USER MOD reduce.3.24.130724 H: found=0, std=0, add=776, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 770 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 39 MET CE :methyl -174:sc= -1.67 (180deg=-1.77) USER MOD Set 1.2: B 34 HIS : no HD1:sc= -0.0419 X(o=-2.4,f=-2.5) USER MOD Set 1.3: B 39 MET CE :methyl 177:sc= -0.697 (180deg=-0.751) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 41:sc= 0.346 USER MOD Single : A 6 SER OG : rot 43:sc= 0.372 USER MOD Single : A 8 GLN : amide:sc= -0.0649 X(o=-0.065,f=-0.065) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 99:sc= 1.3 USER MOD Single : A 17 MET CE :methyl 177:sc= 0 (180deg=-0.00739) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.278 X(o=-0.28,f=-0.28) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -1.59! C(o=-1.6!,f=-3!) USER MOD Single : A 27 GLN : amide:sc= -0.124 X(o=-0.12,f=-0.0081) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 HIS : no HD1:sc= -0.144 X(o=-0.14,f=0) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 36 ASN : amide:sc= -0.515 K(o=-0.52,f=-4.9!) USER MOD Single : A 41 LYS NZ :NH3+ -156:sc= 1.31 (180deg=1.19) USER MOD Single : A 42 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 48 SER OG : rot -133:sc= 1.29 USER MOD Single : A 51 SER OG : rot 180:sc= 0.087 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : B 1 GLY N :NH3+ -172:sc= 0.418 (180deg=0.386) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 5 SER OG : rot 38:sc= 0.331 USER MOD Single : B 6 SER OG : rot 180:sc= 0.119 USER MOD Single : B 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 10 SER OG : rot 180:sc= -0.023 USER MOD Single : B 11 SER OG : rot 83:sc= 0.407 USER MOD Single : B 17 MET CE :methyl -110:sc= -0.0478 (180deg=-0.132) USER MOD Single : B 18 SER OG : rot -36:sc= 0.00748 USER MOD Single : B 19 GLN : amide:sc= -0.0153 K(o=-0.015,f=-1.3) USER MOD Single : B 21 TYR OH : rot -36:sc= 1.2 USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 TYR OH : rot 180:sc= 0 USER MOD Single : B 24 GLN : amide:sc= -1.94! C(o=-1.9!,f=-5!) USER MOD Single : B 27 GLN : amide:sc= -0.245 X(o=-0.25,f=-0.73) USER MOD Single : B 28 LYS NZ :NH3+ 168:sc= 1.28 (180deg=1.15) USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 36 ASN : amide:sc= -0.556 K(o=-0.56,f=-7.9!) USER MOD Single : B 41 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.14) USER MOD Single : B 42 ASN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : B 48 SER OG : rot 85:sc= 1.25 USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.785 8.850 -11.113 1.00 0.00 N ATOM 2 CA GLY A 1 -13.951 8.329 -10.391 1.00 0.00 C ATOM 3 C GLY A 1 -15.237 8.824 -11.030 1.00 0.00 C ATOM 4 O GLY A 1 -15.445 8.626 -12.228 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.914 8.502 -10.663 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.817 8.528 -12.101 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.797 9.890 -11.087 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.932 7.239 -10.395 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.911 8.644 -9.348 1.00 0.00 H new ATOM 8 N SER A 2 -16.113 9.445 -10.240 1.00 0.00 N ATOM 9 CA SER A 2 -17.396 9.979 -10.679 1.00 0.00 C ATOM 10 C SER A 2 -17.348 