USER MOD reduce.3.24.130724 H: found=0, std=0, add=694, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 695 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 476 TYR OH : rot -82:sc= 0.341 USER MOD Set 1.2: B 480 LYS NZ :NH3+ 169:sc= -0.034 (180deg=-0.18) USER MOD Set 2.1: B 468 ASN : amide:sc= 0.818 K(o=0.32,f=-0.29) USER MOD Set 2.2: B 472 GLN : amide:sc= -0.499 X(o=0.32,f=0.35) USER MOD Set 3.1: A 143 CYS SG : rot -8:sc= -0.769! USER MOD Set 3.2: B 473 CYS SG : rot 67:sc= 0.999 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.934 K(o=-0.93,f=-5.1!) USER MOD Single : A 91 ASN : amide:sc= 0.925 K(o=0.93,f=-1.6!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -1.79 K(o=-1.8,f=-0.6) USER MOD Single : A 98 SER OG : rot 170:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 104:sc= 1.24 USER MOD Single : A 107 ASN : amide:sc= 0.812 K(o=0.81,f=0) USER MOD Single : A 109 HIS : no HD1:sc= 0.495 K(o=0.49,f=-4.2!) USER MOD Single : A 112 GLN : amide:sc= -1.32 K(o=-1.3,f=-0.66) USER MOD Single : A 114 MET CE :methyl 159:sc= -0.587 (180deg=-0.986) USER MOD Single : A 116 ASN : amide:sc= -0.0387 K(o=-0.039,f=-1.3!) USER MOD Single : A 119 GLN : amide:sc= -0.434 X(o=-0.43,f=-0.5) USER MOD Single : A 123 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00726) USER MOD Single : A 125 LYS NZ :NH3+ -114:sc= 0.11 (180deg=-0.235) USER MOD Single : A 127 MET CE :methyl 176:sc= -0.0321 (180deg=-0.0644) USER MOD Single : A 130 TYR OH : rot 130:sc= -0.442 USER MOD Single : A 131 MET CE :methyl 147:sc= -3.9! (180deg=-5.28!) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 142 CYS SG : rot 83:sc= -0.61 USER MOD Single : B 465 HIS : no HD1:sc= -0.0108 X(o=-0.011,f=-0.33) USER MOD Single : B 479 LYS NZ :NH3+ 170:sc= -0.0108 (180deg=-0.126) USER MOD ----------------------------------------------------------------- ATOM 70 N ARG A 86 -1.566 -12.032 -0.520 1.00 0.00 N ATOM 71 CA ARG A 86 -0.911 -11.022 -1.331 1.00 0.00 C ATOM 72 C ARG A 86 -1.801 -10.682 -2.522 1.00 0.00 C ATOM 73 O ARG A 86 -2.423 -11.565 -3.118 1.00 0.00 O ATOM 74 CB ARG A 86 0.461 -11.512 -1.806 1.00 0.00 C ATOM 75 CG ARG A 86 0.412 -12.791 -2.629 1.00 0.00 C ATOM 76 CD ARG A 86 1.794 -13.194 -3.108 1.00 0.00 C ATOM 77 NE ARG A 86 2.689 -13.501 -1.995 1.00 0.00 N ATOM 78 CZ ARG A 86 3.994 -13.238 -1.989 1.00 0.00 C ATOM 79 NH1 ARG A 86 4.561 -12.631 -3.024 1.00 0.00 N ATOM 80 NH2 ARG A 86 4.730 -13.577 -0.939 1.00 0.00 N ATOM 0 HA ARG A 86 -0.753 -10.127 -0.730 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.929 -10.728 -2.401 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.098 -11.676 -0.937 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -0.016 -13.595 -2.030 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.245 -12.648 -3.487 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.713 -14.064 -3.759 1.00 0.00 H new ATOM 0 HD3 ARG A 86 2.221 -12.388 -3.705 1.00 0.00 H new ATOM 0 HE ARG A 86 2.288 -13.946 -1.169 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.996 -12.363 -3.830 1.00 0.00 H new ATOM 0 HH12 ARG A 86 5.561 -12.432 -3.013 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.296 -14.038 -0.139 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.730 -13.377 -0.931 1.00 0.00 H new ATOM 94 N VAL A 87 -1.862 -9.407 -2.864 1.00 0.00 N ATOM 95 CA VAL A 87 -2.780 -8.934 -3.888 1.00 0.00 C ATOM 96 C VAL A 87 -2.224 -9.189 -5.283 1.00 0.00 C ATOM 97 O VAL A 87 -1.047 -8.945 -5.546 1.00 0.00 O ATOM 98 CB VAL A 87 -3.069 -7.429 -3.731 1.00 0.00 C ATOM 99 CG1 VAL A 87 -4.154 -6.986 -4.695 1.00 0.00 C ATOM 100 CG2 VAL A 87 -3.459 -7.104 -2.301 1.00 0.00 C ATOM 0 H VAL A 87 -1.285 -8.677 -2.446 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.709 -9.490 -3.762 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.157 -6.882 -3.970 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.342 -5.920 -4.567 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.831 -7.177 -5.719 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -5.069 -7.542 -4.493 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -3.659 -6.036 -2.212 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.354 -7.664 -2.032 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.644 -7.378 -1.631 1.00 0.00 H new ATOM 110 N SER A 88 -3.079 -9.698 -6.160 1.00 0.00 N ATOM 111 CA SER A 88 -2.720 -9.924 -7.552 1.00 0.00 C ATOM 112 C SER A 88 -2.504 -8.589 -8.258 1.00 0.00 C ATOM 113 O SER A 88 -3.198 -7.607 -7.981 1.00 0.00 O ATOM 114 CB SER A 88 -3.833 -10.720 -8.233 1.00 0.00 C ATOM 115 OG SER A 88 -4.153 -11.878 -7.477 1.00 0.00 O ATOM 0 H SER A 88 -4.036 -9.964 -5.927 1.00 0.00 H new ATOM 0 HA SER A 88 -1.791 -10.492 -7.606 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.719 -10.095 -8.344 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.519 -11.009 -9.236 1.00 0.00 H new ATOM 0 HG SER A 88 -4.868 -12.375 -7.926 1.00 0.00 H new ATOM 121 N LEU A 89 -1.541 -8.572 -9.175 1.00 0.00 N ATOM 122 CA LEU A 89 -1.106 -7.351 -9.839 1.00 0.00 C ATOM 123 C LEU A 89 -2.240 -6.734 -10.642 1.00 0.00 C ATOM 124 O LEU A 89 -2.333 -5.515 -10.756 1.00 0.00 O ATOM 125 CB LEU A 89 0.087 -7.651 -10.742 1.00 0.00 C ATOM 126 CG LEU A 89 1.032 -6.470 -10.980 1.00 0.00 C ATOM 127 CD1 LEU A 89 2.456 -6.962 -11.144 1.00 0.00 C ATOM 128 CD2 LEU A 89 0.611 -5.676 -12.205 1.00 0.00 C ATOM 0 H LEU A 89 -1.040 -9.407 -9.478 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.805 -6.630 -9.079 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.657 -8.471 -10.305 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.285 -7.999 -11.706 1.00 0.00 H new ATOM 0 HG LEU A 89 0.980 -5.814 -10.111 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.117 -6.112 -11.313 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.765 -7.489 -10.241 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.511 -7.639 -11.996 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.298 -4.843 -12.352 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.631 -6.323 -13.082 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.399 -5.292 -12.060 1.00 0.00 H new ATOM 140 N GLN A 90 -3.100 -7.583 -11.192 1.00 0.00 N ATOM 141 CA GLN A 90 -4.293 -7.121 -11.896 1.00 0.00 C ATOM 142 C GLN A 90 -5.137 -6.234 -10.996 1.00 0.00 C ATOM 143 O GLN A 90 -5.609 -5.183 -11.418 1.00 0.00 O ATOM 144 CB GLN A 90 -5.137 -8.303 -12.371 1.00 0.00 C ATOM 145 CG GLN A 90 -4.527 -9.074 -13.524 1.00 0.00 C ATOM 146 CD GLN A 90 -4.569 -8.313 -14.838 1.00 0.00 C ATOM 147 OE1 GLN A 90 -4.525 -7.083 -14.868 1.00 0.00 O ATOM 148 NE2 GLN A 90 -4.653 -9.047 -15.935 1.00 0.00 N ATOM 0 H GLN A 90 -2.994 -8.597 -11.165 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.963 -6.547 -12.762 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.293 -8.984 -11.534 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -6.119 -7.937 -12.671 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -3.492 -9.316 -13.284 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.056 -10.020 -13.641 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -4.687 -10.064 -15.867 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -4.684 -8.596 -16.849 1.00 0.00 H new ATOM 157 N ASN A 91 -5.298 -6.661 -9.749 1.00 0.00 N ATOM 158 CA ASN A 91 -6.093 -5.925 -8.772 1.00 0.00 C ATOM 159 C ASN A 91 -5.405 -4.621 -8.403 1.00 0.00 C ATOM 160 O ASN A 91 -6.058 -3.635 -8.061 1.00 0.00 O ATOM 161 CB ASN A 91 -6.323 -6.765 -7.510 1.00 0.00 C ATOM 162 CG ASN A 91 -7.277 -7.927 -7.730 1.00 0.00 C ATOM 163 OD1 ASN A 91 -7.370 -8.475 -8.828 1.00 0.00 O ATOM 164 ND2 ASN A 91 -7.989 -8.313 -6.682 1.00 0.00 N ATOM 0 H ASN A 91 -4.885 -7.521 -9.388 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.060 -5.703 -9.224 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.366 -7.151 -7.159 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.717 -6.124 -6.722 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.643 -9.091 -6.768 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.883 -7.833 -5.788 1.00 0.00 H new ATOM 171 N LEU A 92 -4.086 -4.616 -8.502 1.00 0.00 N ATOM 172 CA LEU A 92 -3.301 -3.442 -8.173 1.00 0.00 C ATOM 173 C LEU A 92 -3.346 -2.432 -9.309 1.00 0.00 C ATOM 174 O LEU A 92 -3.371 -1.231 -9.076 1.00 0.00 O ATOM 175 CB LEU A 92 -1.853 -3.840 -7.875 1.00 0.00 C ATOM 176 CG LEU A 92 -1.678 -4.792 -6.693 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.225 -5.220 -6.565 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.155 -4.133 -5.409 1.00 0.00 C ATOM 0 H LEU A 92 -3.536 -5.418 -8.810 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.729 -2.979 -7.284 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.429 -4.307 -8.764 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.275 -2.936 -7.683 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.283 -5.681 -6.871 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.119 -5.898 -5.718 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.086 -5.728 -7.478 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.401 -4.341 -6.407 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.024 -4.823 -4.575 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.574 -3.229 -5.226 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.209 -3.874 -5.503 1.00 0.00 H new ATOM 190 N LYS A 93 -3.382 -2.924 -10.542 1.00 0.00 N ATOM 191 CA LYS A 93 -3.387 -2.051 -11.715 1.00 0.00 C ATOM 192 C LYS A 93 -4.561 -1.072 -11.707 1.00 0.00 C ATOM 193 O LYS A 93 -4.452 0.033 -12.234 1.00 0.00 O ATOM 194 CB LYS A 93 -3.411 -2.870 -13.006 1.00 0.00 C ATOM 195 CG LYS A 93 -2.145 -3.677 -13.232 1.00 0.00 C ATOM 196 CD LYS A 93 -2.094 -4.274 -14.629 1.00 0.00 C ATOM 197 CE LYS A 93 -1.931 -3.199 -15.692 1.00 0.00 C ATOM 198 NZ LYS A 93 -1.807 -3.780 -17.052 1.00 0.00 N ATOM 0 H LYS A 93 -3.408 -3.921 -10.758 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.466 -1.470 -11.671 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -4.265 -3.547 -12.982 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.560 -2.198 -13.851 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.275 -3.038 -13.078 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.088 -4.477 -12.493 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -1.265 -4.979 -14.694 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -3.008 -4.838 -14.818 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -2.788 -2.526 -15.662 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.047 -2.601 -15.