 52 90.726 6.579 -2.780 1.00 0.00 H new ATOM 0 HB2 ASP A 52 89.696 5.411 -5.377 1.00 0.00 H new ATOM 0 HB3 ASP A 52 90.191 7.092 -5.355 1.00 0.00 H new ATOM 840 N GLY A 53 87.529 6.823 -3.492 1.00 0.00 N ATOM 841 CA GLY A 53 86.362 7.709 -3.415 1.00 0.00 C ATOM 842 C GLY A 53 85.871 7.924 -1.977 1.00 0.00 C ATOM 843 O GLY A 53 84.788 8.481 -1.774 1.00 0.00 O ATOM 0 H GLY A 53 87.307 5.856 -3.729 1.00 0.00 H new ATOM 0 HA2 GLY A 53 86.614 8.673 -3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 53 85.552 7.288 -4.011 1.00 0.00 H new ATOM 847 N ARG A 54 86.661 7.487 -0.993 1.00 0.00 N ATOM 848 CA ARG A 54 86.295 7.645 0.414 1.00 0.00 C ATOM 849 C ARG A 54 87.313 8.507 1.139 1.00 0.00 C ATOM 850 O ARG A 54 88.406 8.759 0.626 1.00 0.00 O ATOM 851 CB ARG A 54 86.199 6.281 1.098 1.00 0.00 C ATOM 852 CG ARG A 54 84.970 5.538 0.573 1.00 0.00 C ATOM 853 CD ARG A 54 84.769 4.248 1.366 1.00 0.00 C ATOM 854 NE ARG A 54 83.593 3.530 0.864 1.00 0.00 N ATOM 855 CZ ARG A 54 82.993 2.544 1.551 1.00 0.00 C ATOM 856 NH1 ARG A 54 83.429 2.164 2.731 1.00 0.00 N ATOM 857 NH2 ARG A 54 81.952 1.951 1.035 1.00 0.00 N ATOM 0 H ARG A 54 87.556 7.022 -1.146 1.00 0.00 H new ATOM 0 HA ARG A 54 85.322 8.135 0.456 1.00 0.00 H new ATOM 0 HB2 ARG A 54 87.100 5.700 0.904 1.00 0.00 H new ATOM 0 HB3 ARG A 54 86.128 6.407 2.178 1.00 0.00 H new ATOM 0 HG2 ARG A 54 84.087 6.171 0.660 1.00 0.00 H new ATOM 0 HG3 ARG A 54 85.096 5.310 -0.485 1.00 0.00 H new ATOM 0 HD2 ARG A 54 85.654 3.617 1.281 1.00 0.00 H new ATOM 0 HD3 ARG A 54 84.641 4.478 2.424 1.00 0.00 H new ATOM 0 HE ARG A 54 83.214 3.791 -0.046 1.00 0.00 H new ATOM 0 HH11 ARG A 54 84.241 2.621 3.146 1.00 0.00 H new ATOM 0 HH12 ARG A 54 82.955 1.412 3.232 1.00 0.00 H new ATOM 0 HH21 ARG A 54 81.603 2.238 0.120 1.00 0.00 H new ATOM 0 HH22 ARG A 54 81.487 1.201 1.546 1.00 0.00 H new ATOM 871 N THR A 55 86.939 8.962 2.337 1.00 0.00 N ATOM 872 CA THR A 55 87.817 9.810 3.142 1.00 0.00 C ATOM 873 C THR A 55 88.392 9.038 4.324 1.00 0.00 C ATOM 874 O THR A 55 87.898 7.971 4.687 1.00 0.00 O ATOM 875 CB THR A 55 87.056 11.040 3.649 1.00 0.00 C ATOM 876 OG1 THR A 55 85.944 10.622 4.425 1.00 0.00 O ATOM 877 CG2 THR A 55 86.572 11.883 2.464 1.00 0.00 C ATOM 0 H THR A 55 86.038 8.758 2.769 1.00 0.00 H new ATOM 0 HA THR A 55 88.641 10.135 2.506 1.00 0.00 H new ATOM 0 HB THR A 55 87.722 11.644 4.265 1.00 0.00 H new ATOM 0 HG1 THR A 55 85.286 10.185 3.845 1.00 0.00 H new ATOM 0 HG21 THR A 55 86.032 12.755 2.834 1.00 0.00 H new ATOM 0 HG22 THR A 55 87.429 12.210 1.876 1.00 0.00 H new ATOM 0 HG23 THR A 55 85.910 11.285 1.838 1.00 0.00 H new ATOM 885 N LEU A 56 89.461 9.588 4.900 1.00 0.00 N ATOM 886 CA LEU A 56 90.142 8.958 6.026 1.00 0.00 C ATOM 887 C LEU A 56 89.210 8.832 7.228 1.00 0.00 C ATOM 888 O LEU A 56 89.204 7.800 7.905 1.00 0.00 O ATOM 889 CB LEU A 56 91.376 9.782 6.413 1.00 0.00 C ATOM 890 CG LEU A 56 92.428 9.711 5.298 1.00 0.00 C ATOM 891 CD1 LEU A 56 93.499 10.776 5.538 1.00 0.00 C ATOM 892 CD2 LEU A 56 93.094 8.328 5.290 1.00 0.00 C ATOM 0 H LEU A 56 89.874 10.472 4.602 1.00 0.00 H new ATOM 0 HA LEU A 56 90.450 7.957 5.723 1.00 0.00 H new ATOM 0 HB2 LEU A 56 91.090 10.819 6.588 1.00 0.00 H new ATOM 0 HB3 LEU A 56 91.797 9.405 7.345 1.00 0.00 H new ATOM 0 HG LEU A 56 91.938 9.884 4.340 1.00 0.00 H new ATOM 0 HD11 LEU A 56 94.246 10.726 4.746 1.00 0.00 H new ATOM 0 HD12 LEU A 56 93.037 11.763 5.538 1.00 0.00 H new ATOM 0 HD13 LEU A 56 93.978 10.599 6.501 1.00 0.00 H new ATOM 0 HD21 LEU A 56 93.839 8.287 4.495 1.00 0.00 H new ATOM 0 HD22 LEU A 56 93.578 8.152 6.251 1.00 0.00 H new ATOM 0 HD23 LEU A 56 92.338 7.561 5.118 1.00 0.00 H new ATOM 904 N SER A 57 88.424 9.880 7.488 1.00 0.00 N ATOM 905 CA SER A 57 87.488 9.865 8.615 1.00 0.00 C ATOM 906 C SER A 57 86.491 8.709 8.481 1.00 0.00 C ATOM 907 O SER A 57 86.067 8.131 9.483 1.00 0.00 O ATOM 908 CB SER A 57 86.721 11.184 8.682 1.00 0.00 C ATOM 909 OG SER A 57 85.963 11.349 7.492 1.00 0.00 O ATOM 0 H SER A 57 88.416 10.740 6.940 1.00 0.00 H new ATOM 0 HA SER A 57 88.066 9.731 9.529 1.00 0.00 H new ATOM 0 HB2 SER A 57 86.062 11.191 9.550 1.00 0.00 H new ATOM 0 HB3 SER A 57 87.415 12.016 8.803 1.00 0.00 H new ATOM 0 HG SER A 57 85.469 12.194 7.534 1.00 0.00 H new ATOM 915 N ASP A 58 86.144 8.381 7.237 1.00 0.00 N ATOM 916 CA ASP A 58 85.207 7.289 6.959 1.00 0.00 C ATOM 917 C ASP A 58 85.800 5.923 7.327 1.00 0.00 C ATOM 918 O ASP A 58 85.066 4.934 7.419 1.00 0.00 O ATOM 919 CB ASP A 58 84.820 7.298 5.478 1.00 0.00 C ATOM 920 CG ASP A 58 83.964 8.523 5.148 1.00 0.00 C ATOM 921 OD1 ASP A 58 83.219 8.965 6.011 1.00 0.00 O ATOM 922 OD2 ASP A 58 84.074 9.010 4.036 1.00 0.00 O ATOM 0 H ASP A 58 86.496 8.854 6.405 1.00 0.00 H new ATOM 0 HA ASP A 58 84.322 7.449 7.575 1.00 0.00 H new ATOM 0 HB2 ASP A 58 85.719 7.301 4.862 1.00 0.00 H new ATOM 0 HB3 ASP A 58 84.270 6.389 5.235 1.00 0.00 H new ATOM 927 N TYR A 59 87.123 5.869 7.526 1.00 0.00 N ATOM 928 CA TYR A 59 87.798 4.617 7.874 1.00 0.00 C ATOM 929 C TYR A 59 88.186 4.562 9.351 1.00 0.00 C ATOM 930 O TYR A 59 88.956 3.682 9.746 1.00 0.00 O ATOM 931 CB TYR A 59 89.054 4.440 7.013 1.00 0.00 C ATOM 932 CG TYR A 59 88.681 3.861 5.664 1.00 0.00 C ATOM 933 CD1 TYR A 59 88.549 4.700 4.555 1.00 0.00 C ATOM 934 CD2 TYR A 59 88.469 2.482 5.529 1.00 0.00 C ATOM 935 CE1 TYR A 59 88.203 4.166 3.311 1.00 0.00 C ATOM 936 CE2 TYR A 59 88.123 1.947 4.283 1.00 0.00 C ATOM 937 CZ TYR A 59 87.991 2.790 3.173 1.00 0.00 C ATOM 938 OH TYR A 59 87.649 2.266 1.945 1.00 0.00 O ATOM 0 H TYR A 59 87.743 6.675 7.452 1.00 0.00 H new ATOM 0 HA TYR A 59 87.094 3.808 7.682 1.00 0.00 H new ATOM 0 HB2 TYR A 59 89.552 5.400 6.880 1.00 0.00 H new ATOM 0 HB3 TYR A 59 89.761 3.781 7.518 1.00 0.00 H new ATOM 0 HD1 TYR A 59 88.714 5.762 4.659 1.00 0.00 H new ATOM 0 HD2 TYR A 59 88.573 1.833 6.386 1.00 0.00 H new ATOM 0 HE1 TYR A 59 88.099 4.816 2.455 1.00 0.00 H new ATOM 0 HE2 TYR A 59 87.958 0.885 4.178 1.00 0.00 H new ATOM 0 HH TYR A 59 87.539 1.295 2.023 1.00 0.00 H new ATOM 948 N ASN A 60 87.657 5.482 10.170 1.00 0.00 N ATOM 949 CA ASN A 60 87.969 5.490 11.599 1.00 0.00 C ATOM 950 C ASN A 60 89.482 5.587 11.824 1.00 0.00 C ATOM 951 O ASN A 60 90.038 4.936 12.718 1.00 0.00 O ATOM 952 CB ASN A 60 87.401 4.225 12.262 1.00 0.00 C ATOM 953 CG ASN A 60 85.875 4.258 12.234 1.00 0.00 C ATOM 954 OD1 ASN A 60 85.271 5.313 12.431 1.00 0.00 O ATOM 955 ND2 ASN A 60 85.214 3.158 11.999 1.00 0.00 N ATOM 0 H ASN A 60 87.020 6.219 9.869 1.00 0.00 H new ATOM 0 HA ASN A 60 87.507 6.365 12.055 1.00 0.00 H new ATOM 0 HB2 ASN A 60 87.763 3.338 11.741 1.00 0.00 H new ATOM 0 HB3 ASN A 60 87.752 4.156 13.292 1.00 0.00 H new ATOM 0 HD21 ASN A 60 84.194 3.170 11.978 1.00 0.00 H new ATOM 0 HD22 ASN A 60 85.717 2.286 11.836 1.00 0.00 H new ATOM 962 N ILE A 61 90.137 6.417 11.010 1.00 0.00 N ATOM 963 CA ILE A 61 91.582 6.617 11.122 1.00 0.00 C ATOM 964 C ILE A 61 91.837 7.829 12.014 1.00 0.00 C ATOM 965 O ILE A 61 91.350 8.929 11.734 1.00 0.00 O ATOM 966 CB ILE A 61 92.206 6.842 9.728 1.00 0.00 C ATOM 967 CG1 ILE A 61 91.929 5.620 8.834 1.00 0.00 C ATOM 968 CG2 ILE A 61 93.728 7.032 9.863 1.00 0.00 C ATOM 969 CD1 ILE A 61 92.203 5.973 7.366 1.00 0.00 C ATOM 0 H ILE A 61 89.692 6.959 10.269 1.00 0.00 H new ATOM 0 HA ILE A 61 92.042 5.730 11.558 1.00 0.00 H new ATOM 0 HB ILE A 61 91.765 7.733 9.281 1.00 0.00 H new ATOM 0 HG12 ILE A 61 92.559 4.785 9.140 1.00 0.00 H new ATOM 0 HG13 ILE A 61 90.894 5.299 8.953 1.00 0.00 H new ATOM 0 HG21 ILE A 61 94.164 7.190 8.877 1.00 0.00 H new ATOM 0 HG22 ILE A 61 93.932 7.898 10.493 1.00 0.00 H new ATOM 0 HG23 ILE A 61 94.167 6.143 10.315 1.00 0.00 H new ATOM 0 HD11 ILE A 61 92.005 5.103 6.740 1.00 0.00 H new ATOM 0 HD12 ILE A 61 