11.516 -10.629 1.00 0.00 C ATOM 11 O SER A 2 -16.343 12.108 -10.210 1.00 0.00 O ATOM 12 CB SER A 2 -18.468 9.337 -9.778 1.00 0.00 C ATOM 13 OG SER A 2 -19.791 9.688 -10.131 1.00 0.00 O ATOM 0 H SER A 2 -15.941 9.593 -9.246 1.00 0.00 H new ATOM 0 HA SER A 2 -17.639 9.736 -11.713 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.365 8.253 -9.822 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.286 9.633 -8.745 1.00 0.00 H new ATOM 0 HG SER A 2 -20.420 9.247 -9.523 1.00 0.00 H new ATOM 19 N SER A 3 -18.413 12.169 -11.101 1.00 0.00 N ATOM 20 CA SER A 3 -18.525 13.616 -11.107 1.00 0.00 C ATOM 21 C SER A 3 -19.941 14.026 -10.720 1.00 0.00 C ATOM 22 O SER A 3 -20.870 14.051 -11.537 1.00 0.00 O ATOM 23 CB SER A 3 -18.031 14.228 -12.416 1.00 0.00 C ATOM 24 OG SER A 3 -17.922 15.628 -12.246 1.00 0.00 O ATOM 0 H SER A 3 -19.227 11.695 -11.493 1.00 0.00 H new ATOM 0 HA SER A 3 -17.858 14.029 -10.351 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.065 13.804 -12.691 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.723 13.998 -13.226 1.00 0.00 H new ATOM 0 HG SER A 3 -17.604 16.035 -13.079 1.00 0.00 H new ATOM 30 N GLY A 4 -20.094 14.357 -9.450 1.00 0.00 N ATOM 31 CA GLY A 4 -21.313 14.785 -8.803 1.00 0.00 C ATOM 32 C GLY A 4 -20.980 15.095 -7.354 1.00 0.00 C ATOM 33 O GLY A 4 -19.838 14.892 -6.927 1.00 0.00 O ATOM 0 H GLY A 4 -19.309 14.330 -8.800 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.721 15.666 -9.299 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.072 14.005 -8.863 1.00 0.00 H new ATOM 37 N SER A 5 -21.979 15.572 -6.621 1.00 0.00 N ATOM 38 CA SER A 5 -21.931 15.940 -5.218 1.00 0.00 C ATOM 39 C SER A 5 -21.265 14.821 -4.406 1.00 0.00 C ATOM 40 O SER A 5 -21.908 13.806 -4.124 1.00 0.00 O ATOM 41 CB SER A 5 -23.369 16.229 -4.782 1.00 0.00 C ATOM 42 OG SER A 5 -24.225 15.141 -5.103 1.00 0.00 O ATOM 0 H SER A 5 -22.905 15.721 -7.022 1.00 0.00 H new ATOM 0 HA SER A 5 -21.326 16.831 -5.047 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.397 16.415 -3.708 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.727 17.135 -5.272 1.00 0.00 H new ATOM 0 HG SER A 5 -23.766 14.296 -4.913 1.00 0.00 H new ATOM 48 N SER A 6 -19.995 15.012 -4.057 1.00 0.00 N ATOM 49 CA SER A 6 -19.157 14.086 -3.318 1.00 0.00 C ATOM 50 C SER A 6 -19.815 13.591 -2.036 1.00 0.00 C ATOM 51 O SER A 6 -19.953 14.365 -1.082 1.00 0.00 O ATOM 52 CB SER A 6 -17.821 14.772 -3.011 1.00 0.00 C ATOM 53 OG SER A 6 -18.067 16.026 -2.397 1.00 0.00 O ATOM 0 H SER A 6 -19.499 15.870 -4.299 1.00 0.00 H new ATOM 0 HA SER A 6 -18.997 13.203 -3.936 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.220 14.144 -2.353 1.00 0.00 H new ATOM 0 HB3 SER A 6 -17.251 14.910 -3.930 1.00 0.00 H new ATOM 0 HG SER A 6 -18.774 15.928 -1.726 1.00 0.00 H new ATOM 59 N GLY A 7 -20.238 12.332 -2.011 1.00 0.00 N ATOM 60 CA GLY A 7 -20.853 11.722 -0.848 1.00 0.00 C ATOM 61 C GLY A 7 -19.763 11.340 0.144 1.00 0.00 C ATOM 62 O GLY A 7 -18.566 11.478 -0.141 1.00 0.00 O ATOM 0 H GLY A 7 -20.160 11.702 -2.810 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.556 12.415 -0.387 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -21.421 10.839 -1.142 1.00 0.00 H new ATOM 66 N GLN A 8 -20.164 10.846 1.313 1.00 0.00 N ATOM 67 CA GLN A 8 -19.248 10.428 2.366 1.00 0.00 C ATOM 68 C GLN A 8 -18.277 9.387 1.780 1.00 0.00 C ATOM 69 O GLN A 8 -18.726 8.472 1.082 1.00 0.00 O ATOM 70 CB GLN A 8 -20.096 9.862 3.517 1.00 0.00 C ATOM 71 CG GLN A 8 -19.310 9.683 4.816 1.00 0.00 C ATOM 72 CD GLN A 8 -18.908 10.999 5.474 1.00 0.00 C ATOM 73 OE1 GLN A 8 -17.733 11.358 5.514 1.00 0.00 O ATOM 74 NE2 GLN A 8 -19.858 11.737 6.012 1.00 0.00 N ATOM 0 H GLN A 8 -21.147 10.724 1.557 1.00 0.00 H new ATOM 0 HA GLN A 8 -18.650 11.253 2.752 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -20.939 10.528 3.700 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -20.510 8.900 3.215 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -19.911 9.105 5.518 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -18.412 9.100 4.610 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -20.829 11.427 5.972 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -19.622 12.618 6.469 1.00 0.00 H new ATOM 83 N LEU A 9 -16.969 9.484 2.036 1.00 0.00 N ATOM 84 CA LEU A 9 -16.001 8.521 1.493 1.00 0.00 C ATOM 85 C LEU A 9 -16.262 7.104 1.983 1.00 0.00 C ATOM 86 O LEU A 9 -16.029 6.153 1.239 1.00 0.00 O ATOM 87 CB LEU A 9 -14.562 8.924 1.839 1.00 0.00 C ATOM 88 CG LEU A 9 -13.622 8.704 0.645 1.00 0.00 C ATOM 89 CD1 LEU A 9 -13.829 9.793 -0.414 1.00 0.00 C ATOM 90 CD2 LEU A 9 -12.173 8.725 1.129 1.00 0.00 C ATOM 0 H LEU A 9 -16.555 10.216 2.613 1.00 0.00 H new ATOM 0 HA LEU A 9 -16.128 8.536 0.411 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -14.537 9.972 2.137 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -14.213 8.342 2.692 1.00 0.00 H new ATOM 0 HG LEU A 9 -13.846 7.737 0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -13.154 9.619 -1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -14.860 9.766 -0.767 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -13.621 10.770 0.023 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -11.504 8.569 0.282 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -11.957 9.689 1.589 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -12.022 7.932 1.861 1.00 0.00 H new ATOM 102 N SER A 10 -16.791 6.945 3.198 1.00 0.00 N ATOM 103 CA SER A 10 -17.088 5.627 3.743 1.00 0.00 C ATOM 104 C SER A 10 -18.149 4.878 2.926 1.00 0.00 C ATOM 105 O SER A 10 -18.356 3.684 3.147 1.00 0.00 O ATOM 106 CB SER A 10 -17.439 5.739 5.222 1.00 0.00 C ATOM 107 OG SER A 10 -18.476 6.669 5.447 1.00 0.00 O ATOM 0 H SER A 10 -17.022 7.718 3.822 1.00 0.00 H new ATOM 0 HA SER A 10 -16.190 5.014 3.663 1.00 0.00 H new ATOM 0 HB2 SER A 10 -17.740 4.761 5.599 1.00 0.00 H new ATOM 0 HB3 SER A 10 -16.554 6.039 5.784 1.00 0.00 H new ATOM 0 HG SER A 10 -18.674 6.712 6.406 1.00 0.00 H new ATOM 113 N SER A 11 -18.824 5.547 1.987 1.00 0.00 N ATOM 114 CA SER A 11 -19.813 4.925 1.123 1.00 0.00 C ATOM 115 C SER A 11 -19.092 3.922 0.211 1.00 0.00 C ATOM 116 O SER A 11 -19.658 2.903 -0.172 1.00 0.00 O ATOM 117 CB SER A 11 -20.497 6.001 0.272 1.00 0.00 C ATOM 118 OG SER A 11 -20.956 7.080 1.065 1.00 0.00 O ATOM 0 H SER A 11 -18.693 6.543 1.809 1.00 0.00 H new ATOM 0 HA SER A 11 -20.569 4.413 1.718 1.00 0.00 H new ATOM 0 HB2 SER A 11 -19.798 6.372 -0.478 1.00 0.00 