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -1.698 -3.015 -17.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.975 -4.403 -17.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.661 -4.330 -17.274 1.00 0.00 H new ATOM 212 N ASN A 94 -5.671 -1.467 -11.096 1.00 0.00 N ATOM 213 CA ASN A 94 -6.871 -0.630 -11.092 1.00 0.00 C ATOM 214 C ASN A 94 -6.703 0.563 -10.163 1.00 0.00 C ATOM 215 O ASN A 94 -7.427 1.547 -10.273 1.00 0.00 O ATOM 216 CB ASN A 94 -8.100 -1.420 -10.657 1.00 0.00 C ATOM 217 CG ASN A 94 -8.111 -2.811 -11.225 1.00 0.00 C ATOM 218 OD1 ASN A 94 -8.543 -3.038 -12.354 1.00 0.00 O ATOM 219 ND2 ASN A 94 -7.656 -3.756 -10.432 1.00 0.00 N ATOM 0 H ASN A 94 -5.769 -2.353 -10.600 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.013 -0.280 -12.114 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -8.129 -1.474 -9.569 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.000 -0.893 -10.974 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -7.651 -4.727 -10.746 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.308 -3.518 -9.503 1.00 0.00 H new ATOM 226 N LEU A 95 -5.741 0.469 -9.254 1.00 0.00 N ATOM 227 CA LEU A 95 -5.536 1.497 -8.243 1.00 0.00 C ATOM 228 C LEU A 95 -5.167 2.828 -8.884 1.00 0.00 C ATOM 229 O LEU A 95 -5.739 3.867 -8.554 1.00 0.00 O ATOM 230 CB LEU A 95 -4.440 1.064 -7.270 1.00 0.00 C ATOM 231 CG LEU A 95 -4.689 -0.268 -6.568 1.00 0.00 C ATOM 232 CD1 LEU A 95 -3.521 -0.625 -5.671 1.00 0.00 C ATOM 233 CD2 LEU A 95 -5.980 -0.231 -5.773 1.00 0.00 C ATOM 0 H LEU A 95 -5.088 -0.312 -9.197 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.470 1.628 -7.697 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.497 1.000 -7.813 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.320 1.839 -6.513 1.00 0.00 H new ATOM 0 HG LEU A 95 -4.785 -1.039 -7.333 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.718 -1.578 -5.179 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.614 -0.706 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.390 0.152 -4.918 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -6.133 -1.192 -5.283 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -5.921 0.555 -5.020 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.815 -0.029 -6.444 1.00 0.00 H new ATOM 245 N GLY A 96 -4.226 2.787 -9.819 1.00 0.00 N ATOM 246 CA GLY A 96 -3.797 3.997 -10.491 1.00 0.00 C ATOM 247 C GLY A 96 -4.813 4.481 -11.506 1.00 0.00 C ATOM 248 O GLY A 96 -4.761 5.628 -11.954 1.00 0.00 O ATOM 0 H GLY A 96 -3.752 1.937 -10.124 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.624 4.779 -9.752 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.846 3.815 -10.991 1.00 0.00 H new ATOM 252 N GLU A 97 -5.747 3.609 -11.860 1.00 0.00 N ATOM 253 CA GLU A 97 -6.756 3.932 -12.857 1.00 0.00 C ATOM 254 C GLU A 97 -8.032 4.423 -12.182 1.00 0.00 C ATOM 255 O GLU A 97 -8.906 5.013 -12.822 1.00 0.00 O ATOM 256 CB GLU A 97 -7.059 2.704 -13.714 1.00 0.00 C ATOM 257 CG GLU A 97 -5.818 2.037 -14.286 1.00 0.00 C ATOM 258 CD GLU A 97 -4.955 2.985 -15.093 1.00 0.00 C ATOM 259 OE1 GLU A 97 -3.908 3.428 -14.580 1.00 0.00 O ATOM 260 OE2 GLU A 97 -5.318 3.290 -16.249 1.00 0.00 O ATOM 0 H GLU A 97 -5.826 2.670 -11.470 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.371 4.726 -13.497 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -7.606 1.978 -13.113 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -7.714 2.997 -14.534 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -5.227 1.622 -13.470 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -6.120 1.202 -14.918 1.00 0.00 H new ATOM 267 N SER A 98 -8.133 4.165 -10.888 1.00 0.00 N ATOM 268 CA SER A 98 -9.272 4.595 -10.103 1.00 0.00 C ATOM 269 C SER A 98 -9.153 6.076 -9.784 1.00 0.00 C ATOM 270 O SER A 98 -8.179 6.516 -9.166 1.00 0.00 O ATOM 271 CB SER A 98 -9.362 3.783 -8.809 1.00 0.00 C ATOM 272 OG SER A 98 -10.406 4.259 -7.973 1.00 0.00 O ATOM 0 H SER A 98 -7.429 3.653 -10.356 1.00 0.00 H new ATOM 0 HA SER A 98 -10.180 4.429 -10.682 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.534 2.733 -9.047 1.00 0.00 H new ATOM 0 HB3 SER A 98 -8.413 3.838 -8.276 1.00 0.00 H new ATOM 0 HG SER A 98 -10.547 3.630 -7.235 1.00 0.00 H new ATOM 278 N ALA A 99 -10.150 6.836 -10.210 1.00 0.00 N ATOM 279 CA ALA A 99 -10.169 8.269 -9.988 1.00 0.00 C ATOM 280 C ALA A 99 -10.300 8.580 -8.504 1.00 0.00 C ATOM 281 O ALA A 99 -9.827 9.611 -8.032 1.00 0.00 O ATOM 282 CB ALA A 99 -11.305 8.909 -10.768 1.00 0.00 C ATOM 0 H ALA A 99 -10.961 6.479 -10.715 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.226 8.686 -10.343 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.307 9.985 -10.592 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -11.170 8.716 -11.832 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.255 8.486 -10.441 1.00 0.00 H new ATOM 288 N THR A 100 -10.919 7.666 -7.773 1.00 0.00 N ATOM 289 CA THR A 100 -11.125 7.846 -6.347 1.00 0.00 C ATOM 290 C THR A 100 -9.806 7.767 -5.584 1.00 0.00 C ATOM 291 O THR A 100 -9.514 8.618 -4.743 1.00 0.00 O ATOM 292 CB THR A 100 -12.089 6.787 -5.789 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.273 6.738 -6.595 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.458 7.103 -4.348 1.00 0.00 C ATOM 0 H THR A 100 -11.288 6.791 -8.146 1.00 0.00 H new ATOM 0 HA THR A 100 -11.559 8.836 -6.211 1.00 0.00 H new ATOM 0 HB THR A 100 -11.592 5.817 -5.814 1.00 0.00 H new ATOM 0 HG1 THR A 100 -13.884 6.061 -6.237 1.00 0.00 H new ATOM 0 HG21 THR A 100 -13.141 6.341 -3.972 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.556 7.116 -3.736 1.00 0.00 H new ATOM 0 HG23 THR A 100 -12.942 8.079 -4.302 1.00 0.00 H new ATOM 302 N LEU A 101 -8.994 6.768 -5.906 1.00 0.00 N ATOM 303 CA LEU A 101 -7.778 6.519 -5.148 1.00 0.00 C ATOM 304 C LEU A 101 -6.748 7.604 -5.419 1.00 0.00 C ATOM 305 O LEU A 101 -6.162 8.156 -4.494 1.00 0.00 O ATOM 306 CB LEU A 101 -7.185 5.150 -5.482 1.00 0.00 C ATOM 307 CG LEU A 101 -5.975 4.759 -4.629 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.384 4.535 -3.181 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.294 3.523 -5.189 1.00 0.00 C ATOM 0 H LEU A 101 -9.154 6.123 -6.680 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.042 6.531 -4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -7.960 4.393 -5.361 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.892 5.141 -6.532 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.262 5.583 -4.659 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.508 4.258 -2.594 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.815 5.452 -2.779 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.122 3.734 -3.131 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.438 3.265 -4.566 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -5.999 2.692 -5.198 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.956 3.723 -6.206 1.00 0.00 H new ATOM 321 N ARG A 102 -6.551 7.923 -6.690 1.00 0.00 N ATOM 322 CA ARG A 102 -5.571 8.932 -7.080 1.00 0.00 C ATOM 323 C ARG A 102 -5.894 10.293 -6.468 1.00 0.00 C ATOM 324 O ARG A 102 -4.996 11.099 -6.235 1.00 0.00 O ATOM 325 CB ARG A 102 -5.491 9.050 -8.597 1.00 0.00 C ATOM 326 CG ARG A 102 -6.839 9.240 -9.258 1.00 0.00 C ATOM 327 CD ARG A 102 -6.693 9.686 -10.697 1.00 0.00 C ATOM 328 NE ARG A 102 -5.952 8.713 -11.496 1.00 0.00 N ATOM 329 CZ ARG A 102 -5.724 8.841 -12.800 1.00 0.00 C ATOM 330 NH1 ARG A 102 -6.160 9.910 -13.452 1.00 0.00 N ATOM 331 NH2 ARG A 102 -5.056 7.898 -13.451 1.00 0.00 N ATOM 0 H ARG A 102 -7.055 7.500 -7.469 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.603 8.608 -6.698 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.847 9.890 -8.855 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.021 8.153 -8.999 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.399 8.305 -9.221 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.416 9.980 -8.703 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.681 9.836 -11.132 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.181 10.648 -10.729 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.587 7.885 -11.025 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.672 10.638 -12.953 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.983 10.005 -14.452 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.718 7.076 -12.952 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.881 7.995 -14.451 1.00 0.00 H new ATOM 345 N SER A 103 -7.172 10.539 -6.193 1.00 0.00 N ATOM 346 CA SER A 103 -7.588 11.780 -5.550 1.00 0.00 C ATOM 347 C SER A 103 -6.982 11.892 -4.150 1.00 0.00 C ATOM 348 O SER A 103 -6.832 12.989 -3.610 1.00 0.00 O ATOM 349 CB SER A 103 -9.113 11.854 -5.478 1.00 0.00 C ATOM 350 OG SER A 103 -9.680 11.894 -6.780 1.00 0.00 O ATOM 0 H SER A 103 -7.935 9.896 -6.405 1.00 0.00 H new ATOM 0 HA SER A 103 -7.225 12.616 -6.148 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.498 10.990 -4.936 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.412 12.741 -4.919 1.00 0.00 H new ATOM 0 HG SER A 103 -10.053 11.015 -7.001 1.00 0.00 H new ATOM 356 N LEU A 104 -6.622 10.753 -3.577 1.00 0.00 N ATOM 357 CA LEU A 104 -5.999 10.718 -2.263 1.00 0.00 C ATOM 358 C LEU A 104 -4.490 10.893 -2.404 1.00 0.00 C ATOM 359 O LEU A 104 -3.839 11.531 -1.575 1.00 0.00 O ATOM 360 CB LEU A 104 -6.320 9.394 -1.567 1.00 0.00 C ATOM 361 CG LEU A 104 -7.779 8.941 -1.674 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.001 7.660 -0.893 1.00 0.00 C ATOM 363 CD2 LEU A 104 -8.723 10.032 -1.192 1.00 0.00 C ATOM 0 H LEU A 104 -6.752 9.836 -4.005 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.393 11.533 -1.656 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.683 8.616 -1.988 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.060 9.483 -0.512 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.995 8.745 -2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.044 7.356 -0.982 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.358 6.875 -1.292 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.761 7.828 0.157 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.753 9.686 -1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.505 10.268 -0.150 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.588 10.925 -1.802 1.00 0.00 H new ATOM 375 N LEU A 105 -3.952 10.352 -3.494 1.00 0.00 N ATOM 376 CA LEU A 105 -2.525 10.450 -3.809 1.00 0.00 C ATOM 377 C LEU A 105 -2.127 11.902 -4.050 1.00 0.00 C ATOM 378 O LEU A 105 -0.946 12.258 -4.014 1.00 0.00 O ATOM 379 CB LEU A 105 -2.194 9.635 -5.065 1.00 0.00 