91.554 6.795 7.062 1.00 0.00 H new ATOM 0 HD13 ILE A 61 93.245 6.272 7.252 1.00 0.00 H new ATOM 981 N GLN A 62 92.583 7.611 13.096 1.00 0.00 N ATOM 982 CA GLN A 62 92.887 8.676 14.043 1.00 0.00 C ATOM 983 C GLN A 62 94.265 9.283 13.766 1.00 0.00 C ATOM 984 O GLN A 62 94.944 8.902 12.811 1.00 0.00 O ATOM 985 CB GLN A 62 92.827 8.124 15.474 1.00 0.00 C ATOM 986 CG GLN A 62 91.378 7.771 15.825 1.00 0.00 C ATOM 987 CD GLN A 62 91.300 7.178 17.230 1.00 0.00 C ATOM 988 OE1 GLN A 62 92.101 6.313 17.588 1.00 0.00 O ATOM 989 NE2 GLN A 62 90.372 7.592 18.051 1.00 0.00 N ATOM 0 H GLN A 62 92.987 6.706 13.336 1.00 0.00 H new ATOM 0 HA GLN A 62 92.145 9.466 13.928 1.00 0.00 H new ATOM 0 HB2 GLN A 62 93.459 7.240 15.561 1.00 0.00 H new ATOM 0 HB3 GLN A 62 93.213 8.863 16.177 1.00 0.00 H new ATOM 0 HG2 GLN A 62 90.755 8.663 15.765 1.00 0.00 H new ATOM 0 HG3 GLN A 62 90.985 7.058 15.100 1.00 0.00 H new ATOM 0 HE21 GLN A 62 89.710 8.308 17.753 1.00 0.00 H new ATOM 0 HE22 GLN A 62 90.310 7.199 18.990 1.00 0.00 H new ATOM 998 N LYS A 63 94.658 10.226 14.620 1.00 0.00 N ATOM 999 CA LYS A 63 95.943 10.906 14.498 1.00 0.00 C ATOM 1000 C LYS A 63 97.095 9.937 14.726 1.00 0.00 C ATOM 1001 O LYS A 63 97.011 9.051 15.580 1.00 0.00 O ATOM 1002 CB LYS A 63 96.015 12.029 15.529 1.00 0.00 C ATOM 1003 CG LYS A 63 94.957 13.086 15.202 1.00 0.00 C ATOM 1004 CD LYS A 63 95.032 14.230 16.218 1.00 0.00 C ATOM 1005 CE LYS A 63 94.418 13.779 17.547 1.00 0.00 C ATOM 1006 NZ LYS A 63 94.305 14.944 18.465 1.00 0.00 N ATOM 0 H LYS A 63 94.096 10.538 15.412 1.00 0.00 H new ATOM 0 HA LYS A 63 96.028 11.313 13.490 1.00 0.00 H new ATOM 0 HB2 LYS A 63 95.850 11.630 16.530 1.00 0.00 H new ATOM 0 HB3 LYS A 63 97.008 12.479 15.525 1.00 0.00 H new ATOM 0 HG2 LYS A 63 95.115 13.472 14.195 1.00 0.00 H new ATOM 0 HG3 LYS A 63 93.964 12.637 15.220 1.00 0.00 H new ATOM 0 HD2 LYS A 63 96.069 14.529 16.368 1.00 0.00 H new ATOM 0 HD3 LYS A 63 94.501 15.103 15.838 1.00 0.00 H new ATOM 0 HE2 LYS A 63 93.434 13.342 17.375 1.00 0.00 H new ATOM 0 HE3 LYS A 63 95.036 13.004 18.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 93.888 14.636 19.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 95.250 15.342 18.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 93.698 15.669 18.032 1.00 0.00 H new ATOM 1020 N GLU A 64 98.170 10.122 13.958 1.00 0.00 N ATOM 1021 CA GLU A 64 99.351 9.273 14.066 1.00 0.00 C ATOM 1022 C GLU A 64 98.974 7.801 13.885 1.00 0.00 C ATOM 1023 O GLU A 64 98.918 7.025 14.849 1.00 0.00 O ATOM 1024 CB GLU A 64 100.033 9.491 15.417 1.00 0.00 C ATOM 1025 CG GLU A 64 100.689 10.879 15.462 1.00 0.00 C ATOM 1026 CD GLU A 64 101.273 11.165 16.858 1.00 0.00 C ATOM 1027 OE1 GLU A 64 101.712 12.279 17.068 1.00 0.00 O ATOM 1028 OE2 GLU A 64 101.283 10.267 17.696 1.00 0.00 O ATOM 0 H GLU A 64 98.244 10.856 13.253 1.00 0.00 H new ATOM 0 HA GLU A 64 100.049 9.545 13.275 1.00 0.00 H new ATOM 0 HB2 GLU A 64 99.302 9.400 16.220 1.00 0.00 H new ATOM 0 HB3 GLU A 64 100.785 8.720 15.582 1.00 0.00 H new ATOM 0 HG2 GLU A 64 101.480 10.937 14.714 1.00 0.00 H new ATOM 0 HG3 GLU A 64 99.953 11.642 15.208 1.00 0.00 H new ATOM 1035 N SER A 65 98.727 7.426 12.632 1.00 0.00 N ATOM 1036 CA SER A 65 98.364 6.051 12.301 1.00 0.00 C ATOM 1037 C SER A 65 99.377 5.477 11.319 1.00 0.00 C ATOM 1038 O SER A 65 99.969 6.218 10.527 1.00 0.00 O ATOM 1039 CB SER A 65 96.967 6.015 11.678 1.00 0.00 C ATOM 1040 OG SER A 65 96.953 6.812 10.501 1.00 0.00 O ATOM 0 H SER A 65 98.772 8.055 11.830 1.00 0.00 H new ATOM 0 HA SER A 65 98.363 5.453 13.212 1.00 0.00 H new ATOM 0 HB2 SER A 65 96.690 4.988 11.438 1.00 0.00 H new ATOM 0 HB3 SER A 65 96.230 6.386 12.390 1.00 0.00 H new ATOM 0 HG SER A 65 96.424 6.363 9.808 1.00 0.00 H new ATOM 1046 N THR A 66 99.581 4.159 11.384 1.00 0.00 N ATOM 1047 CA THR A 66 100.539 3.498 10.501 1.00 0.00 C ATOM 1048 C THR A 66 99.823 2.787 9.359 1.00 0.00 C ATOM 1049 O THR A 66 99.107 1.808 9.576 1.00 0.00 O ATOM 1050 CB THR A 66 101.371 2.487 11.296 1.00 0.00 C ATOM 1051 OG1 THR A 66 101.859 3.106 12.478 1.00 0.00 O ATOM 1052 CG2 THR A 66 102.553 2.013 10.445 1.00 0.00 C ATOM 0 H THR A 66 99.100 3.536 12.033 1.00 0.00 H new ATOM 0 HA THR A 66 101.196 4.258 10.079 1.00 0.00 H new ATOM 0 HB THR A 66 100.749 1.632 11.560 1.00 0.00 H new ATOM 0 HG1 THR A 66 102.390 2.461 12.990 1.00 0.00 H new ATOM 0 HG21 THR A 66 103.144 1.294 11.012 1.00 0.00 H new ATOM 0 HG22 THR A 66 102.181 1.541 9.536 1.00 0.00 H new ATOM 0 HG23 THR A 66 103.177 2.867 10.181 1.00 0.00 H new ATOM 1060 N LEU A 67 100.028 3.299 8.147 1.00 0.00 N ATOM 1061 CA LEU A 67 99.411 2.728 6.953 1.00 0.00 C ATOM 1062 C LEU A 67 100.402 1.839 6.218 1.00 0.00 C ATOM 1063 O LEU A 67 101.600 2.126 6.192 1.00 0.00 O ATOM 1064 CB LEU A 67 98.947 3.847 6.017 1.00 0.00 C ATOM 1065 CG LEU A 67 97.697 4.531 6.589 1.00 0.00 C ATOM 1066 CD1 LEU A 67 97.473 5.868 5.877 1.00 0.00 C ATOM 1067 CD2 LEU A 67 96.471 3.639 6.367 1.00 0.00 C ATOM 0 H LEU A 67 100.619 4.111 7.966 1.00 0.00 H new ATOM 0 HA LEU A 67 98.553 2.130 7.261 1.00 0.00 H new ATOM 0 HB2 LEU A 67 99.745 4.579 5.889 1.00 0.00 H new ATOM 0 HB3 LEU A 67 98.728 3.439 5.030 1.00 0.00 H new ATOM 0 HG LEU A 67 97.841 4.699 7.656 1.00 0.00 H new ATOM 0 HD11 LEU A 67 96.585 6.353 6.284 1.00 0.00 H new ATOM 0 HD12 LEU A 67 98.340 6.511 6.030 1.00 0.00 H new ATOM 0 HD13 LEU A 67 97.334 5.693 4.810 1.00 0.00 H new ATOM 0 HD21 LEU A 67 95.586 4.128 6.775 1.00 0.00 H new ATOM 0 HD22 LEU A 67 96.333 3.470 5.299 1.00 0.00 H new ATOM 0 HD23 LEU A 67 96.621 2.683 6.869 1.00 0.00 H new ATOM 1079 N HIS A 68 99.892 0.762 5.624 1.00 0.00 N ATOM 1080 CA HIS A 68 100.734 -0.170 4.882 1.00 0.00 C ATOM 1081 C HIS A 68 100.684 0.150 3.396 1.00 0.00 C ATOM 1082 O HIS A 68 99.605 0.180 2.798 1.00 0.00 O ATOM 1083 CB HIS A 68 100.264 -1.608 5.112 1.00 0.00 C ATOM 1084 CG HIS A 68 100.500 -1.988 6.547 1.00 0.00 C ATOM 1085 ND1 HIS A 68 101.764 -2.280 7.031 1.00 0.00 N ATOM 1086 CD2 HIS A 68 99.647 -2.127 7.613 1.00 0.00 C ATOM 1087 CE1 HIS A 68 101.640 -2.577 8.337 1.00 0.00 C ATOM 1088 NE2 HIS A 68 100.370 -2.500 8.744 1.00 0.00 N ATOM 0 H HIS A 68 98.903 0.515 5.643 1.00 0.00 H new ATOM 0 HA HIS A 68 101.759 -0.069 5.238 1.00 0.00 H new ATOM 0 HB2 HIS A 68 99.205 -1.699 4.870 1.00 0.00 H new ATOM 0 HB3 HIS A 68 100.802 -2.288 4.451 1.00 0.00 H new ATOM 0 HD2 HIS A 68 98.579 -1.971 7.580 1.00 0.00 H new ATOM 0 HE1 HIS A 68 102.467 -2.845 8.978 1.00 0.00 H new ATOM 0 HE2 HIS A 68 100.008 -2.676 9.681 1.00 0.00 H new ATOM 1096 N LEU A 69 101.859 0.389 2.813 1.00 0.00 N ATOM 1097 CA LEU A 69 101.953 0.709 1.395 1.00 0.00 C ATOM 1098 C LEU A 69 102.451 -0.496 0.617 1.00 0.00 C ATOM 1099 O LEU A 69 103.422 -1.144 1.014 1.00 0.00 O ATOM 1100 CB LEU A 69 102.916 1.883 1.170 1.00 0.00 C ATOM 1101 CG LEU A 69 102.803 2.372 -0.284 1.00 0.00 C ATOM 1102 CD1 LEU A 69 101.520 3.192 -0.454 1.00 0.00 C ATOM 1103 CD2 LEU A 69 104.013 3.242 -0.637 1.00 0.00 C ATOM 0 H LEU A 69 102.754 0.366 3.302 1.00 0.00 H new ATOM 0 HA LEU A 69 100.959 0.986 1.044 1.00 0.00 H new ATOM 0 HB2 LEU A 69 102.681 2.696 1.857 1.00 0.00 H new ATOM 0 HB3 LEU A 69 103.939 1.573 1.381 1.00 0.00 H new ATOM 0 HG LEU A 69 102.774 1.508 -0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 69 101.443 3.537 -1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 69 100.657 2.571 -0.213 1.00 0.00 H new ATOM 0 HD13 LEU A 69 101.546 4.052 0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 69 103.926 3.585 -1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 69 104.049 4.103 0.030 1.00 0.00 H new ATOM 0 HD23 LEU A 69 104.926 2.658 -0.524 1.00 0.00 H new ATOM 1115 N VAL A 70 101.787 -0.778 -0.500 1.00 0.00 N ATOM 1116 CA VAL