C ATOM 380 CG LEU A 105 -2.010 8.123 -4.882 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.215 7.480 -4.221 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.741 7.474 -6.229 1.00 0.00 C ATOM 0 H LEU A 105 -4.492 9.832 -4.186 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.970 10.055 -2.958 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.990 9.794 -5.792 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.279 10.038 -5.500 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.157 7.967 -4.222 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.042 6.410 -4.111 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.372 7.925 -3.238 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -4.099 7.643 -4.838 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.611 6.400 -6.096 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.583 7.657 -6.896 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.836 7.898 -6.663 1.00 0.00 H new ATOM 394 N LEU A 106 -3.130 12.727 -4.313 1.00 0.00 N ATOM 395 CA LEU A 106 -2.930 14.143 -4.573 1.00 0.00 C ATOM 396 C LEU A 106 -2.411 14.867 -3.332 1.00 0.00 C ATOM 397 O LEU A 106 -1.818 15.941 -3.435 1.00 0.00 O ATOM 398 CB LEU A 106 -4.240 14.769 -5.037 1.00 0.00 C ATOM 399 CG LEU A 106 -4.825 14.172 -6.318 1.00 0.00 C ATOM 400 CD1 LEU A 106 -6.055 14.947 -6.747 1.00 0.00 C ATOM 401 CD2 LEU A 106 -3.791 14.152 -7.433 1.00 0.00 C ATOM 0 H LEU A 106 -4.106 12.432 -4.352 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.180 14.245 -5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.976 14.669 -4.239 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.080 15.836 -5.192 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.116 13.142 -6.111 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -6.460 14.510 -7.660 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -6.807 14.902 -5.959 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -5.784 15.987 -6.931 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.233 13.723 -8.332 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.461 15.170 -7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.936 13.549 -7.126 1.00 0.00 H new ATOM 413 N ASN A 107 -2.628 14.271 -2.165 1.00 0.00 N ATOM 414 CA ASN A 107 -2.157 14.851 -0.912 1.00 0.00 C ATOM 415 C ASN A 107 -0.668 14.586 -0.735 1.00 0.00 C ATOM 416 O ASN A 107 -0.239 13.431 -0.666 1.00 0.00 O ATOM 417 CB ASN A 107 -2.916 14.274 0.287 1.00 0.00 C ATOM 418 CG ASN A 107 -4.396 14.591 0.264 1.00 0.00 C ATOM 419 OD1 ASN A 107 -4.817 15.681 0.655 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.196 13.626 -0.151 1.00 0.00 N ATOM 0 H ASN A 107 -3.127 13.387 -2.060 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.338 15.925 -0.957 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.783 13.192 0.307 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.481 14.666 1.207 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.206 13.768 -0.156 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.804 12.739 -0.466 1.00 0.00 H new ATOM 427 N PRO A 108 0.140 15.661 -0.673 1.00 0.00 N ATOM 428 CA PRO A 108 1.591 15.562 -0.473 1.00 0.00 C ATOM 429 C PRO A 108 1.957 14.796 0.795 1.00 0.00 C ATOM 430 O PRO A 108 2.933 14.048 0.816 1.00 0.00 O ATOM 431 CB PRO A 108 2.044 17.021 -0.365 1.00 0.00 C ATOM 432 CG PRO A 108 0.988 17.797 -1.071 1.00 0.00 C ATOM 433 CD PRO A 108 -0.296 17.063 -0.815 1.00 0.00 C ATOM 0 HA PRO A 108 2.071 15.013 -1.284 1.00 0.00 H new ATOM 0 HB2 PRO A 108 2.135 17.332 0.676 1.00 0.00 H new ATOM 0 HB3 PRO A 108 3.020 17.168 -0.828 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.936 18.819 -0.695 1.00 0.00 H new ATOM 0 HG3 PRO A 108 1.197 17.860 -2.139 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -0.793 17.423 0.086 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -1.000 17.184 -1.638 1.00 0.00 H new ATOM 441 N HIS A 109 1.166 14.974 1.845 1.00 0.00 N ATOM 442 CA HIS A 109 1.400 14.265 3.096 1.00 0.00 C ATOM 443 C HIS A 109 1.129 12.772 2.925 1.00 0.00 C ATOM 444 O HIS A 109 1.904 11.932 3.386 1.00 0.00 O ATOM 445 CB HIS A 109 0.518 14.839 4.213 1.00 0.00 C ATOM 446 CG HIS A 109 0.601 14.078 5.501 1.00 0.00 C ATOM 447 ND1 HIS A 109 1.478 14.435 6.495 1.00 0.00 N ATOM 448 CD2 HIS A 109 -0.090 12.979 5.892 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.305 13.551 7.462 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.366 12.651 7.144 1.00 0.00 N ATOM 0 H HIS A 109 0.361 15.600 1.856 1.00 0.00 H new ATOM 0 HA HIS A 109 2.445 14.399 3.374 1.00 0.00 H new ATOM 0 HB2 HIS A 109 0.806 15.874 4.395 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.518 14.851 3.875 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -0.852 12.462 5.327 1.00 0.00 H new ATOM 0 HE1 HIS A 109 1.853 13.554 8.393 1.00 0.00 H new ATOM 0 HE2 HIS A 109 0.050 11.872 7.721 1.00 0.00 H new ATOM 458 N LEU A 110 0.029 12.453 2.253 1.00 0.00 N ATOM 459 CA LEU A 110 -0.398 11.074 2.078 1.00 0.00 C ATOM 460 C LEU A 110 0.610 10.313 1.223 1.00 0.00 C ATOM 461 O LEU A 110 1.014 9.201 1.563 1.00 0.00 O ATOM 462 CB LEU A 110 -1.788 11.047 1.431 1.00 0.00 C ATOM 463 CG LEU A 110 -2.615 9.779 1.661 1.00 0.00 C ATOM 464 CD1 LEU A 110 -4.046 10.004 1.208 1.00 0.00 C ATOM 465 CD2 LEU A 110 -2.018 8.587 0.928 1.00 0.00 C ATOM 0 H LEU A 110 -0.587 13.139 1.817 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.452 10.587 3.051 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.356 11.899 1.804 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.669 11.189 0.357 1.00 0.00 H new ATOM 0 HG LEU A 110 -2.603 9.558 2.728 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -4.627 9.097 1.375 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -4.483 10.825 1.777 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -4.057 10.252 0.147 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -2.629 7.703 1.112 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -1.992 8.794 -0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -1.005 8.409 1.288 1.00 0.00 H new ATOM 477 N ARG A 111 1.027 10.927 0.124 1.00 0.00 N ATOM 478 CA ARG A 111 1.976 10.288 -0.783 1.00 0.00 C ATOM 479 C ARG A 111 3.316 10.076 -0.090 1.00 0.00 C ATOM 480 O ARG A 111 4.000 9.085 -0.334 1.00 0.00 O ATOM 481 CB ARG A 111 2.169 11.107 -2.064 1.00 0.00 C ATOM 482 CG ARG A 111 2.787 12.476 -1.842 1.00 0.00 C ATOM 483 CD ARG A 111 3.048 13.191 -3.158 1.00 0.00 C ATOM 484 NE ARG A 111 1.844 13.271 -3.980 1.00 0.00 N ATOM 485 CZ ARG A 111 1.786 13.879 -5.164 1.00 0.00 C ATOM 486 NH1 ARG A 111 2.846 14.522 -5.640 1.00 0.00 N ATOM 487 NH2 ARG A 111 0.662 13.846 -5.867 1.00 0.00 N ATOM 0 H ARG A 111 0.727 11.859 -0.161 1.00 0.00 H new ATOM 0 HA ARG A 111 1.562 9.319 -1.063 1.00 0.00 H new ATOM 0 HB2 ARG A 111 2.801 10.543 -2.750 1.00 0.00 H new ATOM 0 HB3 ARG A 111 1.202 11.232 -2.551 1.00 0.00 H new ATOM 0 HG2 ARG A 111 2.123 13.080 -1.224 1.00 0.00 H new ATOM 0 HG3 ARG A 111 3.723 12.369 -1.293 1.00 0.00 H new ATOM 0 HD2 ARG A 111 3.419 14.196 -2.958 1.00 0.00 H new ATOM 0 HD3 ARG A 111 3.829 12.666 -3.708 1.00 0.00 H new ATOM 0 HE ARG A 111 0.993 12.834 -3.625 1.00 0.00 H new ATOM 0 HH11 ARG A 111 3.710 14.552 -5.099 1.00 0.00 H new ATOM 0 HH12 ARG A 111 2.796 14.986 -6.547 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -0.154 13.356 -5.501 1.00 0.00 H new ATOM 0 HH22 ARG A 111 0.614 14.310 -6.774 1.00 0.00 H new ATOM 501 N GLN A 112 3.678 11.004 0.788 1.00 0.00 N ATOM 502 CA GLN A 112 4.907 10.889 1.552 1.00 0.00 C ATOM 503 C GLN A 112 4.837 9.722 2.520 1.00 0.00 C ATOM 504 O GLN A 112 5.838 9.053 2.758 1.00 0.00 O ATOM 505 CB GLN A 112 5.203 12.188 2.295 1.00 0.00 C ATOM 506 CG GLN A 112 6.144 13.101 1.530 1.00 0.00 C ATOM 507 CD GLN A 112 7.518 12.478 1.364 1.00 0.00 C ATOM 508 OE1 GLN A 112 8.397 12.651 2.208 1.00 0.00 O ATOM 509 NE2 GLN A 112 7.721 11.746 0.280 1.00 0.00 N ATOM 0 H GLN A 112 3.135 11.844 0.986 1.00 0.00 H new ATOM 0 HA GLN A 112 5.722 10.700 0.854 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.267 12.714 2.485 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.640 11.955 3.266 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.722 13.319 0.549 1.00 0.00 H new ATOM 0 HG3 GLN A 112 6.236 14.051 2.056 1.00 0.00 H new ATOM 0 HE21 GLN A 112 6.971 11.623 -0.400 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.628 11.305 0.125 1.00 0.00 H new ATOM 518 N LEU A 113 3.654 9.472 3.065 1.00 0.00 N ATOM 519 CA LEU A 113 3.441 8.307 3.911 1.00 0.00 C ATOM 520 C LEU A 113 3.745 7.036 3.123 1.00 0.00 C ATOM 521 O LEU A 113 4.492 6.169 3.577 1.00 0.00 O ATOM 522 CB LEU A 113 2.000 8.276 4.437 1.00 0.00 C ATOM 523 CG LEU A 113 1.650 9.353 5.471 1.00 0.00 C ATOM 524 CD1 LEU A 113 0.181 9.266 5.847 1.00 0.00 C ATOM 525 CD2 LEU A 113 2.519 9.206 6.709 1.00 0.00 C ATOM 0 H LEU A 113 2.830 10.059 2.937 1.00 0.00 H new ATOM 0 HA LEU A 113 4.114 8.367 4.766 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.321 8.376 3.590 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.815 7.298 4.881 1.00 0.00 H new ATOM 0 HG LEU A 113 1.841 10.331 5.028 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.053 10.037 6.582 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.432 9.415 4.958 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.028 8.284 6.272 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.257 9.979 7.432 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.357 8.224 7.153 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.568 9.310 6.432 1.00 0.00 H new ATOM 537 N MET A 114 3.184 6.956 1.924 1.00 0.00 N ATOM 538 CA MET A 114 3.439 5.838 1.023 1.00 0.00 C ATOM 539 C MET A 114 4.936 5.674 0.765 1.00 0.00 C ATOM 540 O MET A 114 5.488 4.589 0.944 1.00 0.00 O ATOM 541 CB MET A 114 2.701 6.053 -0.301 1.00 0.00 C ATOM 542 CG MET A 114 1.208 5.777 -0.228 1.00 0.00 C ATOM 543 SD MET A 114 0.315 6.460 -1.638 1.00 0.00 S ATOM 544 CE MET A 114 1.171 5.666 -2.994 1.00 0.00 C ATOM 0 H MET A 114 2.545 7.657 1.550 1.00 0.00 H new ATOM 0 HA MET A 114 3.071 4.928 1.496 1.00 0.00 H new ATOM 0 HB2 MET A 114 2.854 7.081 -0.628 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.143 5.408 -1.060 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.042 4.701 -0.182 1.00 0.00 H new ATOM 0 HG3 MET A 114 0.807 6.201 0.693 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.536 5.675 -3.880 1.00 0.00 H new ATOM 0 HE2 MET A 114 2.096 6.203 -3.205 1.00 0.00 H new ATOM 0 HE3 MET A 114 1.403 4.636 -2.724 1.00 0.00 H new ATOM 554 N VAL A 115 5.588 6.762 0.365 1.00 0.00 N ATOM 555 CA VAL A 115 7.007 6.752 0.065 1.00 0.00 C ATOM 556 C VAL A 115 7.836 6.343 1.284 1.00 0.00 C ATOM 557 O VAL A 115 8.819 5.613 1.161 1.00 0.00 O ATOM 558 CB VAL A 115 7.453 8.141 -0.433 1.00 0.00 C ATOM 559 CG1 VAL A 115 8.950 8.191 -0.632 1.00 0.00 C ATOM 560 CG2 VAL A 115 6.737 8.500 -1.725 1.00 0.00 C ATOM 0 H VAL A 115 5.144 7.672 0.241 1.00 0.00 H new ATOM 0 HA VAL A 115 7.177 6.014 -0.719 1.00 0.00 H new ATOM 0 HB VAL A 115 7.186 8.873 0.330 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.237 9.182 -0.984 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.450 7.982 0.314 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.244 7.445 -1.370 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.065 9.484 -2.061 1.00 0.00 H new ATOM 0 HG22 VAL A 115 6.971 7.759 -2.489 1.00 0.00 H new ATOM 0 HG23 VAL A 115 5.661 8.515 -1.552 1.00 0.00 H new ATOM 570 N ASN A 116 7.428 6.809 2.456 1.00 0.00 N ATOM 571 CA ASN A 116 8.118 6.481 3.698 1.00 0.00 C ATOM 572 C ASN A 116 8.025 4.991 3.999 1.00 0.00 C ATOM 573 O ASN A 116 9.005 4.361 4.403 1.00 0.00 O ATOM 574 CB ASN A 116 7.518 7.266 4.866 1.00 0.00 C ATOM 575 CG ASN A 116 8.023 8.689 4.951 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.150 8.991 4.554 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.191 9.573 5.474 1.00 0.00 N ATOM 0 H ASN A 116 6.619 7.418 2.574 1.00 0.00 H new ATOM 0 HA ASN A 116 9.166 6.753 3.574 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.433 7.278 4.767 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.748 6.750 5.798 1.00 0.00 H new ATOM 0 HD21 ASN A 116 7.473 10.549 5.562 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.267 9.279 5.790 1.00 0.00 H new ATOM 584 N LEU A 117 6.838 4.442 3.797 1.00 0.00 N ATOM 585 CA LEU A 117 6.567 3.040 4.089 1.00 0.00 C ATOM 586 C LEU A 117 7.333 2.111 3.146 1.00 0.00 C ATOM 587 O LEU A 117 7.843 1.072 3.570 1.00 0.00 O ATOM 588 CB LEU A 117 5.061 2.777 3.979 1.00 0.00 C ATOM 589 CG LEU A 117 4.608 1.359 4.334 1.00 0.00 C ATOM 590 CD1 LEU A 117 4.922 1.039 5.788 1.00 0.00 C ATOM 591 CD2 LEU A 117 3.120 1.200 4.064 1.00 0.00 C ATOM 0 H LEU A 117 6.036 4.952 3.427 1.00 0.00 H new ATOM 0 HA LEU A 117 6.905 2.831 5.104 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.540 3.479 4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.746 2.995 2.958 1.00 0.00 H new ATOM 0 HG LEU A 117 5.155 0.656 3.706 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.591 0.026 6.017 1.00 0.00 H new ATOM 0 HD12 LEU A 117 5.997 1.116 5.954 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.404 1.746 6.436 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.810 0.187 4.320 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.562 1.915 4.669 1.00 0.00 H new ATOM 0 HD23 LEU A 117 2.920 1.384 3.008 1.00 0.00 H new ATOM 603 N ASP A 118 7.430 2.508 1.879 1.00 0.00 N ATOM 604 CA ASP A 118 8.057 1.680 0.842 1.00 0.00 C ATOM 605 C ASP A 118 9.539 1.460 1.127 1.00 0.00 C ATOM 606 O ASP A 118 10.118 0.442 0.739 1.00 0.00 O ATOM 607 CB ASP A 118 7.879 2.335 -0.531 1.00 0.00 C ATOM 608 CG ASP A 118 8.434 1.497 -1.673 1.00 0.00 C ATOM 609 OD1 ASP A 118 9.058 2.076 -2.592 1.00 0.00 O ATOM 610 OD2 ASP A 118 8.244 0.263 -1.653 1.00 0.00 O ATOM 0 H ASP A 118 7.080 3.404 1.540 1.00 0.00 H new ATOM 0 HA ASP A 118 7.565 0.707 0.845 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.818 2.517 -0.705 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.373 3.307 -0.529 1.00 0.00 H new ATOM 615 N GLN A 119 10.142 2.417 1.823 1.00 0.00 N ATOM 616 CA GLN A 119 11.553 2.337 2.187 1.00 0.00 C ATOM 617 C GLN A 119 11.807 1.152 3.105 1.00 0.00 C ATOM 618 O GLN A 119 12.886 0.558 3.106 1.00 0.00 O ATOM 619 CB GLN A 119 11.982 3.624 2.879 1.00 0.00 C ATOM 620 CG GLN A 119 11.717 4.855 2.040 1.00 0.00 C ATOM 621 CD GLN A 119 12.084 6.141 2.749 1.00 0.00 C ATOM 622 OE1 GLN A 119 12.979 6.167 3.594 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.391 7.216 2.415 1.00 0.00 N ATOM 0 H GLN A 119 9.673 3.262 2.148 1.00 0.00 H new ATOM 0 HA GLN A 119 12.136 2.201 1.276 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.453 3.715 3.828 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.046 3.570 3.111 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.283 4.784 1.111 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.662 4.884 1.769 1.00 0.00 H new ATOM 0 HE21 GLN A 119 10.657 7.151 1.709 1.00 0.00 H new ATOM 0 HE22 GLN A 119 11.590 8.111 2.863 1.00 0.00 H new ATOM 632 N GLY A 120 10.781 0.822 3.874 1.00 0.00 N ATOM 633 CA GLY A 120 10.794 -0.375 4.698 1.00 0.00 C ATOM 634 C GLY A 120 11.776 -0.325 5.854 1.00 0.00 C ATOM 635 O GLY A 120 12.261 -1.366 6.293 1.00 0.00 O ATOM 0 H GLY A 120 9.924 1.371 3.944 1.00 0.00 H new ATOM 0 HA2 GLY A 120 9.792 -0.540 5.094 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.034 -1.233 4.069 1.00 0.00 H new ATOM 639 N GLU A 121 12.052 0.867 6.370 1.00 0.00 N ATOM 640 CA GLU A 121 12.992 1.014 7.472 1.00 0.00 C ATOM 641 C GLU A 121 12.356 0.504 8.753 1.00 0.00 C ATOM 642 O GLU A 121 12.884 -0.383 9.427 1.00 0.00 O ATOM 643 CB GLU A 121 13.393 2.480 7.635 1.00 0.00 C ATOM 644 CG GLU A 121 14.176 3.034 6.459 1.00 0.00 C ATOM 645 CD GLU A 121 15.472 2.288 6.234 1.00 0.00 C ATOM 646 OE1 GLU A 121 16.398 2.433 7.059 1.00 0.00 O ATOM 647 OE2 GLU A 121 15.571 1.549 5.236 1.00 0.00 O ATOM 0 H GLU A 121 11.640 1.741 6.044 1.00 0.00 H new ATOM 0 HA GLU A 121 13.887 0.431 7.256 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.494 3.080 7.776 1.00 0.00 H new ATOM 0 HB3 GLU A 121 13.991 2.585 8.540 1.00 0.00 H new ATOM 0 HG2 GLU A 121 13.565 2.977 5.558 1.00 0.00 H new ATOM 0 HG3 GLU A 121 14.391 4.088 6.632 1.00 0.00 H new ATOM 654 N ASP A 122 11.203 1.065 9.062 1.00 0.00 N ATOM 655 CA ASP A 122 10.413 0.652 10.205 1.00 0.00 C ATOM 656 C ASP A 122 8.962 0.533 9.799 1.00 0.00 C ATOM 657 O ASP A 122 8.058 1.069 10.439 1.00 0.00 O ATOM 658 CB ASP A 122 10.600 1.615 11.379 1.00 0.00 C ATOM 659 CG ASP A 122 10.630 3.079 10.975 1.00 0.00 C ATOM 660 OD1 ASP A 122 9.559 3.716 10.930 1.00 0.00 O ATOM 661 OD2 ASP A 122 11.738 3.608 10.732 1.00 0.00 O ATOM 0 H ASP A 122 10.786 1.824 8.524 1.00 0.00 H new ATOM 0 HA ASP A 122 10.756 -0.326 10.544 1.00 0.00 H new ATOM 0 HB2 ASP A 122 9.792 1.462 12.094 1.00 0.00 H new ATOM 0 HB3 ASP A 122 11.530 1.371 11.892 1.00 0.00 H new ATOM 666 N LYS A 123 8.776 -0.201 8.712 1.00 0.00 N ATOM 667 CA LYS A 123 7.467 -0.477 8.140 1.00 0.00 C ATOM 668 C LYS A 123 6.471 -0.954 9.196 1.00 0.00 C ATOM 669 O LYS A 123 5.303 -0.580 9.154 1.00 0.00 O ATOM 670 CB LYS A 123 7.580 -1.528 7.018 1.00 0.00 C ATOM 671 CG LYS A 123 8.019 -2.919 7.481 1.00 0.00 C ATOM 672 CD LYS A 123 9.491 -2.965 7.874 1.00 0.00 C ATOM 673 CE LYS A 123 9.854 -4.277 8.552 1.00 0.00 C ATOM 674 NZ LYS A 123 9.635 -5.449 7.663 1.00 0.00 N ATOM 0 H LYS A 123 9.544 -0.629 8.194 1.00 0.00 H new ATOM 0 HA LYS A 123 7.093 0.459 7.725 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.613 -1.614 6.522 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.290 -1.168 6.273 1.00 0.00 H new ATOM 0 HG2 LYS A 123 7.409 -3.225 8.331 1.00 0.00 H new ATOM 0 HG3 LYS A 123 7.837 -3.639 6.683 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.109 -2.832 6.986 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.714 -2.135 8.545 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.899 -4.247 8.860 1.00 0.00 H new ATOM 0 HE3 LYS A 123 9.258 -4.393 9.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 9.927 -6.317 8.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 8.627 -5.514 7.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 10.197 -5.337 6.795 1.00 0.00 H new ATOM 688 N ALA A 124 6.935 -1.753 10.153 1.00 0.00 N ATOM 689 CA ALA A 124 6.046 -2.318 11.156 1.00 0.00 C ATOM 690 C ALA A 124 5.473 -1.226 12.050 1.00 0.00 C ATOM 691 O ALA A 124 4.265 -1.178 12.297 1.00 0.00 O ATOM 692 CB ALA A 124 6.761 -3.373 11.984 1.00 0.00 C ATOM 0 H ALA A 124 7.914 -2.021 10.253 1.00 0.00 H new ATOM 0 HA ALA A 124 5.218 -2.801 10.637 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.074 -3.780 12.727 1.00 0.00 H new ATOM 0 HB2 ALA A 124 7.107 -4.175 11.332 1.00 0.00 H new ATOM 0 HB3 ALA A 124 7.616 -2.922 12.489 1.00 0.00 H new ATOM 698 N LYS A 125 6.344 -0.339 12.508 1.00 0.00 N ATOM 699 CA LYS A 125 5.946 0.788 13.320 1.00 0.00 C ATOM 700 C LYS A 125 5.074 1.737 12.510 1.00 0.00 C ATOM 701 O LYS A 125 4.060 2.245 12.994 1.00 0.00 O ATOM 702 CB LYS A 125 7.205 1.495 13.800 1.00 0.00 C ATOM 703 CG LYS A 125 6.955 2.707 14.666 1.00 0.00 C ATOM 704 CD LYS A 125 8.269 3.267 15.168 1.00 0.00 C ATOM 705 CE LYS A 125 9.116 3.839 14.039 1.00 0.00 C ATOM 706 NZ LYS A 125 8.424 4.932 13.306 1.00 0.00 N ATOM 0 H LYS A 125 7.346 -0.386 12.324 1.00 0.00 H new ATOM 0 HA LYS A 125 5.363 0.449 14.176 1.00 0.00 H new ATOM 0 HB2 LYS A 125 7.814 0.785 14.359 1.00 0.00 H new ATOM 0 HB3 LYS A 125 7.788 1.800 12.931 1.00 0.00 H new ATOM 0 HG2 LYS A 125 6.421 3.467 14.096 1.00 0.00 H new ATOM 0 HG3 LYS A 125 6.320 2.436 15.510 1.00 0.00 H new ATOM 0 HD2 LYS A 125 8.073 4.046 15.904 1.00 0.00 H new ATOM 0 HD3 LYS A 125 8.827 2.481 15.677 1.00 0.00 H new ATOM 0 HE2 LYS A 125 10.053 4.217 14.448 1.00 0.00 H new ATOM 0 HE3 LYS A 125 9.371 3.042 13.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 8.230 4.628 12.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 7.527 5.157 13.