A 70 102.160 -1.894 -1.361 1.00 0.00 C ATOM 1117 C VAL A 70 102.388 -1.342 -2.764 1.00 0.00 C ATOM 1118 O VAL A 70 101.758 -0.350 -3.142 1.00 0.00 O ATOM 1119 CB VAL A 70 101.034 -2.950 -1.388 1.00 0.00 C ATOM 1120 CG1 VAL A 70 101.477 -4.167 -2.211 1.00 0.00 C ATOM 1121 CG2 VAL A 70 100.702 -3.406 0.043 1.00 0.00 C ATOM 0 H VAL A 70 100.983 -0.245 -0.831 1.00 0.00 H new ATOM 0 HA VAL A 70 103.064 -2.374 -0.986 1.00 0.00 H new ATOM 0 HB VAL A 70 100.150 -2.503 -1.842 1.00 0.00 H new ATOM 0 HG11 VAL A 70 100.677 -4.907 -2.225 1.00 0.00 H new ATOM 0 HG12 VAL A 70 101.700 -3.855 -3.231 1.00 0.00 H new ATOM 0 HG13 VAL A 70 102.369 -4.605 -1.762 1.00 0.00 H new ATOM 0 HG21 VAL A 70 99.907 -4.151 0.012 1.00 0.00 H new ATOM 0 HG22 VAL A 70 101.590 -3.842 0.501 1.00 0.00 H new ATOM 0 HG23 VAL A 70 100.374 -2.549 0.631 1.00 0.00 H new ATOM 1131 N LEU A 71 103.277 -1.976 -3.531 1.00 0.00 N ATOM 1132 CA LEU A 71 103.558 -1.517 -4.889 1.00 0.00 C ATOM 1133 C LEU A 71 103.117 -2.563 -5.900 1.00 0.00 C ATOM 1134 O LEU A 71 103.533 -3.722 -5.827 1.00 0.00 O ATOM 1135 CB LEU A 71 105.057 -1.241 -5.061 1.00 0.00 C ATOM 1136 CG LEU A 71 105.295 -0.470 -6.371 1.00 0.00 C ATOM 1137 CD1 LEU A 71 104.950 1.012 -6.171 1.00 0.00 C ATOM 1138 CD2 LEU A 71 106.766 -0.592 -6.784 1.00 0.00 C ATOM 0 H LEU A 71 103.807 -2.797 -3.239 1.00 0.00 H new ATOM 0 HA LEU A 71 103.003 -0.595 -5.060 1.00 0.00 H new ATOM 0 HB2 LEU A 71 105.430 -0.664 -4.215 1.00 0.00 H new ATOM 0 HB3 LEU A 71 105.610 -2.180 -5.075 1.00 0.00 H new ATOM 0 HG LEU A 71 104.660 -0.891 -7.150 1.00 0.00 H new ATOM 0 HD11 LEU A 71 105.120 1.554 -7.101 1.00 0.00 H new ATOM 0 HD12 LEU A 71 103.903 1.106 -5.882 1.00 0.00 H new ATOM 0 HD13 LEU A 71 105.581 1.430 -5.387 1.00 0.00 H new ATOM 0 HD21 LEU A 71 106.930 -0.045 -7.712 1.00 0.00 H new ATOM 0 HD22 LEU A 71 107.400 -0.176 -6.001 1.00 0.00 H new ATOM 0 HD23 LEU A 71 107.016 -1.642 -6.933 1.00 0.00 H new ATOM 1150 N ARG A 72 102.273 -2.144 -6.850 1.00 0.00 N ATOM 1151 CA ARG A 72 101.781 -3.043 -7.883 1.00 0.00 C ATOM 1152 C ARG A 72 102.589 -2.862 -9.164 1.00 0.00 C ATOM 1153 O ARG A 72 102.271 -2.017 -10.003 1.00 0.00 O ATOM 1154 CB ARG A 72 100.302 -2.761 -8.153 1.00 0.00 C ATOM 1155 CG ARG A 72 99.715 -3.897 -8.991 1.00 0.00 C ATOM 1156 CD ARG A 72 98.246 -3.612 -9.260 1.00 0.00 C ATOM 1157 NE ARG A 72 98.106 -2.456 -10.152 1.00 0.00 N ATOM 1158 CZ ARG A 72 96.954 -1.770 -10.282 1.00 0.00 C ATOM 1159 NH1 ARG A 72 95.876 -2.099 -9.610 1.00 0.00 N ATOM 1160 NH2 ARG A 72 96.909 -0.754 -11.099 1.00 0.00 N ATOM 0 H ARG A 72 101.921 -1.189 -6.919 1.00 0.00 H new ATOM 0 HA ARG A 72 101.892 -4.072 -7.541 1.00 0.00 H new ATOM 0 HB2 ARG A 72 99.760 -2.670 -7.212 1.00 0.00 H new ATOM 0 HB3 ARG A 72 100.191 -1.812 -8.678 1.00 0.00 H new ATOM 0 HG2 ARG A 72 100.258 -3.989 -9.932 1.00 0.00 H new ATOM 0 HG3 ARG A 72 99.823 -4.846 -8.466 1.00 0.00 H new ATOM 0 HD2 ARG A 72 97.776 -4.486 -9.710 1.00 0.00 H new ATOM 0 HD3 ARG A 72 97.728 -3.420 -8.320 1.00 0.00 H new ATOM 0 HE ARG A 72 98.915 -2.159 -10.697 1.00 0.00 H new ATOM 0 HH11 ARG A 72 95.897 -2.892 -8.969 1.00 0.00 H new ATOM 0 HH12 ARG A 72 95.017 -1.561 -9.728 1.00 0.00 H new ATOM 0 HH21 ARG A 72 97.739 -0.489 -11.629 1.00 0.00 H new ATOM 0 HH22 ARG A 72 96.044 -0.225 -11.208 1.00 0.00 H new ATOM 1174 N LEU A 73 103.639 -3.667 -9.300 1.00 0.00 N ATOM 1175 CA LEU A 73 104.507 -3.603 -10.474 1.00 0.00 C ATOM 1176 C LEU A 73 103.793 -4.171 -11.690 1.00 0.00 C ATOM 1177 O LEU A 73 102.944 -5.058 -11.562 1.00 0.00 O ATOM 1178 CB LEU A 73 105.797 -4.391 -10.217 1.00 0.00 C ATOM 1179 CG LEU A 73 106.653 -3.659 -9.173 1.00 0.00 C ATOM 1180 CD1 LEU A 73 107.737 -4.604 -8.650 1.00 0.00 C ATOM 1181 CD2 LEU A 73 107.324 -2.437 -9.814 1.00 0.00 C ATOM 0 H LEU A 73 103.910 -4.371 -8.613 1.00 0.00 H new ATOM 0 HA LEU A 73 104.756 -2.559 -10.666 1.00 0.00 H new ATOM 0 HB2 LEU A 73 105.557 -5.395 -9.866 1.00 0.00 H new ATOM 0 HB3 LEU A 73 106.357 -4.504 -11.146 1.00 0.00 H new ATOM 0 HG LEU A 73 106.014 -3.335 -8.352 1.00 0.00 H new ATOM 0 HD11 LEU A 73 108.345 -4.085 -7.909 1.00 0.00 H new ATOM 0 HD12 LEU A 73 107.270 -5.475 -8.191 1.00 0.00 H new ATOM 0 HD13 LEU A 73 108.369 -4.926 -9.477 1.00 0.00 H new ATOM 0 HD21 LEU A 73 107.930 -1.922 -9.069 1.00 0.00 H new ATOM 0 HD22 LEU A 73 107.960 -2.761 -10.637 1.00 0.00 H new ATOM 0 HD23 LEU A 73 106.559 -1.758 -10.192 1.00 0.00 H new ATOM 1193 N ARG A 74 104.150 -3.660 -12.865 1.00 0.00 N ATOM 1194 CA ARG A 74 103.547 -4.122 -14.110 1.00 0.00 C ATOM 1195 C ARG A 74 104.113 -5.476 -14.505 1.00 0.00 C ATOM 1196 O ARG A 74 105.315 -5.716 -14.370 1.00 0.00 O ATOM 1197 CB ARG A 74 103.812 -3.102 -15.227 1.00 0.00 C ATOM 1198 CG ARG A 74 103.121 -1.772 -14.892 1.00 0.00 C ATOM 1199 CD ARG A 74 101.617 -1.890 -15.148 1.00 0.00 C ATOM 1200 NE ARG A 74 100.935 -0.678 -14.691 1.00 0.00 N ATOM 1201 CZ ARG A 74 99.674 -0.681 -14.222 1.00 0.00 C ATOM 1202 NH1 ARG A 74 98.964 -1.786 -14.149 1.00 0.00 N ATOM 1203 NH2 ARG A 74 99.143 0.441 -13.826 1.00 0.00 N ATOM 0 H ARG A 74 104.851 -2.928 -12.980 1.00 0.00 H new ATOM 0 HA ARG A 74 102.472 -4.223 -13.960 1.00 0.00 H new ATOM 0 HB2 ARG A 74 104.885 -2.946 -15.343 1.00 0.00 H new ATOM 0 HB3 ARG A 74 103.441 -3.486 -16.178 1.00 0.00 H new ATOM 0 HG2 ARG A 74 103.302 -1.510 -13.850 1.00 0.00 H new ATOM 0 HG3 ARG A 74 103.541 -0.970 -15.500 1.00 0.00 H new ATOM 0 HD2 ARG A 74 101.432 -2.043 -16.211 1.00 0.00 H new ATOM 0 HD3 ARG A 74 101.218 -2.760 -14.627 1.00 0.00 H new ATOM 0 HE ARG A 74 101.438 0.208 -14.730 1.00 0.00 H new ATOM 0 HH11 ARG A 74 99.367 -2.672 -14.453 1.00 0.00 H new ATOM 0 HH12 ARG A 74 98.010 -1.756 -13.789 1.00 0.00 H new ATOM 0 HH21 ARG A 74 99.682 1.305 -13.874 1.00 0.00 H new ATOM 0 HH22 ARG A 74 98.188 0.455 -13.468 1.00 0.00 H new ATOM 1217 N GLY A 75 103.234 -6.358 -14.981 1.00 0.00 N ATOM 1218 CA GLY A 75 103.642 -7.701 -15.391 1.00 0.00 C ATOM 1219 C GLY A 75 103.626 -8.666 -14.210 1.00 0.00 C ATOM 1220 O GLY A 75 104.591 -9.403 -13.988 1.00 0.00 O ATOM 0 H GLY A 75 102.238 -6.167 -15.092 1.00 0.00 H new ATOM 0 HA2 GLY A 75 102.973 -8.065 -16.171 1.00 0.00 H new ATOM 0 HA3 GLY A 75 104.643 -7.665 -15.821 1.00 0.00 H new ATOM 1224 N GLY A 76 102.525 -8.651 -13.457 1.00 0.00 N ATOM 1225 CA GLY A 76 102.379 -9.524 -12.294 1.00 0.00 C ATOM 1226 C GLY A 76 100.944 -9.512 -11.780 1.00 0.00 C ATOM 1227 O GLY A 76 100.048 -9.735 -12.578 1.00 0.00 O ATOM 1228 OXT GLY A 76 100.763 -9.277 -10.597 1.00 0.00 O ATOM 0 H GLY A 76 101.724 -8.045 -13.632 1.00 0.00 H new ATOM 0 HA2 GLY A 76 102.665 -10.541 -12.560 1.00 0.00 H new ATOM 0 HA3 GLY A 76 103.055 -9.199 -11.503 1.00 0.00 H new TER 1232 GLY A 76 ATOM 1233 N GLN B 198 117.510 -13.551 -6.971 1.00 0.00 N ATOM 1234 CA GLN B 198 116.911 -13.257 -5.638 1.00 0.00 C ATOM 1235 C GLN B 198 115.482 -12.761 -5.834 1.00 0.00 C ATOM 1236 O GLN B 198 115.254 -11.744 -6.497 1.00 0.00 O ATOM 1237 CB GLN B 198 117.758 -12.192 -4.924 1.00 0.00 C ATOM 1238 CG GLN B 198 117.235 -11.978 -3.496 1.00 0.00 C ATOM 1239 CD GLN B 198 118.048 -10.902 -2.785 1.00 0.00 C ATOM 1240 OE1 GLN B 198 118.333 -9.849 -3.361 1.00 0.00 O ATOM 1241 NE2 GLN B 198 118.442 -11.104 -1.556 1.00 0.00 N ATOM 0 HA GLN B 198 116.893 -14.158 -5.025 1.00 0.00 H new ATOM 0 HB2 GLN B 198 118.802 -12.505 -4.895 1.00 0.00 H new ATOM 0 HB3 GLN B 198 117.721 -11.254 -5.478 1.00 0.00 H new ATOM 0 HG2 GLN B 198 116.185 -11.688 -3.527 1.00 0.00 H new ATOM 0 HG3 GLN B 198 117.291 -12.913 -2.938 1.00 0.00 H new ATOM 0 HE21 GLN B 198 118.205 -11.975 -1.081 1.00 0.00 H new ATOM 0 HE22 GLN B 198 118.986 -10.390 -1.071 1.00 0.00 H new ATOM 1250 N VAL B 199 114.527 -13.491 -5.253 1.00 0.00 N ATOM 1251 CA VAL