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 9.029 5.778 13.291 1.00 0.00 H new ATOM 720 N LEU A 126 5.477 1.953 11.264 1.00 0.00 N ATOM 721 CA LEU A 126 4.765 2.840 10.362 1.00 0.00 C ATOM 722 C LEU A 126 3.348 2.341 10.086 1.00 0.00 C ATOM 723 O LEU A 126 2.405 3.117 10.118 1.00 0.00 O ATOM 724 CB LEU A 126 5.543 2.986 9.053 1.00 0.00 C ATOM 725 CG LEU A 126 6.898 3.690 9.173 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.631 3.673 7.842 1.00 0.00 C ATOM 727 CD2 LEU A 126 6.737 5.116 9.673 1.00 0.00 C ATOM 0 H LEU A 126 6.304 1.518 10.854 1.00 0.00 H new ATOM 0 HA LEU A 126 4.682 3.815 10.842 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.704 1.993 8.632 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.927 3.538 8.343 1.00 0.00 H new ATOM 0 HG LEU A 126 7.493 3.143 9.905 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.591 4.178 7.949 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.796 2.642 7.531 1.00 0.00 H new ATOM 0 HD13 LEU A 126 7.032 4.187 7.090 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.717 5.588 9.747 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.115 5.678 8.976 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.264 5.106 10.655 1.00 0.00 H new ATOM 739 N MET A 127 3.194 1.043 9.848 1.00 0.00 N ATOM 740 CA MET A 127 1.883 0.472 9.540 1.00 0.00 C ATOM 741 C MET A 127 0.874 0.790 10.636 1.00 0.00 C ATOM 742 O MET A 127 -0.306 0.996 10.367 1.00 0.00 O ATOM 743 CB MET A 127 1.984 -1.041 9.355 1.00 0.00 C ATOM 744 CG MET A 127 2.603 -1.466 8.031 1.00 0.00 C ATOM 745 SD MET A 127 1.383 -2.078 6.849 1.00 0.00 S ATOM 746 CE MET A 127 0.404 -0.610 6.539 1.00 0.00 C ATOM 0 H MET A 127 3.957 0.366 9.862 1.00 0.00 H new ATOM 0 HA MET A 127 1.538 0.922 8.609 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.576 -1.457 10.170 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.986 -1.473 9.432 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.131 -0.619 7.594 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.345 -2.243 8.215 1.00 0.00 H new ATOM 0 HE1 MET A 127 -0.342 -0.825 5.774 1.00 0.00 H new ATOM 0 HE2 MET A 127 -0.097 -0.306 7.458 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.054 0.195 6.196 1.00 0.00 H new ATOM 756 N ARG A 128 1.349 0.831 11.870 1.00 0.00 N ATOM 757 CA ARG A 128 0.510 1.187 13.005 1.00 0.00 C ATOM 758 C ARG A 128 0.279 2.687 13.062 1.00 0.00 C ATOM 759 O ARG A 128 -0.849 3.146 13.241 1.00 0.00 O ATOM 760 CB ARG A 128 1.168 0.718 14.296 1.00 0.00 C ATOM 761 CG ARG A 128 1.144 -0.788 14.471 1.00 0.00 C ATOM 762 CD ARG A 128 -0.279 -1.288 14.670 1.00 0.00 C ATOM 763 NE ARG A 128 -0.947 -0.592 15.770 1.00 0.00 N ATOM 764 CZ ARG A 128 -2.252 -0.314 15.802 1.00 0.00 C ATOM 765 NH1 ARG A 128 -3.045 -0.702 14.811 1.00 0.00 N ATOM 766 NH2 ARG A 128 -2.765 0.346 16.832 1.00 0.00 N ATOM 0 H ARG A 128 2.317 0.621 12.113 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.456 0.696 12.886 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.202 1.062 14.314 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.663 1.183 15.143 1.00 0.00 H new ATOM 0 HG2 ARG A 128 1.583 -1.267 13.596 1.00 0.00 H new ATOM 0 HG3 ARG A 128 1.756 -1.068 15.328 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -0.847 -1.146 13.751 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -0.264 -2.359 14.873 1.00 0.00 H new ATOM 0 HE ARG A 128 -0.378 -0.300 16.565 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -2.658 -1.216 14.019 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -4.042 -0.487 14.841 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -2.162 0.641 17.600 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -3.762 0.558 16.856 1.00 0.00 H new ATOM 780 N ALA A 129 1.356 3.439 12.894 1.00 0.00 N ATOM 781 CA ALA A 129 1.302 4.891 12.955 1.00 0.00 C ATOM 782 C ALA A 129 0.384 5.459 11.881 1.00 0.00 C ATOM 783 O ALA A 129 -0.368 6.401 12.125 1.00 0.00 O ATOM 784 CB ALA A 129 2.698 5.464 12.802 1.00 0.00 C ATOM 0 H ALA A 129 2.287 3.063 12.713 1.00 0.00 H new ATOM 0 HA ALA A 129 0.896 5.175 13.926 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.652 6.552 12.848 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.334 5.093 13.606 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.113 5.159 11.841 1.00 0.00 H new ATOM 790 N TYR A 130 0.428 4.854 10.704 1.00 0.00 N ATOM 791 CA TYR A 130 -0.313 5.359 9.554 1.00 0.00 C ATOM 792 C TYR A 130 -1.806 5.110 9.719 1.00 0.00 C ATOM 793 O TYR A 130 -2.631 5.793 9.117 1.00 0.00 O ATOM 794 CB TYR A 130 0.185 4.706 8.260 1.00 0.00 C ATOM 795 CG TYR A 130 1.589 5.110 7.847 1.00 0.00 C ATOM 796 CD1 TYR A 130 2.008 4.955 6.534 1.00 0.00 C ATOM 797 CD2 TYR A 130 2.495 5.631 8.762 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.281 5.308 6.148 1.00 0.00 C ATOM 799 CE2 TYR A 130 3.769 5.984 8.383 1.00 0.00 C ATOM 800 CZ TYR A 130 4.159 5.819 7.076 1.00 0.00 C ATOM 801 OH TYR A 130 5.431 6.171 6.694 1.00 0.00 O ATOM 0 H TYR A 130 0.970 4.010 10.518 1.00 0.00 H new ATOM 0 HA TYR A 130 -0.144 6.434 9.494 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.153 3.623 8.380 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.503 4.958 7.453 1.00 0.00 H new ATOM 0 HD1 TYR A 130 1.324 4.551 5.802 1.00 0.00 H new ATOM 0 HD2 TYR A 130 2.193 5.761 9.791 1.00 0.00 H new ATOM 0 HE1 TYR A 130 3.590 5.184 5.120 1.00 0.00 H new ATOM 0 HE2 TYR A 130 4.459 6.389 9.109 1.00 0.00 H new ATOM 0 HH TYR A 130 5.629 7.077 7.012 1.00 0.00 H new ATOM 811 N MET A 131 -2.153 4.143 10.562 1.00 0.00 N ATOM 812 CA MET A 131 -3.550 3.796 10.790 1.00 0.00 C ATOM 813 C MET A 131 -4.211 4.779 11.748 1.00 0.00 C ATOM 814 O MET A 131 -5.398 4.662 12.052 1.00 0.00 O ATOM 815 CB MET A 131 -3.679 2.369 11.326 1.00 0.00 C ATOM 816 CG MET A 131 -3.363 1.284 10.303 1.00 0.00 C ATOM 817 SD MET A 131 -4.775 0.821 9.265 1.00 0.00 S ATOM 818 CE MET A 131 -4.959 2.255 8.203 1.00 0.00 C ATOM 0 H MET A 131 -1.487 3.587 11.098 1.00 0.00 H new ATOM 0 HA MET A 131 -4.064 3.854 9.830 1.00 0.00 H new ATOM 0 HB2 MET A 131 -3.012 2.252 12.180 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.695 2.222 11.693 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.551 1.628 9.662 1.00 0.00 H new ATOM 0 HG3 MET A 131 -3.003 0.398 10.827 1.00 0.00 H new ATOM 0 HE1 MET A 131 -5.315 1.938 7.223 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.678 2.945 8.645 1.00 0.00 H new ATOM 0 HE3 MET A 131 -3.996 2.754 8.095 1.00 0.00 H new ATOM 828 N GLN A 132 -3.445 5.744 12.230 1.00 0.00 N ATOM 829 CA GLN A 132 -4.005 6.791 13.066 1.00 0.00 C ATOM 830 C GLN A 132 -4.264 8.036 12.223 1.00 0.00 C ATOM 831 O GLN A 132 -5.062 8.898 12.589 1.00 0.00 O ATOM 832 CB GLN A 132 -3.063 7.128 14.227 1.00 0.00 C ATOM 833 CG GLN A 132 -2.110 8.276 13.935 1.00 0.00 C ATOM 834 CD GLN A 132 -1.168 8.558 15.080 1.00 0.00 C ATOM 835 OE1 GLN A 132 -1.489 9.320 15.992 1.00 0.00 O ATOM 836 NE2 GLN A 132 0.014 7.969 15.027 1.00 0.00 N ATOM 0 H GLN A 132 -2.443 5.824 12.058 1.00 0.00 H new ATOM 0 HA GLN A 132 -4.946 6.434 13.486 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.659 7.378 15.105 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.481 6.241 14.479 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.530 8.043 13.042 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.687 9.174 13.715 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.238 7.344 14.252 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.702 8.139 15.761 1.00 0.00 H new ATOM 845 N GLU A 133 -3.592 8.107 11.081 1.00 0.00 N ATOM 846 CA GLU A 133 -3.661 9.278 10.228 1.00 0.00 C ATOM 847 C GLU A 133 -4.828 9.143 9.265 1.00 0.00 C ATOM 848 O GLU A 133 -4.879 8.201 8.471 1.00 0.00 O ATOM 849 CB GLU A 133 -2.355 9.450 9.452 1.00 0.00 C ATOM 850 CG GLU A 133 -1.127 9.097 10.273 1.00 0.00 C ATOM 851 CD GLU A 133 0.163 9.620 9.679 1.00 0.00 C ATOM 852 OE1 GLU A 133 0.131 10.683 9.019 1.00 0.00 O ATOM 853 OE2 GLU A 133 1.220 8.995 9.897 1.00 0.00 O ATOM 0 H GLU A 133 -2.992 7.362 10.726 1.00 0.00 H new ATOM 0 HA GLU A 133 -3.811 10.160 10.851 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.383 8.822 8.561 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.274 10.482 9.112 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.244 9.499 11.280 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -1.062 8.013 10.368 1.00 0.00 H new ATOM 860 N PRO A 134 -5.772 10.092 9.314 1.00 0.00 N ATOM 861 CA PRO A 134 -6.999 10.035 8.515 1.00 0.00 C ATOM 862 C PRO A 134 -6.725 10.057 7.014 1.00 0.00 C ATOM 863 O PRO A 134 -7.606 9.749 6.216 1.00 0.00 O ATOM 864 CB PRO A 134 -7.780 11.280 8.945 1.00 0.00 C ATOM 865 CG PRO A 134 -6.761 12.190 9.539 1.00 0.00 C ATOM 866 CD PRO A 134 -5.718 11.302 10.152 1.00 0.00 C ATOM 0 HA PRO A 134 -7.543 9.106 8.684 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.278 11.747 8.095 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.555 11.029 9.669 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.324 12.836 8.778 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -7.210 12.840 10.290 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -4.731 11.764 10.129 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -5.941 11.080 11.195 1.00 0.00 H new ATOM 874 N LEU A 135 -5.504 10.409 6.632 1.00 0.00 N ATOM 875 CA LEU A 135 -5.128 10.386 5.229 1.00 0.00 C ATOM 876 C LEU A 135 -4.854 8.959 4.771 1.00 0.00 C ATOM 877 O LEU A 135 -5.262 8.561 3.685 1.00 0.00 O ATOM 878 CB LEU A 135 -3.899 11.262 4.950 1.00 0.00 C ATOM 879 CG LEU A 135 -4.120 12.769 5.084 1.00 0.00 C ATOM 880 CD1 LEU A 135 -3.812 13.243 6.495 1.00 0.00 C ATOM 881 CD2 LEU A 135 -3.290 13.521 4.055 1.00 0.00 C ATOM 0 H LEU A 135 -4.766 10.710 7.268 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.968 10.793 4.666 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -3.102 10.967 5.633 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.547 11.053 3.940 1.00 0.00 H new ATOM 0 HG LEU A 135 -5.172 12.980 4.891 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.978 14.318 6.562 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.465 12.731 7.202 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -2.772 13.020 6.735 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -3.459 14.592 4.164 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -2.233 13.303 4.210 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -3.582 13.208 3.053 1.00 0.00 H new ATOM 893 N PHE A 136 -4.200 8.171 5.614 1.00 0.00 N ATOM 894 CA PHE A 136 -3.752 6.858 5.188 1.00 0.00 C ATOM 895 C PHE A 136 -4.839 5.830 5.440 1.00 0.00 C ATOM 896 O PHE A 136 -4.968 4.852 4.708 1.00 0.00 O ATOM 897 CB PHE A 136 -2.466 6.466 5.909 1.00 0.00 C ATOM 898 CG PHE A 136 -1.747 5.316 5.263 1.00 0.00 C ATOM 899 CD1 PHE A 136 -1.970 4.015 5.683 1.00 0.00 C ATOM 900 CD2 PHE A 136 -0.846 5.540 4.236 1.00 0.00 C ATOM 901 CE1 PHE A 136 -1.307 2.958 5.091 1.00 0.00 C ATOM 902 CE2 PHE A 136 -0.180 4.488 3.637 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.410 3.196 4.067 1.00 0.00 C ATOM 0 H PHE A 136 -3.973 8.414 6.578 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.543 6.892 4.119 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -1.800 7.328 5.943 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -2.702 6.204 6.941 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -2.671 3.825 6.483 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -0.661 6.549 3.899 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -1.489 1.948 5.427 1.00 0.00 H new ATOM 0 HE2 PHE A 136 0.518 4.676 2.835 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.111 