B 199 113.113 -13.130 -5.361 1.00 0.00 C ATOM 1252 C VAL B 199 112.682 -12.389 -4.095 1.00 0.00 C ATOM 1253 O VAL B 199 112.860 -12.889 -2.982 1.00 0.00 O ATOM 1254 CB VAL B 199 112.248 -14.394 -5.558 1.00 0.00 C ATOM 1255 CG1 VAL B 199 110.772 -14.006 -5.728 1.00 0.00 C ATOM 1256 CG2 VAL B 199 112.707 -15.153 -6.810 1.00 0.00 C ATOM 0 H VAL B 199 114.707 -14.332 -4.705 1.00 0.00 H new ATOM 0 HA VAL B 199 112.974 -12.481 -6.226 1.00 0.00 H new ATOM 0 HB VAL B 199 112.360 -15.028 -4.679 1.00 0.00 H new ATOM 0 HG11 VAL B 199 110.173 -14.906 -5.866 1.00 0.00 H new ATOM 0 HG12 VAL B 199 110.431 -13.476 -4.839 1.00 0.00 H new ATOM 0 HG13 VAL B 199 110.664 -13.361 -6.600 1.00 0.00 H new ATOM 0 HG21 VAL B 199 112.092 -16.043 -6.942 1.00 0.00 H new ATOM 0 HG22 VAL B 199 112.605 -14.509 -7.684 1.00 0.00 H new ATOM 0 HG23 VAL B 199 113.750 -15.447 -6.695 1.00 0.00 H new ATOM 1266 N THR B 200 112.112 -11.201 -4.289 1.00 0.00 N ATOM 1267 CA THR B 200 111.645 -10.381 -3.176 1.00 0.00 C ATOM 1268 C THR B 200 110.374 -10.969 -2.579 1.00 0.00 C ATOM 1269 O THR B 200 109.529 -11.499 -3.299 1.00 0.00 O ATOM 1270 CB THR B 200 111.379 -8.952 -3.655 1.00 0.00 C ATOM 1271 OG1 THR B 200 112.465 -8.518 -4.462 1.00 0.00 O ATOM 1272 CG2 THR B 200 111.236 -8.016 -2.450 1.00 0.00 C ATOM 0 H THR B 200 111.963 -10.786 -5.209 1.00 0.00 H new ATOM 0 HA THR B 200 112.419 -10.365 -2.408 1.00 0.00 H new ATOM 0 HB THR B 200 110.456 -8.933 -4.235 1.00 0.00 H new ATOM 0 HG1 THR B 200 112.297 -7.604 -4.772 1.00 0.00 H new ATOM 0 HG21 THR B 200 111.047 -7.001 -2.798 1.00 0.00 H new ATOM 0 HG22 THR B 200 110.404 -8.347 -1.829 1.00 0.00 H new ATOM 0 HG23 THR B 200 112.155 -8.033 -1.865 1.00 0.00 H new ATOM 1280 N LYS B 201 110.252 -10.863 -1.257 1.00 0.00 N ATOM 1281 CA LYS B 201 109.080 -11.374 -0.551 1.00 0.00 C ATOM 1282 C LYS B 201 108.536 -10.323 0.409 1.00 0.00 C ATOM 1283 O LYS B 201 109.294 -9.531 0.975 1.00 0.00 O ATOM 1284 CB LYS B 201 109.438 -12.649 0.211 1.00 0.00 C ATOM 1285 CG LYS B 201 109.686 -13.781 -0.788 1.00 0.00 C ATOM 1286 CD LYS B 201 110.090 -15.049 -0.037 1.00 0.00 C ATOM 1287 CE LYS B 201 110.320 -16.183 -1.037 1.00 0.00 C ATOM 1288 NZ LYS B 201 110.688 -17.424 -0.300 1.00 0.00 N ATOM 0 H LYS B 201 110.950 -10.428 -0.654 1.00 0.00 H new ATOM 0 HA LYS B 201 108.308 -11.607 -1.284 1.00 0.00 H new ATOM 0 HB2 LYS B 201 110.327 -12.485 0.821 1.00 0.00 H new ATOM 0 HB3 LYS B 201 108.630 -12.919 0.891 1.00 0.00 H new ATOM 0 HG2 LYS B 201 108.786 -13.965 -1.375 1.00 0.00 H new ATOM 0 HG3 LYS B 201 110.471 -13.496 -1.489 1.00 0.00 H new ATOM 0 HD2 LYS B 201 110.997 -14.869 0.540 1.00 0.00 H new ATOM 0 HD3 LYS B 201 109.311 -15.328 0.672 1.00 0.00 H new ATOM 0 HE2 LYS B 201 109.419 -16.351 -1.627 1.00 0.00 H new ATOM 0 HE3 LYS B 201 111.112 -15.912 -1.735 1.00 0.00 H new ATOM 0 HZ1 LYS B 201 110.845 -18.197 -0.978 1.00 0.00 H new ATOM 0 HZ2 LYS B 201 111.559 -17.259 0.245 1.00 0.00 H new ATOM 0 HZ3 LYS B 201 109.918 -17.684 0.349 1.00 0.00 H new ATOM 1302 N VAL B 202 107.215 -10.327 0.575 1.00 0.00 N ATOM 1303 CA VAL B 202 106.543 -9.379 1.464 1.00 0.00 C ATOM 1304 C VAL B 202 105.393 -10.066 2.189 1.00 0.00 C ATOM 1305 O VAL B 202 104.649 -10.845 1.588 1.00 0.00 O ATOM 1306 CB VAL B 202 106.028 -8.164 0.674 1.00 0.00 C ATOM 1307 CG1 VAL B 202 107.215 -7.405 0.069 1.00 0.00 C ATOM 1308 CG2 VAL B 202 105.084 -8.616 -0.451 1.00 0.00 C ATOM 0 H VAL B 202 106.586 -10.978 0.104 1.00 0.00 H new ATOM 0 HA VAL B 202 107.264 -9.026 2.202 1.00 0.00 H new ATOM 0 HB VAL B 202 105.480 -7.511 1.353 1.00 0.00 H new ATOM 0 HG11 VAL B 202 106.849 -6.544 -0.491 1.00 0.00 H new ATOM 0 HG12 VAL B 202 107.875 -7.065 0.867 1.00 0.00 H new ATOM 0 HG13 VAL B 202 107.766 -8.065 -0.600 1.00 0.00 H new ATOM 0 HG21 VAL B 202 104.729 -7.744 -1.000 1.00 0.00 H new ATOM 0 HG22 VAL B 202 105.619 -9.279 -1.130 1.00 0.00 H new ATOM 0 HG23 VAL B 202 104.234 -9.146 -0.022 1.00 0.00 H new ATOM 1318 N ASP B 203 105.264 -9.772 3.479 1.00 0.00 N ATOM 1319 CA ASP B 203 104.213 -10.364 4.302 1.00 0.00 C ATOM 1320 C ASP B 203 102.852 -9.763 3.959 1.00 0.00 C ATOM 1321 O ASP B 203 102.774 -8.616 3.510 1.00 0.00 O ATOM 1322 CB ASP B 203 104.520 -10.122 5.778 1.00 0.00 C ATOM 1323 CG ASP B 203 105.823 -10.815 6.163 1.00 0.00 C ATOM 1324 OD1 ASP B 203 106.657 -10.167 6.775 1.00 0.00 O ATOM 1325 OD2 ASP B 203 105.965 -11.985 5.847 1.00 0.00 O ATOM 0 H ASP B 203 105.875 -9.126 3.979 1.00 0.00 H new ATOM 0 HA ASP B 203 104.180 -11.435 4.102 1.00 0.00 H new ATOM 0 HB2 ASP B 203 104.598 -9.052 5.971 1.00 0.00 H new ATOM 0 HB3 ASP B 203 103.703 -10.498 6.394 1.00 0.00 H new ATOM 1330 N CYS B 204 101.780 -10.536 4.188 1.00 0.00 N ATOM 1331 CA CYS B 204 100.430 -10.046 3.907 1.00 0.00 C ATOM 1332 C CYS B 204 99.872 -9.282 5.128 1.00 0.00 C ATOM 1333 O CYS B 204 99.770 -9.850 6.205 1.00 0.00 O ATOM 1334 CB CYS B 204 99.480 -11.192 3.557 1.00 0.00 C ATOM 1335 SG CYS B 204 97.848 -10.534 3.110 1.00 0.00 S ATOM 0 H CYS B 204 101.823 -11.485 4.560 1.00 0.00 H new ATOM 0 HA CYS B 204 100.498 -9.376 3.050 1.00 0.00 H new ATOM 0 HB2 CYS B 204 99.887 -11.772 2.728 1.00 0.00 H new ATOM 0 HB3 CYS B 204 99.388 -11.870 4.405 1.00 0.00 H new ATOM 1340 N PRO B 205 99.506 -8.022 5.007 1.00 0.00 N ATOM 1341 CA PRO B 205 98.940 -7.228 6.159 1.00 0.00 C ATOM 1342 C PRO B 205 97.549 -7.722 6.599 1.00 0.00 C ATOM 1343 O PRO B 205 97.057 -7.367 7.674 1.00 0.00 O ATOM 1344 CB PRO B 205 98.855 -5.782 5.625 1.00 0.00 C ATOM 1345 CG PRO B 205 99.597 -5.769 4.332 1.00 0.00 C ATOM 1346 CD PRO B 205 99.559 -7.185 3.790 1.00 0.00 C ATOM 0 HA PRO B 205 99.567 -7.325 7.045 1.00 0.00 H new ATOM 0 HB2 PRO B 205 97.817 -5.481 5.481 1.00 0.00 H new ATOM 0 HB3 PRO B 205 99.295 -5.080 6.333 1.00 0.00 H new ATOM 0 HG2 PRO B 205 99.137 -5.074 3.630 1.00 0.00 H new ATOM 0 HG3 PRO B 205 100.625 -5.439 4.480 1.00 0.00 H new ATOM 0 HD2 PRO B 205 98.689 -7.347 3.154 1.00 0.00 H new ATOM 0 HD3 PRO B 205 100.440 -7.408 3.188 1.00 0.00 H new ATOM 1354 N VAL B 206 96.920 -8.512 5.731 1.00 0.00 N ATOM 1355 CA VAL B 206 95.574 -9.047 5.960 1.00 0.00 C ATOM 1356 C VAL B 206 95.597 -10.336 6.756 1.00 0.00 C ATOM 1357 O VAL B 206 94.848 -10.506 7.723 1.00 0.00 O ATOM 1358 CB VAL B 206 94.927 -9.398 4.604 1.00 0.00 C ATOM 1359 CG1 VAL B 206 93.454 -9.807 4.787 1.00 0.00 C ATOM 1360 CG2 VAL B 206 95.026 -8.234 3.615 1.00 0.00 C ATOM 0 H VAL B 206 97.330 -8.802 4.843 1.00 0.00 H new ATOM 0 HA VAL B 206 95.023 -8.282 6.507 1.00 0.00 H new ATOM 0 HB VAL B 206 95.480 -10.243 4.193 1.00 0.00 H new ATOM 0 HG11 VAL B 206 93.020 -10.050 3.817 1.00 0.00 H new ATOM 0 HG12 VAL B 206 93.397 -10.679 5.438 1.00 0.00 H new ATOM 0 HG13 VAL B 206 92.900 -8.982 5.236 1.00 0.00 H new ATOM 0 HG21 VAL B 206 94.560 -8.518 2.671 1.00 0.00 H new ATOM 0 HG22 VAL B 206 94.514 -7.363 4.025 1.00 0.00 H new ATOM 0 HG23 VAL B 206 96.075 -7.991 3.443 1.00 0.00 H new ATOM 1370 N CYS B 207 96.403 -11.269 6.269 1.00 0.00 N ATOM 1371 CA CYS B 207 96.472 -12.594 6.845 1.00 0.00 C ATOM 1372 C CYS B 207 97.878 -12.957 7.321 1.00 0.00 C ATOM 1373 O CYS B 207 98.056 -13.953 8.028 1.00 0.00 O ATOM 1374 CB CYS B 207 95.965 -13.568 5.772 1.00 0.00 C ATOM 1375 SG CYS B 207 97.241 -13.915 4.525 1.00 0.00 S ATOM 0 H CYS B 207 97.021 -11.126 5.470 1.00 0.00 H new ATOM 0 HA CYS B 207 95.854 -12.644 7.741 1.00 0.00 H new ATOM 0 HB2 CYS B 207 95.654 -14.500 6.244 1.00 0.00 H new ATOM 0 HB3 CYS B 207 95.085 -13.148 5.285 1.00 0.00 H new ATOM 1380 N GLY B 208 98.867 -12.159 6.926 1.00 0.00 N ATOM 1381 CA GLY B 208 100.245 -12.412 7.319 1.00 0.00 C ATOM 1382 C GLY B 208 100.726 -13.750 6.784 1.00 0.00 C ATOM 1383 O GLY B 208 100.784 -14.735 7.521 1.00 0.00 O ATOM 0 H GLY B 208 98.738 -11.336 