2.372 3.603 1.00 0.00 H new ATOM 913 N VAL A 137 -5.627 6.067 6.478 1.00 0.00 N ATOM 914 CA VAL A 137 -6.748 5.199 6.802 1.00 0.00 C ATOM 915 C VAL A 137 -7.732 5.110 5.640 1.00 0.00 C ATOM 916 O VAL A 137 -8.141 4.022 5.240 1.00 0.00 O ATOM 917 CB VAL A 137 -7.496 5.695 8.048 1.00 0.00 C ATOM 918 CG1 VAL A 137 -6.662 5.530 9.302 1.00 0.00 C ATOM 919 CG2 VAL A 137 -7.918 7.120 7.880 1.00 0.00 C ATOM 0 H VAL A 137 -5.510 6.857 7.113 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.333 4.211 7.001 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.389 5.080 8.161 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.224 5.892 10.163 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.421 4.476 9.443 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.740 6.103 9.204 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.446 7.451 8.774 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.038 7.744 7.726 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.578 7.205 7.017 1.00 0.00 H new ATOM 929 N GLU A 138 -8.109 6.264 5.109 1.00 0.00 N ATOM 930 CA GLU A 138 -9.034 6.323 3.990 1.00 0.00 C ATOM 931 C GLU A 138 -8.366 5.824 2.718 1.00 0.00 C ATOM 932 O GLU A 138 -9.002 5.161 1.909 1.00 0.00 O ATOM 933 CB GLU A 138 -9.583 7.739 3.791 1.00 0.00 C ATOM 934 CG GLU A 138 -8.537 8.779 3.429 1.00 0.00 C ATOM 935 CD GLU A 138 -9.153 10.125 3.116 1.00 0.00 C ATOM 936 OE1 GLU A 138 -9.355 10.926 4.051 1.00 0.00 O ATOM 937 OE2 GLU A 138 -9.444 10.388 1.932 1.00 0.00 O ATOM 0 H GLU A 138 -7.786 7.174 5.437 1.00 0.00 H new ATOM 0 HA GLU A 138 -9.876 5.671 4.220 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -10.338 7.714 3.006 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -10.085 8.052 4.707 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -7.833 8.887 4.254 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -7.967 8.433 2.567 1.00 0.00 H new ATOM 944 N PHE A 139 -7.078 6.127 2.554 1.00 0.00 N ATOM 945 CA PHE A 139 -6.317 5.604 1.430 1.00 0.00 C ATOM 946 C PHE A 139 -6.395 4.089 1.435 1.00 0.00 C ATOM 947 O PHE A 139 -6.702 3.460 0.420 1.00 0.00 O ATOM 948 CB PHE A 139 -4.859 6.067 1.512 1.00 0.00 C ATOM 949 CG PHE A 139 -3.927 5.313 0.605 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.881 5.587 -0.751 1.00 0.00 C ATOM 951 CD2 PHE A 139 -3.097 4.326 1.113 1.00 0.00 C ATOM 952 CE1 PHE A 139 -3.027 4.890 -1.584 1.00 0.00 C ATOM 953 CE2 PHE A 139 -2.241 3.626 0.287 1.00 0.00 C ATOM 954 CZ PHE A 139 -2.206 3.908 -1.064 1.00 0.00 C ATOM 0 H PHE A 139 -6.547 6.728 3.183 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.740 5.982 0.499 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.811 7.128 1.265 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.513 5.963 2.540 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.520 6.354 -1.163 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -3.120 4.102 2.169 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -3.001 5.113 -2.641 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.600 2.859 0.697 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.538 3.362 -1.713 1.00 0.00 H new ATOM 964 N ALA A 140 -6.152 3.520 2.604 1.00 0.00 N ATOM 965 CA ALA A 140 -6.226 2.089 2.793 1.00 0.00 C ATOM 966 C ALA A 140 -7.635 1.585 2.535 1.00 0.00 C ATOM 967 O ALA A 140 -7.831 0.658 1.753 1.00 0.00 O ATOM 968 CB ALA A 140 -5.776 1.721 4.199 1.00 0.00 C ATOM 0 H ALA A 140 -5.899 4.040 3.444 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.558 1.611 2.076 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.836 0.640 4.329 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.747 2.048 4.349 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.422 2.211 4.928 1.00 0.00 H new ATOM 974 N ASP A 141 -8.618 2.231 3.153 1.00 0.00 N ATOM 975 CA ASP A 141 -10.003 1.776 3.063 1.00 0.00 C ATOM 976 C ASP A 141 -10.490 1.820 1.619 1.00 0.00 C ATOM 977 O ASP A 141 -11.311 1.004 1.197 1.00 0.00 O ATOM 978 CB ASP A 141 -10.902 2.636 3.952 1.00 0.00 C ATOM 979 CG ASP A 141 -12.341 2.162 3.954 1.00 0.00 C ATOM 980 OD1 ASP A 141 -13.171 2.764 3.240 1.00 0.00 O ATOM 981 OD2 ASP A 141 -12.651 1.187 4.674 1.00 0.00 O ATOM 0 H ASP A 141 -8.484 3.068 3.720 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.050 0.744 3.411 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.518 2.624 4.972 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.864 3.670 3.609 1.00 0.00 H new ATOM 986 N CYS A 142 -9.951 2.761 0.863 1.00 0.00 N ATOM 987 CA CYS A 142 -10.328 2.938 -0.527 1.00 0.00 C ATOM 988 C CYS A 142 -9.675 1.888 -1.423 1.00 0.00 C ATOM 989 O CYS A 142 -10.343 1.285 -2.265 1.00 0.00 O ATOM 990 CB CYS A 142 -9.951 4.344 -0.993 1.00 0.00 C ATOM 991 SG CYS A 142 -11.014 5.649 -0.327 1.00 0.00 S ATOM 0 H CYS A 142 -9.245 3.419 1.193 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.408 2.811 -0.604 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -8.920 4.547 -0.705 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -9.990 4.378 -2.082 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.611 5.970 0.866 1.00 0.00 H new ATOM 997 N CYS A 143 -8.380 1.641 -1.231 1.00 0.00 N ATOM 998 CA CYS A 143 -7.666 0.695 -2.078 1.00 0.00 C ATOM 999 C CYS A 143 -8.140 -0.727 -1.808 1.00 0.00 C ATOM 1000 O CYS A 143 -8.122 -1.578 -2.697 1.00 0.00 O ATOM 1001 CB CYS A 143 -6.150 0.808 -1.874 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.592 0.484 -0.188 1.00 0.00 S ATOM 0 H CYS A 143 -7.812 2.078 -0.505 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.884 0.940 -3.117 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.653 0.110 -2.548 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.832 1.810 -2.162 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.622 0.383 0.598 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.602 -0.970 -0.582 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.123 -2.279 -0.205 1.00 0.00 C ATOM 1010 C LEU A 144 -10.342 -2.634 -1.043 1.00 0.00 C ATOM 1011 O LEU A 144 -10.576 -3.801 -1.343 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.494 -2.310 1.281 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.329 -2.095 2.245 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.798 -2.189 3.685 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -7.224 -3.097 1.976 1.00 0.00 C ATOM 0 H LEU A 144 -8.625 -0.276 0.165 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.339 -3.014 -0.388 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.246 -1.543 1.468 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.957 -3.271 1.504 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.931 -1.093 2.082 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.952 -2.033 4.354 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.554 -1.426 3.872 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.225 -3.175 3.865 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.403 -2.928 2.672 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.610 -4.108 2.108 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.864 -2.976 0.954 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.099 -1.618 -1.439 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.298 -1.846 -2.220 1.00 0.00 C ATOM 1029 C GLY A 145 -11.998 -2.082 -3.683 1.00 0.00 C ATOM 1030 O GLY A 145 -12.833 -2.597 -4.423 1.00 0.00 O ATOM 0 H GLY A 145 -10.903 -0.639 -1.232 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.832 -2.707 -1.818 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -12.961 -0.986 -2.122 1.00 0.00 H new ATOM 1034 N ILE A 146 -10.804 -1.699 -4.101 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.398 -1.852 -5.487 1.00 0.00 C ATOM 1036 C ILE A 146 -9.703 -3.194 -5.697 1.00 0.00 C ATOM 1037 O ILE A 146 -9.713 -3.751 -6.796 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.456 -0.706 -5.909 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -10.090 0.645 -5.570 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.143 -0.788 -7.400 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -9.143 1.817 -5.711 1.00 0.00 C ATOM 0 H ILE A 146 -10.097 -1.279 -3.498 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.295 -1.816 -6.106 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.520 -0.804 -5.359 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -10.951 0.805 -6.220 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.464 0.614 -4.547 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.477 0.029 -7.677 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.659 -1.740 -7.618 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -10.068 -0.712 -7.971 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.664 2.739 -5.454 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -8.294 1.681 -5.041 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -8.788 1.876 -6.740 1.00 0.00 H new ATOM 1053 N VAL A 147 -9.107 -3.722 -4.633 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.363 -4.968 -4.733 1.00 0.00 C ATOM 1055 C VAL A 147 -9.145 -6.137 -4.146 1.00 0.00 C ATOM 1056 O VAL A 147 -8.688 -7.279 -4.205 1.00 0.00 O ATOM 1057 CB VAL A 147 -6.992 -4.885 -4.028 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -6.180 -3.716 -4.560 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -7.160 -4.785 -2.520 1.00 0.00 C ATOM 0 H VAL A 147 -9.125 -3.309 -3.700 1.00 0.00 H new ATOM 0 HA VAL A 147 -8.203 -5.136 -5.798 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.447 -5.803 -4.245 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -5.218 -3.678 -4.048 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.017 -3.843 -5.630 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.722 -2.787 -4.384 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.179 -4.728 -2.048 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.733 -3.890 -2.276 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.688 -5.665 -2.154 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.315 -5.857 -3.583 1.00 0.00 N ATOM 1070 CA GLU A 148 -11.116 -6.905 -2.974 1.00 0.00 C ATOM 1071 C GLU A 148 -11.718 -7.806 -4.048 1.00 0.00 C ATOM 1072 O GLU A 148 -12.380 -7.340 -4.975 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.217 -6.333 -2.059 1.00 0.00 C ATOM 1074 CG GLU A 148 -13.247 -5.453 -2.757 1.00 0.00 C ATOM 1075 CD GLU A 148 -14.383 -5.051 -1.832 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -15.220 -5.919 -1.503 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -14.453 -3.865 -1.428 1.00 0.00 O ATOM 0 H GLU