6.337 1.00 0.00 H new ATOM 0 HA2 GLY B 208 100.886 -11.614 6.944 1.00 0.00 H new ATOM 0 HA3 GLY B 208 100.325 -12.401 8.406 1.00 0.00 H new ATOM 1387 N VAL B 209 101.068 -13.765 5.497 1.00 0.00 N ATOM 1388 CA VAL B 209 101.560 -14.971 4.842 1.00 0.00 C ATOM 1389 C VAL B 209 102.757 -14.611 3.965 1.00 0.00 C ATOM 1390 O VAL B 209 102.749 -13.581 3.285 1.00 0.00 O ATOM 1391 CB VAL B 209 100.435 -15.628 4.015 1.00 0.00 C ATOM 1392 CG1 VAL B 209 100.986 -16.767 3.143 1.00 0.00 C ATOM 1393 CG2 VAL B 209 99.387 -16.201 4.970 1.00 0.00 C ATOM 0 H VAL B 209 101.012 -12.950 4.886 1.00 0.00 H new ATOM 0 HA VAL B 209 101.881 -15.694 5.592 1.00 0.00 H new ATOM 0 HB VAL B 209 99.994 -14.872 3.365 1.00 0.00 H new ATOM 0 HG11 VAL B 209 100.173 -17.213 2.570 1.00 0.00 H new ATOM 0 HG12 VAL B 209 101.737 -16.371 2.459 1.00 0.00 H new ATOM 0 HG13 VAL B 209 101.440 -17.526 3.780 1.00 0.00 H new ATOM 0 HG21 VAL B 209 98.587 -16.668 4.395 1.00 0.00 H new ATOM 0 HG22 VAL B 209 99.852 -16.946 5.616 1.00 0.00 H new ATOM 0 HG23 VAL B 209 98.974 -15.398 5.581 1.00 0.00 H new ATOM 1403 N ASN B 210 103.767 -15.478 3.983 1.00 0.00 N ATOM 1404 CA ASN B 210 104.961 -15.262 3.180 1.00 0.00 C ATOM 1405 C ASN B 210 104.599 -15.418 1.718 1.00 0.00 C ATOM 1406 O ASN B 210 104.098 -16.468 1.304 1.00 0.00 O ATOM 1407 CB ASN B 210 106.039 -16.272 3.559 1.00 0.00 C ATOM 1408 CG ASN B 210 107.402 -15.758 3.123 1.00 0.00 C ATOM 1409 OD1 ASN B 210 108.058 -16.372 2.282 1.00 0.00 O ATOM 1410 ND2 ASN B 210 107.869 -14.663 3.647 1.00 0.00 N ATOM 0 H ASN B 210 103.780 -16.331 4.542 1.00 0.00 H new ATOM 0 HA ASN B 210 105.348 -14.259 3.361 1.00 0.00 H new ATOM 0 HB2 ASN B 210 106.031 -16.440 4.636 1.00 0.00 H new ATOM 0 HB3 ASN B 210 105.834 -17.232 3.085 1.00 0.00 H new ATOM 0 HD21 ASN B 210 108.782 -14.310 3.361 1.00 0.00 H new ATOM 0 HD22 ASN B 210 107.322 -14.157 4.344 1.00 0.00 H new ATOM 1417 N ILE B 211 104.833 -14.361 0.939 1.00 0.00 N ATOM 1418 CA ILE B 211 104.507 -14.390 -0.487 1.00 0.00 C ATOM 1419 C ILE B 211 105.452 -13.466 -1.281 1.00 0.00 C ATOM 1420 O ILE B 211 105.735 -12.353 -0.822 1.00 0.00 O ATOM 1421 CB ILE B 211 103.037 -13.958 -0.731 1.00 0.00 C ATOM 1422 CG1 ILE B 211 102.078 -14.844 0.096 1.00 0.00 C ATOM 1423 CG2 ILE B 211 102.695 -14.106 -2.228 1.00 0.00 C ATOM 1424 CD1 ILE B 211 100.649 -14.314 0.008 1.00 0.00 C ATOM 0 H ILE B 211 105.241 -13.485 1.266 1.00 0.00 H new ATOM 0 HA ILE B 211 104.635 -15.416 -0.833 1.00 0.00 H new ATOM 0 HB ILE B 211 102.921 -12.918 -0.426 1.00 0.00 H new ATOM 0 HG12 ILE B 211 102.115 -15.870 -0.270 1.00 0.00 H new ATOM 0 HG13 ILE B 211 102.400 -14.866 1.137 1.00 0.00 H new ATOM 0 HG21 ILE B 211 101.662 -13.802 -2.397 1.00 0.00 H new ATOM 0 HG22 ILE B 211 103.360 -13.475 -2.817 1.00 0.00 H new ATOM 0 HG23 ILE B 211 102.821 -15.146 -2.529 1.00 0.00 H new ATOM 0 HD11 ILE B 211 99.988 -14.950 0.596 1.00 0.00 H new ATOM 0 HD12 ILE B 211 100.614 -13.296 0.397 1.00 0.00 H new ATOM 0 HD13 ILE B 211 100.324 -14.316 -1.032 1.00 0.00 H new ATOM 1436 N PRO B 212 105.915 -13.874 -2.471 1.00 0.00 N ATOM 1437 CA PRO B 212 106.798 -13.012 -3.311 1.00 0.00 C ATOM 1438 C PRO B 212 106.158 -11.649 -3.560 1.00 0.00 C ATOM 1439 O PRO B 212 104.942 -11.494 -3.411 1.00 0.00 O ATOM 1440 CB PRO B 212 106.954 -13.792 -4.619 1.00 0.00 C ATOM 1441 CG PRO B 212 106.655 -15.211 -4.280 1.00 0.00 C ATOM 1442 CD PRO B 212 105.663 -15.180 -3.132 1.00 0.00 C ATOM 0 HA PRO B 212 107.755 -12.808 -2.832 1.00 0.00 H new ATOM 0 HB2 PRO B 212 106.270 -13.419 -5.381 1.00 0.00 H new ATOM 0 HB3 PRO B 212 107.963 -13.689 -5.018 1.00 0.00 H new ATOM 0 HG2 PRO B 212 106.237 -15.735 -5.139 1.00 0.00 H new ATOM 0 HG3 PRO B 212 107.563 -15.741 -3.994 1.00 0.00 H new ATOM 0 HD2 PRO B 212 104.636 -15.254 -3.490 1.00 0.00 H new ATOM 0 HD3 PRO B 212 105.822 -16.012 -2.445 1.00 0.00 H new ATOM 1450 N GLU B 213 106.984 -10.667 -3.911 1.00 0.00 N ATOM 1451 CA GLU B 213 106.495 -9.315 -4.162 1.00 0.00 C ATOM 1452 C GLU B 213 105.556 -9.291 -5.370 1.00 0.00 C ATOM 1453 O GLU B 213 104.608 -8.513 -5.403 1.00 0.00 O ATOM 1454 CB GLU B 213 107.670 -8.360 -4.403 1.00 0.00 C ATOM 1455 CG GLU B 213 107.180 -6.898 -4.363 1.00 0.00 C ATOM 1456 CD GLU B 213 107.371 -6.302 -2.966 1.00 0.00 C ATOM 1457 OE1 GLU B 213 106.507 -5.548 -2.546 1.00 0.00 O ATOM 1458 OE2 GLU B 213 108.392 -6.577 -2.353 1.00 0.00 O ATOM 0 H GLU B 213 107.991 -10.781 -4.028 1.00 0.00 H new ATOM 0 HA GLU B 213 105.941 -8.988 -3.282 1.00 0.00 H new ATOM 0 HB2 GLU B 213 108.437 -8.516 -3.644 1.00 0.00 H new ATOM 0 HB3 GLU B 213 108.129 -8.572 -5.369 1.00 0.00 H new ATOM 0 HG2 GLU B 213 107.729 -6.305 -5.095 1.00 0.00 H new ATOM 0 HG3 GLU B 213 106.127 -6.854 -4.642 1.00 0.00 H new ATOM 1465 N SER B 214 105.843 -10.132 -6.363 1.00 0.00 N ATOM 1466 CA SER B 214 105.022 -10.203 -7.571 1.00 0.00 C ATOM 1467 C SER B 214 103.710 -10.942 -7.302 1.00 0.00 C ATOM 1468 O SER B 214 102.649 -10.536 -7.784 1.00 0.00 O ATOM 1469 CB SER B 214 105.798 -10.928 -8.673 1.00 0.00 C ATOM 1470 OG SER B 214 106.188 -12.211 -8.207 1.00 0.00 O ATOM 0 H SER B 214 106.637 -10.773 -6.355 1.00 0.00 H new ATOM 0 HA SER B 214 104.786 -9.187 -7.886 1.00 0.00 H new ATOM 0 HB2 SER B 214 105.180 -11.025 -9.565 1.00 0.00 H new ATOM 0 HB3 SER B 214 106.677 -10.349 -8.956 1.00 0.00 H new ATOM 0 HG SER B 214 106.684 -12.678 -8.912 1.00 0.00 H new ATOM 1476 N HIS B 215 103.797 -12.034 -6.544 1.00 0.00 N ATOM 1477 CA HIS B 215 102.620 -12.852 -6.224 1.00 0.00 C ATOM 1478 C HIS B 215 101.691 -12.155 -5.227 1.00 0.00 C ATOM 1479 O HIS B 215 100.516 -12.517 -5.125 1.00 0.00 O ATOM 1480 CB HIS B 215 103.077 -14.188 -5.615 1.00 0.00 C ATOM 1481 CG HIS B 215 103.334 -15.193 -6.706 1.00 0.00 C ATOM 1482 ND1 HIS B 215 104.504 -15.198 -7.447 1.00 0.00 N ATOM 1483 CD2 HIS B 215 102.570 -16.218 -7.200 1.00 0.00 C ATOM 1484 CE1 HIS B 215 104.411 -16.195 -8.342 1.00 0.00 C ATOM 1485 NE2 HIS B 215 103.250 -16.850 -8.234 1.00 0.00 N ATOM 0 H HIS B 215 104.668 -12.376 -6.138 1.00 0.00 H new ATOM 0 HA HIS B 215 102.070 -13.012 -7.151 1.00 0.00 H new ATOM 0 HB2 HIS B 215 103.983 -14.038 -5.028 1.00 0.00 H new ATOM 0 HB3 HIS B 215 102.314 -14.566 -4.934 1.00 0.00 H new ATOM 0 HD2 HIS B 215 101.589 -16.493 -6.841 1.00 0.00 H new ATOM 0 HE1 HIS B 215 105.180 -16.438 -9.061 1.00 0.00 H new ATOM 0 HE2 HIS B 215 102.932 -17.643 -8.791 1.00 0.00 H new ATOM 1493 N ILE B 216 102.218 -11.173 -4.499 1.00 0.00 N ATOM 1494 CA ILE B 216 101.423 -10.449 -3.513 1.00 0.00 C ATOM 1495 C ILE B 216 100.243 -9.720 -4.172 1.00 0.00 C ATOM 1496 O ILE B 216 99.203 -9.531 -3.545 1.00 0.00 O ATOM 1497 CB ILE B 216 102.328 -9.449 -2.743 1.00 0.00 C ATOM 1498 CG1 ILE B 216 101.697 -9.131 -1.375 1.00 0.00 C ATOM 1499 CG2 ILE B 216 102.522 -8.139 -3.543 1.00 0.00 C ATOM 1500 CD1 ILE B 216 101.892 -10.313 -0.416 1.00 0.00 C ATOM 0 H ILE B 216 103.187 -10.862 -4.573 1.00 0.00 H new ATOM 0 HA ILE B 216 101.007 -11.169 -2.808 1.00 0.00 H new ATOM 0 HB ILE B 216 103.306 -9.910 -2.603 1.00 0.00 H new ATOM 0 HG12 ILE B 216 102.152 -8.234 -0.956 1.00 0.00 H new ATOM 0 HG13 ILE B 216 100.634 -8.922 -1.496 1.00 0.00 H new ATOM 0 HG21 ILE B 216 103.160 -7.459 -2.978 1.00 0.00 H new ATOM 0 HG22 ILE B 216 102.990 -8.364 -4.501 1.00 0.00 H new ATOM 0 HG23 ILE B 216 101.553 -7.670 -3.714 1.00 0.00 H new ATOM 0 HD11 ILE B 216 101.442 -10.077 0.548 1.00 0.00 H new ATOM 0 HD12 ILE B 216 101.416 -11.201 -0.831 1.00 0.00 H new ATOM 0 HD13 ILE B 216 102.957 -10.502 -0.283 1.00 0.00 H new ATOM 1512 N ASN B 217 100.444 -9.279 -5.419 1.00 0.00 N ATOM 1513 CA ASN B 217 99.412 -8.541 -6.135 1.00 0.00 C ATOM 1514 C ASN B 217 98.177 -9.413 -6.319 1.00 0.00 C ATOM 1515 O ASN B 217 97.060 -8.994 -6.002 1.00 0.00 O ATOM 1516 CB ASN B 217 99.944 -8.102 -7.504 1.00 0.00 C ATOM 1517 CG ASN B 217 101.041 -7.053 -7.335 1.00 0.00 C ATOM 1518 OD1 ASN B 217 100.836 -6.040 -6.666 1.00 0.00 O ATOM 1519 ND2 ASN B 217 102.201 -7.237 -7.906 1.00 0.00 N ATOM 0 H ASN B 217 101.306 -9.422 -5.945 1.00 0.00 H new ATOM 0 HA ASN B 217 99.140 -7.660 -5.554 1.00 0.00 H new ATOM 0 HB2 ASN B 217 100.336 -8.964 -8.043 1.00 0.00 H new ATOM 0 HB3 ASN B 217 99.131 -7.694 -8.104 1.00 0.00 H new ATOM 0 HD21 ASN B 217 102.939 -6.541 -7.798 1.00 0.00 H new ATOM 0 HD22 ASN B 217 102.369 -8.077 -8.460 1.00 0.00 H new ATOM 1526 N LYS B 218 98.392 -10.642 -6.804 1.00 0.00 N ATOM 1527 CA LYS B 218 97.293 -11.582 -6.999 1.00 0.00 C ATOM 1528 C LYS B 218 96.716 -12.001 -5.653 1.00 0.00 C ATOM 1529 O LYS B 218 95.494 -12.065 -5.484 1.00 0.00 O ATOM 1530 CB LYS B 218 97.769 -12.818 -7.762 1.00 0.00 C ATOM 1531 CG LYS B 218 98.128 -12.424 -9.195 1.00 0.00 C ATOM 1532 CD LYS B 218 98.567 -13.668 -9.971 1.00 0.00 C ATOM 1533 CE LYS B 218 98.911 -13.275 -11.408 1.00 0.00 C ATOM 1534 NZ LYS B 218 99.357 -14.483 -12.156 1.00 0.00 N ATOM 0 H LYS B 218 99.310 -11.002 -7.065 1.00 0.00 H new ATOM 0 HA LYS B 218 96.519 -11.086 -7.584 1.00 0.00 H new ATOM 0 HB2 LYS B 218 98.636 -13.254 -7.265 1.00 0.00 H new ATOM 0 HB3 LYS B 218 96.988 -13.579 -7.767 1.00 0.00 H new ATOM 0 HG2 LYS B 218 97.269 -11.962 -9.683 1.00 0.00 H new ATOM 0 HG3 LYS B 218 98.928 -11.684 -9.190 1.00 0.00 H new ATOM 0 HD2 LYS B 218 99.432 -14.124 -9.490 1.00 0.00 H new ATOM 0 HD3 LYS B 218 97.771 -14.413 -9.967 1.00 0.00 H new ATOM 0 HE2 LYS B 218 98.041 -12.833 -11.894 1.00 0.00 H new ATOM 0 HE3 LYS B 218 99.697 -12.520 -11.412 1.00 0.00 H new ATOM 0 HZ1 LYS B 218 99.592 -14.219 -13.134 1.00 0.00 H new ATOM 0 HZ2 LYS B 218 100.198 -14.886 -11.695 1.00 0.00 H new ATOM 0 HZ3 LYS B 218 98.593 -15.189 -12.162 1.00 0.00 H new ATOM 1548 N HIS B 219 97.606 -12.299 -4.705 1.00 0.00 N ATOM 1549 CA HIS B 219 97.182 -12.722 -3.376 1.00 0.00 C ATOM 1550 C HIS B 219 96.311 -11.649 -2.720 1.00 0.00 C ATOM 1551 O HIS B 219 95.350 -11.985 -2.032 1.00 0.00 O ATOM 1552 CB HIS B 219 98.394 -13.049 -2.480 1.00 0.00 C ATOM 1553 CG HIS B 219 97.907 -13.357 -1.083 1.00 0.00 C ATOM 1554 ND1 HIS B 219 97.238 -14.527 -0.760 1.00 0.00 N ATOM 1555 CD2 HIS B 219 97.911 -12.601 0.056 1.00 0.00 C ATOM 1556 CE1 HIS B 219 96.862 -14.431 0.531 1.00 0.00 C ATOM 1557 NE2 HIS B 219 97.252 -13.273 1.074 1.00 0.00 N ATOM 0 H HIS B 219 98.617 -12.255 -4.834 1.00 0.00 H new ATOM 0 HA HIS B 219 96.591 -13.631 -3.490 1.00 0.00 H new ATOM 0 HB2 HIS B 219 98.941 -13.901 -2.884 1.00 0.00 H new ATOM 0 HB3 HIS B 219 99.085 -12.206 -2.460 1.00 0.00 H new ATOM 0 HD1 HIS B 219 97.063 -15.315 -1.384 1.00 0.00 H new ATOM 0 HD2 HIS B 219 98.361 -11.624 0.149 1.00 0.00 H new ATOM 0 HE1 HIS B 219 96.313 -15.195 1.061 1.00 0.00 H new ATOM 1564 N LEU B 220 96.665 -10.379 -2.907 1.00 0.00 N ATOM 1565 CA LEU B 220 95.906 -9.294 -2.291 1.00 0.00 C ATOM 1566 C LEU B 220 94.463 -9.323 -2.773 1.00 0.00 C ATOM 1567 O LEU B 220 93.541 -9.117 -1.985 1.00 0.00 O ATOM 1568 CB LEU B 220 96.542 -7.940 -2.621 1.00 0.00 C ATOM 1569 CG LEU B 220 97.748 -7.688 -1.702 1.00 0.00 C ATOM 1570 CD1 LEU B 220 98.591 -6.552 -2.273 1.00 0.00 C ATOM 1571 CD2 LEU B 220 97.256 -7.297 -0.301 1.00 0.00 C ATOM 0 H LEU B 220 97.460 -10.079 -3.471 1.00 0.00 H new ATOM 0 HA LEU B 220 95.921 -9.432 -1.210 1.00 0.00 H new ATOM 0 HB2 LEU B 220 96.859 -7.922 -3.664 1.00 0.00 H new ATOM 0 HB3 LEU B 220 95.808 -7.144 -2.497 1.00 0.00 H new ATOM 0 HG LEU B 220 98.348 -8.596 -1.637 1.00 0.00 H new ATOM 0 HD11 LEU B 220 99.447 -6.372 -1.623 1.00 0.00 H new ATOM 0 HD12 LEU B 220 98.942 -6.824 -3.268 1.00 0.00 H new ATOM 0 HD13 LEU B 220 97.987 -5.647 -2.337 1.00 0.00 H new ATOM 0 HD21 LEU B 220 98.113 -7.119 0.349 1.00 0.00 H new ATOM 0 HD22 LEU B 220 96.655 -6.390 -0.366 1.00 0.00 H new ATOM 0 HD23 LEU B 220 96.650 -8.104 0.110 1.00 0.00 H new ATOM 1583 N ASP B 221 94.281 -9.594 -4.062 1.00 0.00 N ATOM 1584 CA ASP B 221 92.946 -9.670 -4.648 1.00 0.00 C ATOM 1585 C ASP B 221 92.137 -10.801 -4.003 1.00 0.00 C ATOM 1586 O ASP B 221 90.921 -10.682 -3.830 1.00 0.00 O ATOM 1587 CB ASP B 221 93.061 -9.913 -6.153 1.00 0.00 C ATOM 1588 CG ASP B 221 91.706 -9.712 -6.821 1.00 0.00 C ATOM 1589 OD1 ASP B 221 91.139 -10.695 -7.269 1.00 0.00 O ATOM 1590 OD2 ASP B 221 91.257 -8.581 -6.873 1.00 0.00 O ATOM 0 H ASP B 221 95.041 -9.765 -4.721 1.00 0.00 H new ATOM 0 HA ASP B 221 92.430 -8.727 -4.467 1.00 0.00 H new ATOM 0 HB2 ASP B 221 93.793 -9.230 -6.585 1.00 0.00 H new ATOM 0 HB3 ASP B 221 93.421 -10.925 -6.339 1.00 0.00 H new ATOM 1595 N SER B 222 92.823 -11.894 -3.651 1.00 0.00 N ATOM 1596 CA SER B 222 92.174 -13.047 -3.017 1.00 0.00 C ATOM 1597 C SER B 222 91.869 -12.773 -1.540 1.00 0.00 C ATOM 1598 O SER B 222 90.769 -13.051 -1.059 1.00 0.00 O ATOM 1599 CB SER B 222 93.078 -14.276 -3.128 1.00 0.00 C ATOM 1600 OG SER B 222 92.292 -15.453 -2.998 1.00 0.00 O ATOM 0 H SER B 222 93.827 -12.004 -3.794 1.00 0.00 H new ATOM 0 HA SER B 222 91.232 -13.229 -3.535 1.00 0.00 H new ATOM 0 HB2 SER B 222 93.596 -14.275 -4.087 1.00 0.00 H new ATOM 0 HB3 SER B 222 93.844 -14.249 -2.353 1.00 0.00 H new ATOM 0 HG SER B 222 92.869 -16.242 -3.071 1.00 0.00 H new ATOM 1606 N CYS B 223 92.867 -12.241 -0.833 1.00 0.00 N ATOM 1607 CA CYS B 223 92.742 -11.933 0.594 1.00 0.00 C ATOM 1608 C CYS B 223 91.705 -10.842 0.826 1.00 0.00 C ATOM 1609 O CYS B 223 90.889 -10.939 1.739 1.00 0.00 O ATOM 1610 CB CYS B 223 94.110 -11.474 1.128 1.00 0.00 C ATOM 1611 SG CYS B 223 94.391 -12.145 2.788 1.00 0.00 S ATOM 0 H CYS B 223 93.779 -12.012 -1.229 1.00 0.00 H new ATOM 0 HA CYS B 223 92.415 -12.829 1.122 1.00 0.00 H new ATOM 0 HB2 CYS B 223 94.901 -11.805 0.455 1.00 0.00 H new ATOM 0 HB3 CYS B 223 94.151 -10.385 1.156 1.00 0.00 H new ATOM 1616 N LEU B 224 91.754 -9.815 -0.013 1.00 0.00 N ATOM 1617 CA LEU B 224 90.824 -8.692 0.083 1.00 0.00 C ATOM 1618 C LEU B 224 89.391 -9.155 -0.160 1.00 0.00 C ATOM 1619 O LEU B 224 88.464 -8.686 0.506 1.00 0.00 O ATOM 1620 CB LEU B 224 91.214 -7.607 -0.927 1.00 0.00 C ATOM 1621 CG LEU B 224 92.511 -6.921 -0.469 1.00 0.00 C ATOM 1622 CD1 LEU B 224 93.110 -6.129 -1.633 1.00 0.00 C ATOM 1623 CD2 LEU B 224 92.212 -5.957 0.689 1.00 0.00 C ATOM 0 H LEU B 224 92.431 -9.735 -0.772 1.00 0.00 H new ATOM 0 HA LEU B 224 90.879 -8.277 1.090 1.00 0.00 H new ATOM 0 HB2 LEU B 224 91.352 -8.047 -1.914 1.00 0.00 H new ATOM 0 HB3 LEU B 224 90.413 -6.873 -1.015 1.00 0.00 H new ATOM 0 HG LEU B 224 93.216 -7.683 -0.137 1.00 0.00 H new ATOM 0 HD11 LEU B 224 94.030 -5.643 -1.307 1.00 0.00 H new ATOM 0 HD12 LEU B 224 93.330 -6.806 -2.459 1.00 0.00 H new ATOM 0 HD13 LEU B 224 92.398 -5.373 -1.964 1.00 0.00 H new ATOM 0 HD21 LEU B 224 93.136 -5.474 1.008 1.00 0.00 H new ATOM 0 HD22 LEU B 224 91.502 -5.199 0.357 1.00 0.00 H new ATOM 0 HD23 LEU B 224 91.785 -6.513 1.524 1.00 0.00 H new ATOM 1635 N SER B 225 89.223 -10.082 -1.108 1.00 0.00 N ATOM 1636 CA SER B 225 87.900 -10.614 -1.430 1.00 0.00 C ATOM 1637 C SER B 225 87.248 -11.227 -0.190 1.00 0.00 C ATOM 1638 O SER B 225 86.024 -11.172 -0.038 1.00 0.00 O ATOM 1639 CB SER B 225 88.012 -11.679 -2.524 1.00 0.00 C ATOM 1640 OG SER B 225 88.305 -11.051 -3.765 1.00 0.00 O ATOM 0 H SER B 225 89.983 -10.476 -1.662 1.00 0.00 H new ATOM 0 HA SER B 225 87.280 -9.791 -1.786 1.00 0.00 H new ATOM 0 HB2 SER B 225 88.795 -12.394 -2.272 1.00 0.00 H new ATOM 0 HB3 SER B 225 87.080 -12.239 -2.598 1.00 0.00 H new ATOM 0 HG SER B 225 89.256 -11.163 -3.972 1.00 0.00 H new ATOM 1646 N ARG B 226 88.071 -11.812 0.690 1.00 0.00 N ATOM 1647 CA ARG B 226 87.563 -12.438 1.912 1.00 0.00 C ATOM 1648 C ARG B 226 