A 148 -10.724 -4.924 -3.537 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.454 -7.501 -2.345 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -12.736 -7.163 -1.580 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -11.744 -5.753 -1.267 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -12.757 -4.557 -3.138 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -13.653 -5.985 -3.617 1.00 0.00 H new ATOM 1197 N ILE B 463 -7.465 -7.059 9.879 1.00 0.00 N ATOM 1198 CA ILE B 463 -6.573 -5.910 9.757 1.00 0.00 C ATOM 1199 C ILE B 463 -5.155 -6.323 9.365 1.00 0.00 C ATOM 1200 O ILE B 463 -4.518 -5.654 8.555 1.00 0.00 O ATOM 1201 CB ILE B 463 -6.521 -5.095 11.068 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -7.929 -4.662 11.493 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -5.621 -3.879 10.909 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -8.636 -3.783 10.481 1.00 0.00 C ATOM 0 HA ILE B 463 -6.985 -5.287 8.963 1.00 0.00 H new ATOM 0 HB ILE B 463 -6.106 -5.734 11.847 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -8.533 -5.552 11.671 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -7.863 -4.127 12.440 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -5.598 -3.319 11.844 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -4.612 -4.204 10.656 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -6.007 -3.242 10.113 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -9.625 -3.520 10.856 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -8.056 -2.875 10.320 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -8.736 -4.321 9.539 1.00 0.00 H new ATOM 1216 N ARG B 464 -4.663 -7.419 9.933 1.00 0.00 N ATOM 1217 CA ARG B 464 -3.326 -7.910 9.601 1.00 0.00 C ATOM 1218 C ARG B 464 -3.212 -8.201 8.109 1.00 0.00 C ATOM 1219 O ARG B 464 -2.221 -7.845 7.469 1.00 0.00 O ATOM 1220 CB ARG B 464 -2.986 -9.163 10.407 1.00 0.00 C ATOM 1221 CG ARG B 464 -2.725 -8.893 11.877 1.00 0.00 C ATOM 1222 CD ARG B 464 -2.336 -10.165 12.608 1.00 0.00 C ATOM 1223 NE ARG B 464 -2.031 -9.921 14.015 1.00 0.00 N ATOM 1224 CZ ARG B 464 -1.870 -10.885 14.919 1.00 0.00 C ATOM 1225 NH1 ARG B 464 -1.949 -12.160 14.556 1.00 0.00 N ATOM 1226 NH2 ARG B 464 -1.610 -10.576 16.183 1.00 0.00 N ATOM 0 H ARG B 464 -5.164 -7.982 10.621 1.00 0.00 H new ATOM 0 HA ARG B 464 -2.612 -7.129 9.861 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -3.807 -9.875 10.318 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -2.105 -9.636 9.972 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -1.930 -8.155 11.978 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -3.617 -8.466 12.335 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -3.149 -10.888 12.534 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -1.468 -10.611 12.122 1.00 0.00 H new ATOM 0 HE ARG B 464 -1.936 -8.954 14.324 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -2.133 -12.403 13.583 1.00 0.00 H new ATOM 0 HH12 ARG B 464 -1.825 -12.897 15.251 1.00 0.00 H new ATOM 0 HH21 ARG B 464 -1.533 -9.598 16.464 1.00 0.00 H new ATOM 0 HH22 ARG B 464 -1.487 -11.316 16.874 1.00 0.00 H new ATOM 1240 N HIS B 465 -4.241 -8.832 7.559 1.00 0.00 N ATOM 1241 CA HIS B 465 -4.306 -9.091 6.129 1.00 0.00 C ATOM 1242 C HIS B 465 -4.373 -7.776 5.362 1.00 0.00 C ATOM 1243 O HIS B 465 -3.626 -7.560 4.410 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.525 -9.965 5.799 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.902 -9.953 4.350 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -5.242 -10.681 3.388 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.864 -9.260 3.700 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -5.780 -10.435 2.209 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -6.769 -9.577 2.370 1.00 0.00 N ATOM 0 H HIS B 465 -5.045 -9.175 8.085 1.00 0.00 H new ATOM 0 HA HIS B 465 -3.406 -9.627 5.828 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -5.318 -10.991 6.102 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -6.376 -9.624 6.389 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -7.576 -8.582 4.147 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -5.464 -10.864 1.270 1.00 0.00 H new ATOM 0 HE2 HIS B 465 -7.364 -9.210 1.628 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.272 -6.906 5.798 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.508 -5.634 5.132 1.00 0.00 C ATOM 1260 C GLU B 466 -4.245 -4.774 5.106 1.00 0.00 C ATOM 1261 O GLU B 466 -3.905 -4.200 4.077 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.657 -4.897 5.822 1.00 0.00 C ATOM 1263 CG GLU B 466 -7.979 -5.644 5.727 1.00 0.00 C ATOM 1264 CD GLU B 466 -9.060 -5.064 6.617 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -9.578 -5.798 7.484 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -9.403 -3.876 6.450 1.00 0.00 O ATOM 0 H GLU B 466 -5.856 -7.061 6.620 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.784 -5.832 4.096 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -6.406 -4.744 6.872 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -6.770 -3.910 5.374 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -8.323 -5.630 4.693 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -7.819 -6.688 5.995 1.00 0.00 H new ATOM 1273 N ARG B 467 -3.540 -4.718 6.232 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.304 -3.941 6.340 1.00 0.00 C ATOM 1275 C ARG B 467 -1.256 -4.397 5.331 1.00 0.00 C ATOM 1276 O ARG B 467 -0.573 -3.576 4.725 1.00 0.00 O ATOM 1277 CB ARG B 467 -1.734 -4.033 7.756 1.00 0.00 C ATOM 1278 CG ARG B 467 -2.297 -2.989 8.707 1.00 0.00 C ATOM 1279 CD ARG B 467 -1.877 -3.248 10.146 1.00 0.00 C ATOM 1280 NE ARG B 467 -0.428 -3.422 10.294 1.00 0.00 N ATOM 1281 CZ ARG B 467 0.169 -3.737 11.447 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -0.552 -3.919 12.545 1.00 0.00 N ATOM 1283 NH2 ARG B 467 1.487 -3.884 11.499 1.00 0.00 N ATOM 0 H ARG B 467 -3.804 -5.204 7.089 1.00 0.00 H new ATOM 0 HA ARG B 467 -2.556 -2.904 6.118 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -1.938 -5.026 8.157 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -0.650 -3.924 7.710 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -1.957 -1.999 8.402 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -3.385 -2.987 8.641 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -2.204 -2.416 10.770 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -2.385 -4.140 10.513 1.00 0.00 H new ATOM 0 HE ARG B 467 0.158 -3.295 9.469 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -1.566 -3.819 12.511 1.00 0.00 H new ATOM 0 HH12 ARG B 467 -0.092 -4.159 13.423 1.00 0.00 H new ATOM 0 HH21 ARG B 467 2.048 -3.756 10.657 1.00 0.00 H new ATOM 0 HH22 ARG B 467 1.939 -4.124 12.381 1.00 0.00 H new ATOM 1297 N ASN B 468 -1.149 -5.702 5.127 1.00 0.00 N ATOM 1298 CA ASN B 468 -0.151 -6.238 4.214 1.00 0.00 C ATOM 1299 C ASN B 468 -0.604 -5.997 2.783 1.00 0.00 C ATOM 1300 O ASN B 468 0.206 -5.806 1.880 1.00 0.00 O ATOM 1301 CB ASN B 468 0.084 -7.732 4.477 1.00 0.00 C ATOM 1302 CG ASN B 468 -0.281 -8.612 3.295 1.00 0.00 C ATOM 1303 OD1 ASN B 468 0.547 -8.879 2.421 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -1.523 -9.063 3.258 1.00 0.00 N ATOM 0 H ASN B 468 -1.736 -6.404 5.577 1.00 0.00 H new ATOM 0 HA ASN B 468 0.798 -5.728 4.377 1.00 0.00 H new ATOM 0 HB2 ASN B 468 1.133 -7.889 4.729 1.00 0.00 H new ATOM 0 HB3 ASN B 468 -0.501 -8.038 5.344 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -1.828 -9.656 2.486 1.00 0.00 H new ATOM 0 HD22 ASN B 468 -2.177 -8.818 4.002 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.916 -5.993 2.604 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.529 -5.699 1.324 1.00 0.00 C ATOM 1313 C VAL B 469 -2.194 -4.273 0.882 1.00 0.00 C ATOM 1314 O VAL B 469 -1.987 -4.009 -0.307 1.00 0.00 O ATOM 1315 CB VAL B 469 -4.061 -5.903 1.406 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.799 -5.031 0.409 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -4.406 -7.365 1.189 1.00 0.00 C ATOM 0 H VAL B 469 -2.585 -6.195 3.347 1.00 0.00 H new ATOM 0 HA VAL B 469 -2.128 -6.387 0.579 1.00 0.00 H new ATOM 0 HB VAL B 469 -4.383 -5.603 2.403 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.871 -5.204 0.498 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.582 -3.982 0.612 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -4.475 -5.279 -0.602 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -5.486 -7.497 1.249 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -4.056 -7.679 0.206 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.924 -7.970 1.956 1.00 0.00 H new ATOM 1327 N ILE B 470 -2.114 -3.368 1.850 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.781 -1.979 1.571 1.00 0.00 C ATOM 1329 C ILE B 470 -0.373 -1.873 0.993 1.00 0.00 C ATOM 1330 O ILE B 470 -0.112 -1.039 0.128 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.872 -1.100 2.839 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -3.201 -1.323 3.563 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.717 0.366 2.476 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.417 -1.080 2.697 1.00 0.00 C ATOM 0 H ILE B 470 -2.276 -3.573 2.836 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.509 -1.617 0.845 1.00 0.00 H new ATOM 0 HB ILE B 470 -1.062 -1.387 3.510 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -3.232 -2.346 3.938 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -3.247 -0.664 4.430 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -1.783 0.973 3.379 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.748 0.523 2.003 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.509 0.655 1.785 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.320 -1.258 3.280 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.411 -0.049 2.343 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.397 -1.757 1.843 1.00 0.00 H new ATOM 1346 N LEU B 471 0.521 -2.740 1.463 1.00 0.00 N ATOM 1347 CA LEU B 471 1.903 -2.758 0.990 1.00 0.00 C ATOM 1348 C LEU B 471 1.953 -2.963 -0.522 1.00 0.00 C ATOM 1349 O LEU B 471 2.718 -2.302 -1.223 1.00 0.00 O ATOM 1350 CB LEU B 471 2.695 -3.865 1.693 1.00 0.00 C ATOM 1351 CG LEU B 471 2.726 -3.777 3.221 1.00 0.00 C ATOM 1352 CD1 LEU B 471 3.462 -4.970 3.806 1.00 0.00 C ATOM 1353 CD2 LEU B 471 3.376 -2.478 3.671 1.00 0.00 C ATOM 0 H LEU B 471 0.312 -3.441 2.173 1.00 0.00 H new ATOM 0 HA LEU B 471 2.355 -1.795 1.227 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.271 -4.828 1.409 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.720 -3.846 1.323 1.00 0.00 H new ATOM 0 HG LEU B 471 1.699 -3.790 3.586 1.00 0.00 H new ATOM 0 HD11 LEU B 471 3.475 -4.892 4.893 1.00 0.00 H new ATOM 0 HD12 LEU B 471 2.955 -5.889 3.514 1.00 0.00 H new ATOM 0 HD13 LEU B 471 4.485 -4.986 3.431 1.00 0.00 H new ATOM 0 HD21 LEU B 471 3.388 -2.435 4.760 1.00 0.00 H new ATOM 0 HD22 LEU B 471 4.398 -2.433 3.295 1.00 0.00 H new ATOM 0 HD23 LEU B 471 2.809 -1.633 3.281 1.00 0.00 H new ATOM 1365 N GLN B 472 1.119 -3.874 -1.016 1.00 0.00 N ATOM 1366 CA GLN B 472 1.023 -4.128 -2.449 1.00 0.00 C ATOM 1367 C GLN B 472 0.535 -2.882 -3.179 1.00 0.00 C ATOM 1368 O GLN B 472 1.064 -2.517 -4.226 1.00 0.00 O ATOM 1369 CB GLN B 472 0.078 -5.297 -2.739 1.00 0.00 C ATOM 1370 CG GLN B 472 0.690 -6.677 -2.531 1.00 0.00 C ATOM 1371 CD GLN B 472 1.042 -6.965 -1.086 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.162 -6.720 -0.641 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.080 -7.480 -0.341 1.00 0.00 N ATOM 0 H GLN B 472 0.500 -4.449 -0.444 1.00 0.00 H new ATOM 0 HA GLN B 472 2.019 -4.388 -2.808 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -0.800 -5.204 -2.100 1.00 0.00 H new ATOM 0 HB3 GLN B 472 -0.268 -5.220 -3.770 1.00 0.00 H new ATOM 0 HG2 GLN B 472 -0.010 -7.434 -2.885 1.00 0.00 H new ATOM 0 HG3 GLN B 472 1.589 -6.764 -3.141 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.836 -7.668 -0.749 1.00 0.00 H new ATOM 0 HE22 GLN B 472 0.253 -7.689 0.642 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.465 -2.230 -2.600 1.00 0.00 N ATOM 1383 CA CYS B 473 -1.060 -1.039 -3.191 1.00 0.00 C ATOM 1384 C CYS B 473 -0.038 0.094 -3.271 1.00 0.00 C ATOM 1385 O CYS B 473 0.219 0.642 -4.345 1.00 0.00 O ATOM 1386 CB CYS B 473 -2.270 -0.607 -2.360 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.489 -1.922 -2.106 1.00 0.00 S ATOM 0 H CYS B 473 -0.884 -2.510 -1.713 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.384 -1.272 -4.205 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.924 -0.252 -1.389 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.755 0.235 -2.853 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.971 -2.857 -1.366 1.00 0.00 H new ATOM 1393 N VAL B 474 0.541 0.425 -2.122 1.00 0.00 N ATOM 1394 CA VAL B 474 1.562 1.453 -2.014 1.00 0.00 C ATOM 1395 C VAL B 474 2.690 1.243 -3.023 1.00 0.00 C ATOM 1396 O VAL B 474 2.974 2.125 -3.837 1.00 0.00 O ATOM 1397 CB VAL B 474 2.150 1.475 -0.584 1.00 0.00 C ATOM 1398 CG1 VAL B 474 3.317 2.437 -0.479 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.074 1.838 0.427 1.00 0.00 C ATOM 0 H VAL B 474 0.311 -0.019 -1.233 1.00 0.00 H new ATOM 0 HA VAL B 474 1.084 2.408 -2.232 1.00 0.00 H new ATOM 0 HB VAL B 474 2.521 0.474 -0.362 1.00 0.00 H new ATOM 0 HG11 VAL B 474 3.706 2.427 0.539 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.103 2.133 -1.171 1.00 0.00 H new ATOM 0 HG13 VAL B 474 2.983 3.444 -0.730 1.00 0.00 H new ATOM 0 HG21 VAL B 474 1.504 1.849 1.428 1.00 0.00 H new ATOM 0 HG22 VAL B 474 0.673 2.824 0.193 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.272 1.101 0.385 1.00 0.00 H new ATOM 1409 N ARG B 475 3.305 0.066 -2.994 1.00 0.00 N ATOM 1410 CA ARG B 475 4.492 -0.185 -3.801 1.00 0.00 C ATOM 1411 C ARG B 475 4.160 -0.229 -5.288 1.00 0.00 C ATOM 1412 O ARG B 475 4.976 0.174 -6.115 1.00 0.00 O ATOM 1413 CB ARG B 475 5.188 -1.474 -3.367 1.00 0.00 C ATOM 1414 CG ARG B 475 6.407 -1.813 -4.211 1.00 0.00 C ATOM 1415 CD ARG B 475 7.306 -2.819 -3.519 1.00 0.00 C ATOM 1416 NE ARG B 475 7.954 -2.243 -2.344 1.00 0.00 N ATOM 1417 CZ ARG B 475 8.533 -2.951 -1.385 1.00 0.00 C ATOM 1418 NH1 ARG B 475 8.561 -4.277 -1.454 1.00 0.00 N ATOM 1419 NH2 ARG B 475 9.098 -2.328 -0.359 1.00 0.00 N ATOM 0 H ARG B 475 3.003 -0.724 -2.424 1.00 0.00 H new ATOM 0 HA ARG B 475 5.177 0.647 -3.637 1.00 0.00 H new ATOM 0 HB2 ARG B 475 5.491 -1.382 -2.324 1.00 0.00 H new ATOM 0 HB3 ARG B 475 4.477 -2.298 -3.421 1.00 0.00 H new ATOM 0 HG2 ARG B 475 6.084 -2.214 -5.172 1.00 0.00 H new ATOM 0 HG3 ARG B 475 6.971 -0.903 -4.418 1.00 0.00 H new ATOM 0 HD2 ARG B 475 6.719 -3.688 -3.222 1.00 0.00 H new ATOM 0 HD3 ARG B 475 8.065 -3.171 -4.218 1.00 0.00 H new ATOM 0 HE ARG B 475 7.961 -1.227 -2.255 1.00 0.00 H new ATOM 0 HH11 ARG B 475 8.136 -4.755 -2.248 1.00 0.00 H new ATOM 0 HH12 ARG B 475 9.008 -4.817 -0.713 1.00 0.00 H new ATOM 0 HH21 ARG B 475 9.085 -1.309 -0.311 1.00 0.00 H new ATOM 0 HH22 ARG B 475 9.545 -2.868 0.382 1.00 0.00 H new ATOM 1433 N TYR B 476 2.962 -0.691 -5.632 1.00 0.00 N ATOM 1434 CA TYR B 476 2.547 -0.717 -7.020 1.00 0.00 C ATOM 1435 C TYR B 476 2.526 0.702 -7.584 1.00 0.00 C ATOM 1436 O TYR B 476 3.047 0.960 -8.669 1.00 0.00 O ATOM 1437 CB TYR B 476 1.167 -1.373 -7.161 1.00 0.00 C ATOM 1438 CG TYR B 476 0.350 -0.776 -8.281 1.00 0.00 C ATOM 1439 CD1 TYR B 476 -0.543 0.248 -8.018 1.00 0.00 C ATOM 1440 CD2 TYR B 476 0.509 -1.195 -9.595 1.00 0.00 C ATOM 1441 CE1 TYR B 476 -1.255 0.850 -9.032 1.00 0.00 C ATOM 1442 CE2 TYR B 476 -0.210 -0.606 -10.618 1.00 0.00 C ATOM 1443 CZ TYR B 476 -1.090 0.418 -10.330 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.790 1.031 -11.343 1.00 0.00 O ATOM 0 H TYR B 476 2.271 -1.048 -4.972 1.00 0.00 H new ATOM 0 HA TYR B 476 3.263 -1.311 -7.588 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.293 -2.441 -7.338 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.622 -1.268 -6.223 1.00 0.00 H new ATOM 0 HD1 TYR B 476 -0.684 0.581 -7.000 1.00 0.00 H new ATOM 0 HD2 TYR B 476 1.203 -1.991 -9.821 1.00 0.00 H new ATOM 0 HE1 TYR B 476 -1.939 1.656 -8.811 1.00 0.00 H new ATOM 0 HE2 TYR B 476 -0.084 -0.945 -11.636 1.00 0.00 H new ATOM 0 HH TYR B 476 -2.697 0.663 -11.383 1.00 0.00 H new ATOM 1454 N ILE B 477 1.929 1.619 -6.832 1.00 0.00 N ATOM 1455 CA ILE B 477 1.834 3.008 -7.252 1.00 0.00 C ATOM 1456 C ILE B 477 3.217 3.614 -7.362 1.00 0.00 C ATOM 1457 O ILE B 477 3.599 4.146 -8.404 1.00 0.00 O ATOM 1458 CB ILE B 477 1.003 3.839 -6.259 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.418 3.287 -6.165 1.00 0.00 C ATOM 1460 CG2 ILE B 477 0.991 5.304 -6.683 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -1.199 3.819 -4.989 1.00 0.00 C ATOM 0 H ILE B 477 1.503 1.423 -5.926 1.00 0.00 H new ATOM 0 HA ILE B 477 1.339 3.025 -8.223 1.00 0.00 H new ATOM 0 HB ILE B 477 1.459 3.771 -5.271 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.953 3.527 -7.084 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.372 2.200 -6.098 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.400 5.883 -5.973 1.00 0.00 H new ATOM 0 HG22 ILE B 477 2.012 5.686 -6.702 1.00 0.00 H new ATOM 0 HG23 ILE B 477 0.552 5.392 -7.677 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -2.198 3.383 -4.988 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.687 3.556 -4.063 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -1.277 4.904 -5.065 1.00 0.00 H new ATOM 1473 N ILE B 478 3.973 3.491 -6.281 1.00 0.00 N ATOM 1474 CA ILE B 478 5.314 4.045 -6.202 1.00 0.00 C ATOM 1475 C ILE B 478 6.205 3.472 -7.302 1.00 0.00 C ATOM 1476 O ILE B 478 7.145 4.126 -7.749 1.00 0.00 O ATOM 1477 CB ILE B 478 5.935 3.764 -4.816 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.060 4.384 -3.726 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.352 4.310 -4.722 1.00 0.00 C ATOM 1480 CD1 ILE B 478 5.625 4.221 -2.338 1.00 0.00 C ATOM 0 H ILE B 478 3.674 3.005 -5.436 1.00 0.00 H new ATOM 0 HA ILE B 478 5.242 5.123 -6.343 1.00 0.00 H new ATOM 0 HB ILE B 478 5.984 2.684 -4.676 1.00 0.00 H new ATOM 0 HG12 ILE B 478 4.931 5.446 -3.935 1.00 0.00 H new ATOM 0 HG13 ILE B 478 4.070 3.929 -3.763 1.00 0.00 H new ATOM 0 HG21 ILE B 478 7.760 4.095 -3.734 1.00 0.00 H new ATOM 0 HG22 ILE B 478 7.975 3.838 -5.482 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.338 5.388 -4.882 1.00 0.00 H new ATOM 0 HD11 ILE B 478 4.953 4.684 -1.615 1.00 0.00 H new ATOM 0 HD12 ILE B 478 5.729 3.160 -2.110 1.00 0.00 H new ATOM 0 HD13 ILE B 478 6.602 4.701 -2.284 1.00 0.00 H new ATOM 1492 N LYS B 479 5.876 2.265 -7.750 1.00 0.00 N ATOM 1493 CA LYS B 479 6.635 1.588 -8.787 1.00 0.00 C ATOM 1494 C LYS B 479 6.706 2.417 -10.069 1.00 0.00 C ATOM 1495 O LYS B 479 7.756 2.492 -10.704 1.00 0.00 O ATOM 1496 CB LYS B 479 6.019 0.218 -9.080 1.00 0.00 C ATOM 1497 CG LYS B 479 6.894 -0.674 -9.938 1.00 0.00 C ATOM 1498 CD LYS B 479 8.223 -0.953 -9.257 1.00 0.00 C ATOM 1499 CE LYS B 479 9.079 -1.898 -10.072 1.00 0.00 C ATOM 1500 NZ LYS B 479 9.442 -1.323 -11.393 1.00 0.00 N ATOM 0 H LYS B 479 5.078 1.733 -7.404 1.00 0.00 H new ATOM 0 HA LYS B 479 7.653 1.457 -8.420 1.00 0.00 H new ATOM 0 HB2 LYS B 479 5.815 -0.288 -8.136 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.061 0.360 -9.579 1.00 0.00 H new ATOM 0 HG2 LYS B 479 6.378 -1.614 -10.135 1.00 0.00 H new ATOM 0 HG3 LYS B 479 7.069 -0.198 -10.903 1.00 0.00 H new ATOM 0 HD2 LYS B 479 8.758 -0.016 -9.105 1.00 0.00 H new ATOM 0 HD3 LYS B 479 8.044 -1.382 -8.271 1.00 0.00 H new ATOM 0 HE2 LYS B 479 9.987 -2.134 -9.517 1.00 0.00 H new ATOM 0 HE3 LYS B 479 8.543 -2.836 -10.220 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 10.161 -1.922 -11.847 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 8.596 -1.279 -11.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 9.823 -0.364 -11.261 1.00 0.00 H new ATOM 1514 N LYS B 480 5.597 3.045 -10.451 1.00 0.00 N ATOM 1515 CA LYS B 480 5.592 3.847 -11.669 1.00 0.00 C ATOM 1516 C LYS B 480 5.582 5.332 -11.340 1.00 0.00 C ATOM 1517 O LYS B 480 5.889 6.164 -12.192 1.00 0.00 O ATOM 1518 CB LYS B 480 4.366 3.542 -12.547 1.00 0.00 C ATOM 1519 CG LYS B 480 4.147 2.069 -12.877 1.00 0.00 C ATOM 1520 CD LYS B 480 3.328 1.355 -11.807 1.00 0.00 C ATOM 1521 CE LYS B 480 1.917 1.926 -11.683 1.00 0.00 C ATOM 1522 NZ LYS B 480 1.155 1.854 -12.962 1.00 0.00 N ATOM 0 H LYS B 480 4.710 3.016 -9.948 1.00 0.00 H new ATOM 0 HA LYS B 480 6.500 3.588 -12.214 1.00 0.00 H new ATOM 0 HB2 LYS B 480 3.476 3.920 -12.043 1.00 0.00 H new ATOM 0 HB3 LYS B 480 4.463 4.096 -13.481 1.00 0.00 H new ATOM 0 HG2 LYS B 480 3.639 1.985 -13.838 1.00 0.00 H new ATOM 0 HG3 LYS B 480 5.113 1.575 -12.983 1.00 0.00 H new ATOM 0 HD2 LYS B 480 3.269 0.293 -12.046 1.00 0.00 H new ATOM 0 HD3 LYS B 480 3.837 1.438 -10.847 1.00 0.00 H new ATOM 0 HE2 LYS B 480 1.375 1.381 -10.910 1.00 0.00 H new ATOM 0 HE3 LYS B 480 1.977 2.965 -11.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 0.155 2.077 -12.783 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 1.547 2.539 -13.639 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 1.230 0.895 -13.357 1.00 0.00 H new