86.756 -11.420 2.714 1.00 0.00 C ATOM 1649 O ARG B 226 85.651 -11.715 3.172 1.00 0.00 O ATOM 1650 CB ARG B 226 88.739 -12.948 2.756 1.00 0.00 C ATOM 1651 CG ARG B 226 88.210 -13.711 3.976 1.00 0.00 C ATOM 1652 CD ARG B 226 89.379 -14.287 4.774 1.00 0.00 C ATOM 1653 NE ARG B 226 90.193 -13.201 5.327 1.00 0.00 N ATOM 1654 CZ ARG B 226 91.336 -13.419 6.003 1.00 0.00 C ATOM 1655 NH1 ARG B 226 91.789 -14.632 6.216 1.00 0.00 N ATOM 1656 NH2 ARG B 226 92.008 -12.400 6.459 1.00 0.00 N ATOM 0 H ARG B 226 89.084 -11.864 0.578 1.00 0.00 H new ATOM 0 HA ARG B 226 86.919 -13.277 1.647 1.00 0.00 H new ATOM 0 HB2 ARG B 226 89.374 -13.599 2.156 1.00 0.00 H new ATOM 0 HB3 ARG B 226 89.357 -12.110 3.079 1.00 0.00 H new ATOM 0 HG2 ARG B 226 87.621 -13.044 4.606 1.00 0.00 H new ATOM 0 HG3 ARG B 226 87.547 -14.514 3.655 1.00 0.00 H new ATOM 0 HD2 ARG B 226 89.004 -14.918 5.580 1.00 0.00 H new ATOM 0 HD3 ARG B 226 89.991 -14.920 4.132 1.00 0.00 H new ATOM 0 HE ARG B 226 89.880 -12.239 5.194 1.00 0.00 H new ATOM 0 HH11 ARG B 226 91.272 -15.438 5.866 1.00 0.00 H new ATOM 0 HH12 ARG B 226 92.658 -14.768 6.732 1.00 0.00 H new ATOM 0 HH21 ARG B 226 91.666 -11.452 6.302 1.00 0.00 H new ATOM 0 HH22 ARG B 226 92.876 -12.550 6.973 1.00 0.00 H new ATOM 1670 N GLU B 227 87.323 -10.230 2.857 1.00 0.00 N ATOM 1671 CA GLU B 227 86.662 -9.151 3.589 1.00 0.00 C ATOM 1672 C GLU B 227 85.412 -8.683 2.855 1.00 0.00 C ATOM 1673 O GLU B 227 84.408 -8.349 3.487 1.00 0.00 O ATOM 1674 CB GLU B 227 87.627 -7.978 3.777 1.00 0.00 C ATOM 1675 CG GLU B 227 88.526 -8.235 4.998 1.00 0.00 C ATOM 1676 CD GLU B 227 89.721 -9.130 4.637 1.00 0.00 C ATOM 1677 OE1 GLU B 227 89.792 -9.602 3.517 1.00 0.00 O ATOM 1678 OE2 GLU B 227 90.551 -9.336 5.504 1.00 0.00 O ATOM 0 H GLU B 227 88.237 -9.985 2.478 1.00 0.00 H new ATOM 0 HA GLU B 227 86.364 -9.532 4.566 1.00 0.00 H new ATOM 0 HB2 GLU B 227 88.239 -7.851 2.884 1.00 0.00 H new ATOM 0 HB3 GLU B 227 87.067 -7.053 3.914 1.00 0.00 H new ATOM 0 HG2 GLU B 227 88.887 -7.285 5.392 1.00 0.00 H new ATOM 0 HG3 GLU B 227 87.942 -8.707 5.788 1.00 0.00 H new ATOM 1685 N GLU B 228 85.485 -8.665 1.526 1.00 0.00 N ATOM 1686 CA GLU B 228 84.353 -8.243 0.704 1.00 0.00 C ATOM 1687 C GLU B 228 83.197 -9.248 0.802 1.00 0.00 C ATOM 1688 O GLU B 228 82.032 -8.865 0.662 1.00 0.00 O ATOM 1689 CB GLU B 228 84.783 -8.105 -0.753 1.00 0.00 C ATOM 1690 CG GLU B 228 85.765 -6.933 -0.912 1.00 0.00 C ATOM 1691 CD GLU B 228 86.246 -6.816 -2.368 1.00 0.00 C ATOM 1692 OE1 GLU B 228 85.735 -7.534 -3.222 1.00 0.00 O ATOM 1693 OE2 GLU B 228 87.125 -6.008 -2.609 1.00 0.00 O ATOM 0 H GLU B 228 86.313 -8.937 0.996 1.00 0.00 H new ATOM 0 HA GLU B 228 84.010 -7.278 1.076 1.00 0.00 H new ATOM 0 HB2 GLU B 228 85.252 -9.029 -1.090 1.00 0.00 H new ATOM 0 HB3 GLU B 228 83.909 -7.943 -1.383 1.00 0.00 H new ATOM 0 HG2 GLU B 228 85.282 -6.004 -0.608 1.00 0.00 H new ATOM 0 HG3 GLU B 228 86.621 -7.078 -0.252 1.00 0.00 H new ATOM 1700 N LYS B 229 83.528 -10.522 1.052 1.00 0.00 N ATOM 1701 CA LYS B 229 82.510 -11.564 1.188 1.00 0.00 C ATOM 1702 C LYS B 229 81.735 -11.405 2.492 1.00 0.00 C ATOM 1703 O LYS B 229 80.507 -11.483 2.500 1.00 0.00 O ATOM 1704 CB LYS B 229 83.172 -12.944 1.131 1.00 0.00 C ATOM 1705 CG LYS B 229 83.659 -13.233 -0.294 1.00 0.00 C ATOM 1706 CD LYS B 229 82.463 -13.566 -1.192 1.00 0.00 C ATOM 1707 CE LYS B 229 82.960 -13.899 -2.594 1.00 0.00 C ATOM 1708 NZ LYS B 229 81.798 -14.209 -3.468 1.00 0.00 N ATOM 0 H LYS B 229 84.487 -10.851 1.163 1.00 0.00 H new ATOM 0 HA LYS B 229 81.804 -11.468 0.363 1.00 0.00 H new ATOM 0 HB2 LYS B 229 84.011 -12.983 1.826 1.00 0.00 H new ATOM 0 HB3 LYS B 229 82.463 -13.710 1.444 1.00 0.00 H new ATOM 0 HG2 LYS B 229 84.192 -12.368 -0.689 1.00 0.00 H new ATOM 0 HG3 LYS B 229 84.363 -14.065 -0.286 1.00 0.00 H new ATOM 0 HD2 LYS B 229 81.909 -14.410 -0.781 1.00 0.00 H new ATOM 0 HD3 LYS B 229 81.776 -12.721 -1.229 1.00 0.00 H new ATOM 0 HE2 LYS B 229 83.522 -13.059 -3.002 1.00 0.00 H new ATOM 0 HE3 LYS B 229 83.640 -14.750 -2.558 1.00 0.00 H new ATOM 0 HZ1 LYS B 229 82.135 -14.437 -4.425 1.00 0.00 H new ATOM 0 HZ2 LYS B 229 81.280 -15.023 -3.081 1.00 0.00 H new ATOM 0 HZ3 LYS B 229 81.166 -13.384 -3.510 1.00 0.00 H new ATOM 1722 N LYS B 230 82.468 -11.209 3.584 1.00 0.00 N ATOM 1723 CA LYS B 230 81.851 -11.060 4.906 1.00 0.00 C ATOM 1724 C LYS B 230 80.899 -9.872 4.929 1.00 0.00 C ATOM 1725 O LYS B 230 79.686 -10.056 5.031 1.00 0.00 O ATOM 1726 CB LYS B 230 82.934 -10.885 5.978 1.00 0.00 C ATOM 1727 CG LYS B 230 83.840 -12.123 6.012 1.00 0.00 C ATOM 1728 CD LYS B 230 83.101 -13.283 6.685 1.00 0.00 C ATOM 1729 CE LYS B 230 84.006 -14.510 6.720 1.00 0.00 C ATOM 1730 NZ LYS B 230 83.300 -15.624 7.409 1.00 0.00 N ATOM 0 H LYS B 230 83.486 -11.149 3.584 1.00 0.00 H new ATOM 0 HA LYS B 230 81.280 -11.963 5.120 1.00 0.00 H new ATOM 0 HB2 LYS B 230 83.527 -9.995 5.766 1.00 0.00 H new ATOM 0 HB3 LYS B 230 82.471 -10.735 6.954 1.00 0.00 H new ATOM 0 HG2 LYS B 230 84.129 -12.402 4.999 1.00 0.00 H new ATOM 0 HG3 LYS B 230 84.758 -11.899 6.556 1.00 0.00 H new ATOM 0 HD2 LYS B 230 82.809 -13.004 7.698 1.00 0.00 H new ATOM 0 HD3 LYS B 230 82.184 -13.509 6.140 1.00 0.00 H new ATOM 0 HE2 LYS B 230 84.275 -14.807 5.706 1.00 0.00 H new ATOM 0 HE3 LYS B 230 84.935 -14.276 7.240 1.00 0.00 H new ATOM 0 HZ1 LYS B 230 83.915 -16.462 7.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 230 83.065 -15.338 8.381 1.00 0.00 H new ATOM 0 HZ3 LYS B 230 82.426 -15.852 6.894 1.00 0.00 H new ATOM 1744 N GLU B 231 81.462 -8.655 4.831 1.00 0.00 N ATOM 1745 CA GLU B 231 80.667 -7.422 4.840 1.00 0.00 C ATOM 1746 C GLU B 231 79.543 -7.506 5.890 1.00 0.00 C ATOM 1747 O GLU B 231 78.388 -7.162 5.636 1.00 0.00 O ATOM 1748 CB GLU B 231 80.073 -7.193 3.454 1.00 0.00 C ATOM 1749 CG GLU B 231 79.541 -5.760 3.350 1.00 0.00 C ATOM 1750 CD GLU B 231 79.040 -5.471 1.932 1.00 0.00 C ATOM 1751 OE1 GLU B 231 78.809 -6.412 1.179 1.00 0.00 O ATOM 1752 OE2 GLU B 231 78.909 -4.305 1.606 1.00 0.00 O ATOM 0 H GLU B 231 82.467 -8.503 4.745 1.00 0.00 H new ATOM 0 HA GLU B 231 81.315 -6.586 5.102 1.00 0.00 H new ATOM 0 HB2 GLU B 231 80.831 -7.366 2.690 1.00 0.00 H new ATOM 0 HB3 GLU B 231 79.268 -7.904 3.271 1.00 0.00 H new ATOM 0 HG2 GLU B 231 78.730 -5.615 4.064 1.00 0.00 H new ATOM 0 HG3 GLU B 231 80.329 -5.054 3.614 1.00 0.00 H new ATOM 1759 N SER B 232 79.901 -8.013 7.070 1.00 0.00 N ATOM 1760 CA SER B 232 78.935 -8.179 8.154 1.00 0.00 C ATOM 1761 C SER B 232 79.639 -8.507 9.471 1.00 0.00 C ATOM 1762 O SER B 232 79.192 -8.080 10.541 1.00 0.00 O ATOM 1763 CB SER B 232 77.953 -9.300 7.803 1.00 0.00 C ATOM 1764 OG SER B 232 78.555 -10.561 8.071 1.00 0.00 O ATOM 0 H SER B 232 80.848 -8.314 7.298 1.00 0.00 H new ATOM 0 HA SER B 232 78.394 -7.241 8.277 1.00 0.00 H new ATOM 0 HB2 SER B 232 77.038 -9.191 8.385 1.00 0.00 H new ATOM 0 HB3 SER B 232 77.672 -9.236 6.752 1.00 0.00 H new ATOM 0 HG SER B 232 77.925 -11.278 7.848 1.00 0.00 H new ATOM 1770 N LEU B 233 80.731 -9.260 9.377 1.00 0.00 N ATOM 1771 CA LEU B 233 81.499 -9.643 10.555 1.00 0.00 C ATOM 1772 C LEU B 233 82.732 -8.761 10.678 1.00 0.00 C ATOM 1773 O LEU B 233 83.570 -8.728 9.774 1.00 0.00 O ATOM 1774 CB LEU B 233 81.924 -11.110 10.441 1.00 0.00 C ATOM 1775 CG LEU B 233 80.708 -12.028 10.641 1.00 0.00 C ATOM 1776 CD1 LEU B 233 81.058 -13.448 10.182 1.00 0.00 C ATOM 1777 CD2 LEU B 233 80.315 -12.064 12.126 1.00 0.00 C ATOM 0 H LEU B 233 81.103 -9.617 8.497 1.00 0.00 H new ATOM 0 HA LEU B 233 80.878 -9.516 11.442 1.00 0.00 H new ATOM 0 HB2 LEU B 233 82.371 -11.293 9.464 1.00 0.00 H new ATOM 0 HB3 LEU B 233 82.686 -11.335 11.187 1.00 0.00 H new ATOM 0 HG LEU B 233 79.874 -11.643 10.055 1.00 0.00 H new ATOM 0 HD11 LEU B 233 80.195 -14.099 10.324 1.00 0.00 H new ATOM 0 HD12 LEU B 233 81.331 -13.432 9.127 1.00 0.00 H new ATOM 0 HD13 LEU B 233 81.897 -13.824 10.768 1.00 0.00 H new ATOM 0 HD21 LEU B 233 79.452 -12.717 12.258 1.00 0.00 H new ATOM 0 HD22 LEU B 233 81.151 -12.443 12.714 1.00 0.00 H new ATOM 0 HD23 LEU B 233 80.063 -11.058 12.460 1.00 0.00 H new ATOM 1789 N ARG B 234 82.825 -8.039 11.794 1.00 0.00 N ATOM 1790 CA ARG B 234 83.954 -7.144 12.028 1.00 0.00 C ATOM 1791 C ARG B 234 84.354 -7.165 13.498 1.00 0.00 C ATOM 1792 O ARG B 234 85.459 -7.597 13.843 1.00 0.00 O ATOM 1793 CB ARG B 234 83.586 -5.716 11.614 1.00 0.00 C ATOM 1794 CG ARG B 234 83.458 -5.635 10.093 1.00 0.00 C ATOM 1795 CD ARG B 234 83.065 -4.213 9.686 1.00 0.00 C ATOM 1796 NE ARG B 234 82.956 -4.114 8.226 1.00 0.00 N ATOM 1797 CZ ARG B 234 82.895 -2.935 7.577 1.00 0.00 C ATOM 1798 NH1 ARG B 234 82.926 -1.790 8.221 1.00 0.00 N ATOM 1799 NH2 ARG B 234 82.804 -2.929 6.275 1.00 0.00 N ATOM 0 H ARG B 234 82.136 -8.057 12.546 1.00 0.00 H new ATOM 0 HA ARG B 234 84.797 -7.487 11.428 1.00 0.00 H new ATOM 0 HB2 ARG B 234 82.647 -5.422 12.083 1.00 0.00 H new ATOM 0 HB3 ARG B 234 84.348 -5.019 11.962 1.00 0.00 H new ATOM 0 HG2 ARG B 234 84.402 -5.911 9.623 1.00 0.00 H new ATOM 0 HG3 ARG B 234 82.708 -6.345 9.743 1.00 0.00 H new ATOM 0 HD2 ARG B 234 82.115 -3.945 10.148 1.00 0.00 H new ATOM 0 HD3 ARG B 234 83.808 -3.504 10.051 1.00 0.00 H new ATOM 0 HE ARG B 234 82.925 -4.975 7.679 1.00 0.00 H new ATOM 0 HH11 ARG B 234 82.998 -1.779 9.238 1.00 0.00 H new ATOM 0 HH12 ARG B 234 82.878 -0.912 7.703 1.00 0.00 H new ATOM 0 HH21 ARG B 234 82.780 -3.810 5.761 1.00 0.00 H new ATOM 0 HH22 ARG B 234 82.757 -2.043 5.771 1.00 0.00 H new ATOM 1813 N SER B 235 83.445 -6.695 14.353 1.00 0.00 N ATOM 1814 CA SER B 235 83.693 -6.662 15.788 1.00 0.00 C ATOM 1815 C SER B 235 83.616 -8.068 16.372 1.00 0.00 C ATOM 1816 O SER B 235 84.373 -8.415 17.278 1.00 0.00 O ATOM 1817 CB SER B 235 82.666 -5.763 16.475 1.00 0.00 C ATOM 1818 OG SER B 235 81.359 -6.261 16.221 1.00 0.00 O ATOM 0 H SER B 235 82.533 -6.333 14.074 1.00 0.00 H new ATOM 0 HA SER B 235 84.693 -6.263 15.959 1.00 0.00 H new ATOM 0 HB2 SER B 235 82.853 -5.732 17.548 1.00 0.00 H new ATOM 0 HB3 SER B 235 82.756 -4.741 16.106 1.00 0.00 H new ATOM 0 HG SER B 235 80.699 -5.687 16.662 1.00 0.00 H new ATOM 1824 N SER B 236 82.689 -8.872 15.838 1.00 0.00 N ATOM 1825 CA SER B 236 82.504 -10.240 16.299 1.00 0.00 C ATOM 1826 C SER B 236 83.081 -11.222 15.275 1.00 0.00 C ATOM 1827 O SER B 236 82.421 -12.190 14.866 1.00 0.00 O ATOM 1828 CB SER B 236 81.017 -10.523 16.518 1.00 0.00 C ATOM 1829 OG SER B 236 80.296 -10.140 15.355 1.00 0.00 O ATOM 0 H SER B 236 82.059 -8.593 15.086 1.00 0.00 H new ATOM 0 HA SER B 236 83.030 -10.368 17.245 1.00 0.00 H new ATOM 0 HB2 SER B 236 80.862 -11.582 16.725 1.00 0.00 H new ATOM 0 HB3 SER B 236 80.653 -9.972 17.385 1.00 0.00 H new ATOM 0 HG SER B 236 79.342 -10.320 15.487 1.00 0.00 H new ATOM 1835 N VAL B 237 84.328 -10.970 14.873 1.00 0.00 N ATOM 1836 CA VAL B 237 85.002 -11.838 13.905 1.00 0.00 C ATOM 1837 C VAL B 237 85.136 -13.255 14.477 1.00 0.00 C ATOM 1838 O VAL B 237 85.073 -14.238 13.738 1.00 0.00 O ATOM 1839 CB VAL B 237 86.388 -11.256 13.550 1.00 0.00 C ATOM 1840 CG1 VAL B 237 87.287 -11.227 14.791 1.00 0.00 C ATOM 1841 CG2 VAL B 237 87.053 -12.116 12.466 1.00 0.00 C ATOM 0 H VAL B 237 84.887 -10.181 15.198 1.00 0.00 H new ATOM 0 HA VAL B 237 84.407 -11.890 12.993 1.00 0.00 H new ATOM 0 HB VAL B 237 86.252 -10.239 13.181 1.00 0.00 H new ATOM 0 HG11 VAL B 237 88.260 -10.814 14.526 1.00 0.00 H new ATOM 0 HG12 VAL B 237 86.827 -10.606 15.559 1.00 0.00 H new ATOM 0 HG13 VAL B 237 87.414 -12.240 15.172 1.00 0.00 H new ATOM 0 HG21 VAL B 237 88.030 -11.700 12.220 1.00 0.00 H new ATOM 0 HG22 VAL B 237 87.174 -13.135 12.834 1.00 0.00 H new ATOM 0 HG23 VAL B 237 86.427 -12.124 11.574 1.00 0.00 H new ATOM 1851 N HIS B 238 85.338 -13.329 15.792 1.00 0.00 N ATOM 1852 CA HIS B 238 85.495 -14.606 16.475 1.00 0.00 C ATOM 1853 C HIS B 238 84.680 -14.618 17.770 1.00 0.00 C ATOM 1854 O HIS B 238 84.597 -13.596 18.460 1.00 0.00 O ATOM 1855 CB HIS B 238 86.984 -14.857 16.786 1.00 0.00 C ATOM 1856 CG HIS B 238 87.505 -13.809 17.742 1.00 0.00 C ATOM 1857 ND1 HIS B 238 88.215 -12.706 17.316 1.00 0.00 N ATOM 1858 CD2 HIS B 238 87.390 -13.681 19.103 1.00 0.00 C ATOM 1859 CE1 HIS B 238 88.496 -11.964 18.396 1.00 0.00 C ATOM 1860 NE2 HIS B 238 88.016 -12.513 19.514 1.00 0.00 N ATOM 0 H HIS B 238 85.396 -12.515 16.404 1.00 0.00 H new ATOM 0 HA HIS B 238 85.129 -15.400 15.824 1.00 0.00 H new ATOM 0 HB2 HIS B 238 87.110 -15.849 17.220 1.00 0.00 H new ATOM 0 HB3 HIS B 238 87.564 -14.837 15.863 1.00 0.00 H new ATOM 0 HD2 HIS B 238 86.889 -14.382 19.754 1.00 0.00 H new ATOM 0 HE1 HIS B 238 89.045 -11.034 18.365 1.00 0.00 H new ATOM 0 HE2 HIS B 238 88.093 -12.152 20.465 1.00 0.00 H new ATOM 1868 N LYS B 239 84.102 -15.773 18.089 1.00 0.00 N ATOM 1869 CA LYS B 239 83.304 -15.915 19.303 1.00 0.00 C ATOM 1870 C LYS B 239 84.207 -16.137 20.517 1.00 0.00 C ATOM 1871 O LYS B 239 85.112 -16.973 20.482 1.00 0.00 O ATOM 1872 CB LYS B 239 82.338 -17.095 19.151 1.00 0.00 C ATOM 1873 CG LYS B 239 81.357 -17.110 20.327 1.00 0.00 C ATOM 1874 CD LYS B 239 80.315 -18.208 20.112 1.00 0.00 C ATOM 1875 CE LYS B 239 79.318 -18.199 21.271 1.00 0.00 C ATOM 1876 NZ LYS B 239 79.988 -18.692 22.508 1.00 0.00 N ATOM 0 H LYS B 239 84.171 -16.621 17.526 1.00 0.00 H new ATOM 0 HA LYS B 239 82.736 -14.998 19.457 1.00 0.00 H new ATOM 0 HB2 LYS B 239 81.793 -17.013 18.211 1.00 0.00 H new ATOM 0 HB3 LYS B 239 82.894 -18.032 19.116 1.00 0.00 H new ATOM 0 HG2 LYS B 239 81.894 -17.282 21.260 1.00 0.00 H new ATOM 0 HG3 LYS B 239 80.866 -16.141 20.416 1.00 0.00 H new ATOM 0 HD2 LYS B 239 79.793 -18.049 19.168 1.00 0.00 H new ATOM 0 HD3 LYS B 239 80.804 -19.180 20.046 1.00 0.00 H new ATOM 0 HE2 LYS B 239 78.937 -17.190 21.429 1.00 0.00 H new ATOM 0 HE3 LYS B 239 78.462 -18.830 21.033 1.00 0.00 H new ATOM 0 HZ1 LYS B 239 79.269 -18.927 23.222 1.00 0.00 H new ATOM 0 HZ2 LYS B 239 80.546 -19.541 22.286 1.00 0.00 H new ATOM 0 HZ3 LYS B 239 80.617 -17.952 22.881 1.00 0.00 H new ATOM 1890 N ARG B 240 83.941 -15.385 21.587 1.00 0.00 N ATOM 1891 CA ARG B 240 84.720 -15.499 22.818 1.00 0.00 C ATOM 1892 C ARG B 240 83.939 -16.294 23.868 1.00 0.00 C ATOM 1893 O ARG B 240 84.550 -17.119 24.530 1.00 0.00 O ATOM 1894 CB ARG B 240 85.050 -14.095 23.349 1.00 0.00 C ATOM 1895 CG ARG B 240 85.963 -14.190 24.576 1.00 0.00 C ATOM 1896 CD ARG B 240 86.252 -12.785 25.100 1.00 0.00 C ATOM 1897 NE ARG B 240 87.244 -12.836 26.180 1.00 0.00 N ATOM 1898 CZ ARG B 240 87.454 -11.809 27.024 1.00 0.00 C ATOM 1899 NH1 ARG B 240 86.777 -10.687 26.924 1.00 0.00 N ATOM 1900 NH2 ARG B 240 88.349 -11.929 27.965 1.00 0.00 N ATOM 1901 OXT ARG B 240 82.752 -16.058 24.001 1.00 0.00 O ATOM 0 H ARG B 240 83.193 -14.692 21.624 1.00 0.00 H new ATOM 0 HA ARG B 240 85.649 -16.029 22.606 1.00 0.00 H new ATOM 0 HB2 ARG B 240 85.537 -13.509 22.569 1.00 0.00 H new ATOM 0 HB3 ARG B 240 84.130 -13.573 23.612 1.00 0.00 H new ATOM 0 HG2 ARG B 240 85.487 -14.789 25.352 1.00 0.00 H new ATOM 0 HG3 ARG B 240 86.894 -14.691 24.313 1.00 0.00 H new ATOM 0 HD2 ARG B 240 86.620 -12.156 24.289 1.00 0.00 H new ATOM 0 HD3 ARG B 240 85.331 -12.329 25.464 1.00 0.00 H new ATOM 0 HE ARG B 240 87.797 -13.685 26.296 1.00 0.00 H new ATOM 0 HH11 ARG B 240 86.073 -10.579 26.194 1.00 0.00 H new ATOM 0 HH12 ARG B 240 86.956 -9.924 27.577 1.00 0.00 H new ATOM 0 HH21 ARG B 240 88.881 -12.795 28.055 1.00 0.00 H new ATOM 0 HH22 ARG B 240 88.517 -11.157 28.611 1.00 0.00 H new TER 1915 ARG B 240 HETATM 1916 ZN ZN B 300 96.685 -12.490 2.812 1.00 0.00 ZN