H new ATOM 0 HB3 SER A 11 -21.337 5.561 -0.266 1.00 0.00 H new ATOM 0 HG SER A 11 -20.313 7.818 1.017 1.00 0.00 H new ATOM 124 N GLU A 12 -17.831 4.200 -0.144 1.00 0.00 N ATOM 125 CA GLU A 12 -17.016 3.344 -0.994 1.00 0.00 C ATOM 126 C GLU A 12 -16.505 2.132 -0.215 1.00 0.00 C ATOM 127 O GLU A 12 -16.216 1.112 -0.834 1.00 0.00 O ATOM 128 CB GLU A 12 -15.839 4.154 -1.564 1.00 0.00 C ATOM 129 CG GLU A 12 -16.269 5.193 -2.608 1.00 0.00 C ATOM 130 CD GLU A 12 -16.861 4.542 -3.858 1.00 0.00 C ATOM 131 OE1 GLU A 12 -16.172 3.731 -4.524 1.00 0.00 O ATOM 132 OE2 GLU A 12 -18.018 4.841 -4.227 1.00 0.00 O ATOM 0 H GLU A 12 -17.346 5.044 0.161 1.00 0.00 H new ATOM 0 HA GLU A 12 -17.630 2.978 -1.817 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -15.326 4.661 -0.747 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.121 3.470 -2.016 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -17.005 5.866 -2.167 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -15.409 5.801 -2.889 1.00 0.00 H new ATOM 139 N ILE A 13 -16.398 2.205 1.119 1.00 0.00 N ATOM 140 CA ILE A 13 -15.938 1.077 1.934 1.00 0.00 C ATOM 141 C ILE A 13 -16.952 -0.052 1.740 1.00 0.00 C ATOM 142 O ILE A 13 -16.574 -1.204 1.546 1.00 0.00 O ATOM 143 CB ILE A 13 -15.788 1.479 3.424 1.00 0.00 C ATOM 144 CG1 ILE A 13 -14.654 2.520 3.586 1.00 0.00 C ATOM 145 CG2 ILE A 13 -15.560 0.249 4.325 1.00 0.00 C ATOM 146 CD1 ILE A 13 -14.605 3.170 4.977 1.00 0.00 C ATOM 0 H ILE A 13 -16.626 3.041 1.658 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.947 0.749 1.621 1.00 0.00 H new ATOM 0 HB ILE A 13 -16.722 1.937 3.748 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -13.698 2.036 3.387 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.779 3.300 2.835 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -15.460 0.571 5.362 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.409 -0.429 4.236 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -14.650 -0.265 4.015 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -13.785 3.888 5.015 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -15.546 3.684 5.172 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -14.448 2.400 5.733 1.00 0.00 H new ATOM 158 N GLU A 14 -18.243 0.287 1.752 1.00 0.00 N ATOM 159 CA GLU A 14 -19.323 -0.672 1.573 1.00 0.00 C ATOM 160 C GLU A 14 -19.228 -1.311 0.182 1.00 0.00 C ATOM 161 O GLU A 14 -19.624 -2.462 -0.004 1.00 0.00 O ATOM 162 CB GLU A 14 -20.678 0.027 1.799 1.00 0.00 C ATOM 163 CG GLU A 14 -20.768 0.619 3.215 1.00 0.00 C ATOM 164 CD GLU A 14 -22.120 1.276 3.498 1.00 0.00 C ATOM 165 OE1 GLU A 14 -23.038 0.575 3.976 1.00 0.00 O ATOM 166 OE2 GLU A 14 -22.243 2.516 3.329 1.00 0.00 O ATOM 0 H GLU A 14 -18.566 1.245 1.888 1.00 0.00 H new ATOM 0 HA GLU A 14 -19.237 -1.473 2.307 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -20.809 0.819 1.062 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -21.488 -0.686 1.648 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.593 -0.171 3.946 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.976 1.356 3.347 1.00 0.00 H new ATOM 173 N ARG A 15 -18.708 -0.587 -0.817 1.00 0.00 N ATOM 174 CA ARG A 15 -18.569 -1.135 -2.165 1.00 0.00 C ATOM 175 C ARG A 15 -17.340 -2.035 -2.216 1.00 0.00 C ATOM 176 O ARG A 15 -17.366 -3.062 -2.890 1.00 0.00 O ATOM 177 CB ARG A 15 -18.563 -0.004 -3.214 1.00 0.00 C ATOM 178 CG ARG A 15 -19.754 0.969 -3.075 1.00 0.00 C ATOM 179 CD ARG A 15 -21.106 0.263 -2.926 1.00 0.00 C ATOM 180 NE ARG A 15 -22.216 1.191 -2.683 1.00 0.00 N ATOM 181 CZ ARG A 15 -23.517 0.881 -2.717 1.00 0.00 C ATOM 182 NH1 ARG A 15 -23.925 -0.339 -3.047 1.00 0.00 N ATOM 183 NH2 ARG A 15 -24.401 1.808 -2.388 1.00 0.00 N ATOM 0 H ARG A 15 -18.379 0.373 -0.715 1.00 0.00 H new ATOM 0 HA ARG A 15 -19.428 -1.757 -2.416 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -17.633 0.557 -3.126 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -18.577 -0.444 -4.211 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -19.590 1.610 -2.209 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -19.787 1.618 -3.950 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -21.311 -0.311 -3.830 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -21.049 -0.449 -2.103 1.00 0.00 H new ATOM 0 HE ARG A 15 -21.974 2.159 -2.469 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -23.242 -1.060 -3.280 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -24.922 -0.555 -3.067 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -24.086 2.739 -2.115 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -25.398 1.592 -2.407 1.00 0.00 H new ATOM 197 N LEU A 16 -16.281 -1.704 -1.469 1.00 0.00 N ATOM 198 CA LEU A 16 -15.065 -2.500 -1.428 1.00 0.00 C ATOM 199 C LEU A 16 -15.315 -3.806 -0.680 1.00 0.00 C ATOM 200 O LEU A 16 -14.700 -4.808 -1.034 1.00 0.00 O ATOM 201 CB LEU A 16 -13.891 -1.690 -0.852 1.00 0.00 C ATOM 202 CG LEU A 16 -13.383 -0.640 -1.859 1.00 0.00 C ATOM 203 CD1 LEU A 16 -12.465 0.367 -1.158 1.00 0.00 C ATOM 204 CD2 LEU A 16 -12.635 -1.282 -3.038 1.00 0.00 C ATOM 0 H LEU A 16 -16.250 -0.874 -0.877 1.00 0.00 H new ATOM 0 HA LEU A 16 -14.777 -2.765 -2.445 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.206 -1.193 0.066 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.077 -2.365 -0.586 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.259 -0.128 -2.257 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -12.113 1.103 -1.881 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -13.017 0.872 -0.365 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -11.611 -0.157 -0.729 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -12.296 -0.503 -3.721 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.774 -1.837 -2.664 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -13.303 -1.962 -3.566 1.00 0.00 H new ATOM 216 N MET A 17 -16.245 -3.847 0.283 1.00 0.00 N ATOM 217 CA MET A 17 -16.567 -5.079 1.007 1.00 0.00 C ATOM 218 C MET A 17 -17.014 -6.125 -0.018 1.00 0.00 C ATOM 219 O MET A 17 -16.547 -7.263 0.009 1.00 0.00 O ATOM 220 CB MET A 17 -17.689 -4.833 2.025 1.00 0.00 C ATOM 221 CG MET A 17 -17.200 -4.088 3.266 1.00 0.00 C ATOM 222 SD MET A 17 -18.549 -3.461 4.302 1.00 0.00 S ATOM 223 CE MET A 17 -17.600 -3.119 5.801 1.00 0.00 C ATOM 0 H MET A 17 -16.789 -3.036 0.578 1.00 0.00 H new ATOM 0 HA MET A 17 -15.690 -5.426 1.553 1.00 0.00 H new ATOM 0 HB2 MET A 17 -18.486 -4.259 1.551 1.00 0.00 H new ATOM 0 HB3 MET A 17 -18.119 -5.789 2.325 1.00 0.00 H new ATOM 0 HG2 MET A 17 -16.575 -4.755 3.859 1.00 0.00 H new ATOM 0 HG3 MET A 17 -16.571 -3.254 2.956 1.00 0.00 H new ATOM 0 HE1 MET A 17 -18.252 -2.671 6.550 1.00 0.00 H new ATOM 0 HE2 MET A 17 -17.186 -4.049 6.190 1.00 0.00 H new ATOM 0 HE3 MET A 17 -16.788 -2.430 5.568 1.00 0.00 H new ATOM 233 N SER A 18 -17.868 -5.718 -0.961 1.00 0.00 N ATOM 234 CA SER A 18 -18.392 -6.567 -2.021 1.00 0.00 C ATOM 235 C SER A 18 -17.269 -7.085 -2.931 1.00 0.00 C ATOM 236 O SER A 18 -17.453 -8.104 -3.588 1.00 0.00 O ATOM 237 CB SER A 18 -19.444 -5.758 -2.784 1.00 0.00 C ATOM 238 OG SER A 18 -20.145 -6.499 -3.773 1.00 0.00 O ATOM 0 H SER A 18 -18.220 -4.762 -1.005 1.00 0.00 H new ATOM 0 HA SER A 18 -18.858 -7.459 -1.603 1.00 0.00 H new ATOM 0 HB2 SER A 18 -20.163 -5.354 -2.071 1.00 0.00 H new ATOM 0 HB3 SER A 18 -18.956 -4.908 -3.261 1.00 0.00 H new ATOM 0 HG SER A 18 -20.799 -5.918 -4.215 1.00 0.00 H new ATOM 244 N GLN A 19 -16.114 -6.414 -3.024 1.00 0.00 N ATOM 245 CA GLN A 19 -15.015 -6.898 -3.855 1.00 0.00 C ATOM 246 C GLN A 19 -14.302 -8.083 -3.189 1.00 0.00 C ATOM 247 O GLN A 19 -13.411 -8.662 -3.803 1.00 0.00 O ATOM 248 CB GLN A 19 -14.041 -5.758 -4.190 1.00 0.00 C ATOM 249 CG GLN A 19 -14.639 -4.755 -5.183 1.00 0.00 C ATOM 250 CD GLN A 19 -14.944 -5.435 -6.516 1.00 0.00 C ATOM 251 OE1 GLN A 19 -14.043 -5.924 -7.199 1.00 0.00 O ATOM 252 NE2 GLN A 19 -16.210 -5.517 -6.889 1.00 0.00 N ATOM 0 H GLN A 19 -15.921 -5.540 -2.535 1.00 0.00 H new ATOM 0 HA GLN A 19 -15.430 -7.259 -4.796 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -13.765 -5.237 -3.273 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -13.125 -6.176 -4.607 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -15.552 -4.326 -4.770 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -13.943 -3.931 -5.340 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -16.940 -5.105 -6.308 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -16.456 -5.992 -7.757 1.00 0.00 H new ATOM 261 N GLY A 20 -14.686 -8.461 -1.967 1.00 0.00 N ATOM 262 CA GLY A 20 -14.118 -9.571 -1.223 1.00 0.00 C ATOM 263 C GLY A 20 -13.045 -9.137 -0.235 1.00 0.00 C ATOM 264 O GLY A 20 -12.455 -10.002 0.411 1.00 0.00 O ATOM 0 H GLY A 20 -15.427 -7.981 -1.457 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -14.914 -10.085 -0.684 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -13.691 -10.290 -1.923 1.00 0.00 H new ATOM 268 N TYR A 21 -12.746 -7.840 -0.145 1.00 0.00 N ATOM 269 CA TYR A 21 -11.748 -7.321 0.773 1.00 0.00 C ATOM 270 C TYR A 21 -12.393 -7.195 2.153 1.00 0.00 C ATOM 271 O TYR A 21 -13.486 -6.635 2.272 1.00 0.00 O ATOM 272 CB TYR A 21 -11.263 -5.942 0.306 1.00 0.00 C ATOM 273 CG TYR A 21 -10.801 -5.845 -1.136 1.00 0.00 C ATOM 274 CD1 TYR A 21 -9.779 -6.681 -1.625 1.00 0.00 C ATOM 275 CD2 TYR A 21 -11.383 -4.889 -1.987 1.00 0.00 C ATOM 276 CE1 TYR A 21 -9.340 -6.556 -2.955 1.00 0.00 C ATOM 277 CE2 TYR A 21 -10.928 -4.735 -3.307 1.00 0.00 C ATOM 278 CZ TYR A 21 -9.903 -5.573 -3.797 1.00 0.00 C ATOM 279 OH TYR A 21 -9.472 -5.414 -5.080 1.00 0.00 O ATOM 0 H TYR A 21 -13.195 -7.122 -0.713 1.00 0.00 H new ATOM 0 HA TYR A 21 -10.892 -7.994 0.809 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -12.072 -5.226 0.455 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -10.440 -5.632 0.950 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -9.331 -7.420 -0.977 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -12.187 -4.267 -1.622 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.571 -7.213 -3.333 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -11.361 -3.978 -3.945 1.00 0.00 H new ATOM 0 HH TYR A 21 -9.976 -4.690 -5.507 1.00 0.00 H new ATOM 289 N SER A 22 -11.738 -7.704 3.195 1.00 0.00 N ATOM 290 CA SER A 22 -12.273 -7.602 4.546 1.00 0.00 C ATOM 291 C SER A 22 -12.175 -6.142 4.988 1.00 0.00 C ATOM 292 O SER A 22 -11.288 -5.400 4.555 1.00 0.00 O ATOM 293 CB SER A 22 -11.498 -8.505 5.513 1.00 0.00 C ATOM 294 OG SER A 22 -11.372 -9.812 4.992 1.00 0.00 O ATOM 0 H SER A 22 -10.842 -8.187 3.128 1.00 0.00 H new ATOM 0 HA SER A 22 -13.312 -7.931 4.555 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.509 -8.085 5.695 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.011 -8.540 6.474 1.00 0.00 H new ATOM 0 HG SER A 22 -10.873 -10.370 5.625 1.00 0.00 H new ATOM 300 N TYR A 23 -13.043 -5.738 5.912 1.00 0.00 N ATOM 301 CA TYR A 23 -13.094 -4.388 6.454 1.00 0.00 C ATOM 302 C TYR A 23 -11.731 -3.945 6.990 1.00 0.00 C ATOM 303 O TYR A 23 -11.380 -2.775 6.868 1.00 0.00 O ATOM 304 CB TYR A 23 -14.161 -4.359 7.553 1.00 0.00 C ATOM 305 CG TYR A 23 -14.321 -3.028 8.258 1.00 0.00 C ATOM 306 CD1 TYR A 23 -14.653 -1.875 7.523 1.00 0.00 C ATOM 307 CD2 TYR A 23 -14.165 -2.950 9.656 1.00 0.00 C ATOM 308 CE1 TYR A 23 -14.832 -0.649 8.183 1.00 0.00 C ATOM 309 CE2 TYR A 23 -14.345 -1.726 10.323 1.00 0.00 C ATOM 310 CZ TYR A 23 -14.675 -0.568 9.583 1.00 0.00 C ATOM 311 OH TYR A 23 -14.831 0.629 10.204 1.00 0.00 O ATOM 0 H TYR A 23 -13.747 -6.358 6.313 1.00 0.00 H new ATOM 0 HA TYR A 23 -13.355 -3.684 5.664 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -15.119 -4.638 7.115 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -13.917 -5.119 8.295 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -14.770 -1.933 6.451 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -13.906 -3.835 10.218 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -15.090 0.234 7.618 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -14.232 -1.671 11.396 1.00 0.00 H new ATOM 0 HH TYR A 23 -14.691 0.518 11.168 1.00 0.00 H new ATOM 321 N GLN A 24 -10.963 -4.874 7.567 1.00 0.00 N ATOM 322 CA GLN A 24 -9.643 -4.621 8.124 1.00 0.00 C ATOM 323 C GLN A 24 -8.717 -4.106 7.024 1.00 0.00 C ATOM 324 O GLN A 24 -8.114 -3.049 7.188 1.00 0.00 O ATOM 325 CB GLN A 24 -9.062 -5.899 8.754 1.00 0.00 C ATOM 326 CG GLN A 24 -9.820 -6.385 9.998 1.00 0.00 C ATOM 327 CD GLN A 24 -11.252 -6.834 9.702 1.00 0.00 C ATOM 328 OE1 GLN A 24 -11.497 -7.574 8.755 1.00 0.00 O ATOM 329 NE2 GLN A 24 -12.230 -6.367 10.460 1.00 0.00 N ATOM 0 H GLN A 24 -11.256 -5.847 7.659 1.00 0.00 H new ATOM 0 HA GLN A 24 -9.729 -3.868 8.907 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -9.064 -6.693 8.007 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -8.021 -5.718 9.023 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -9.273 -7.214 10.446 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -9.844 -5.583 10.736 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -12.017 -5.752 11.246 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -13.197 -6.622 10.259 1.00 0.00 H new ATOM 338 N ASP A 25 -8.614 -4.847 5.918 1.00 0.00 N ATOM 339 CA ASP A 25 -7.780 -4.506 4.767 1.00 0.00 C ATOM 340 C ASP A 25 -8.202 -3.141 4.234 1.00 0.00 C ATOM 341 O ASP A 25 -7.365 -2.251 4.087 1.00 0.00 O ATOM 342 CB ASP A 25 -7.886 -5.564 3.648 1.00 0.00 C ATOM 343 CG ASP A 25 -6.992 -6.779 3.886 1.00 0.00 C ATOM 344 OD1 ASP A 25 -7.168 -7.450 4.927 1.00 0.00 O ATOM 345 OD2 ASP A 25 -6.071 -7.041 3.075 1.00 0.00 O ATOM 0 H ASP A 25 -9.122 -5.723 5.797 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.740 -4.479 5.093 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.922 -5.893 3.564 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.620 -5.105 2.696 1.00 0.00 H new ATOM 350 N ILE A 26 -9.502 -2.950 3.982 1.00 0.00 N ATOM 351 CA ILE A 26 -10.031 -1.693 3.458 1.00 0.00 C ATOM 352 C ILE A 26 -9.615 -0.523 4.366 1.00 0.00 C ATOM 353 O ILE A 26 -9.086 0.475 3.861 1.00 0.00 O ATOM 354 CB ILE A 26 -11.557 -1.775 3.214 1.00 0.00 C ATOM 355 CG1 ILE A 26 -11.978 -2.966 2.321 1.00 0.00 C ATOM 356 CG2 ILE A 26 -12.024 -0.486 2.515 1.00 0.00 C ATOM 357 CD1 ILE A 26 -13.478 -3.275 2.420 1.00 0.00 C ATOM 0 H ILE A 26 -10.214 -3.664 4.137 1.00 0.00 H new ATOM 0 HA ILE A 26 -9.593 -1.504 2.478 1.00 0.00 H new ATOM 0 HB ILE A 26 -12.017 -1.910 4.193 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -11.724 -2.746 1.284 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -11.409 -3.850 2.608 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -13.099 -0.536 2.340 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -11.799 0.373 3.147 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -11.505 -0.380 1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -13.719 -4.119 1.774 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -13.731 -3.523 3.451 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -14.051 -2.402 2.106 1.00 0.00 H new ATOM 369 N GLN A 27 -9.810 -0.645 5.685 1.00 0.00 N ATOM 370 CA GLN A 27 -9.441 0.390 6.638 1.00 0.00 C ATOM 371 C GLN A 27 -7.939 0.649 6.570 1.00 0.00 C ATOM 372 O GLN A 27 -7.549 1.796 6.381 1.00 0.00 O ATOM 373 CB GLN A 27 -9.833 0.009 8.079 1.00 0.00 C ATOM 374 CG GLN A 27 -11.327 0.144 8.398 1.00 0.00 C ATOM 375 CD GLN A 27 -11.875 1.567 8.278 1.00 0.00 C ATOM 376 OE1 GLN A 27 -12.920 1.793 7.681 1.00 0.00 O ATOM 377 NE2 GLN A 27 -11.227 2.577 8.825 1.00 0.00 N ATOM 0 H GLN A 27 -10.230 -1.469 6.115 1.00 0.00 H new ATOM 0 HA GLN A 27 -9.987 1.294 6.368 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -9.529 -1.021 8.263 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -9.270 0.636 8.771 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -11.889 -0.506 7.727 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.503 -0.215 9.412 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -10.355 2.411 9.327 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -11.598 3.524 8.746 1.00 0.00 H new ATOM 386 N LYS A 28 -7.093 -0.378 6.735 1.00 0.00 N ATOM 387 CA LYS A 28 -5.629 -0.245 6.704 1.00 0.00 C ATOM 388 C LYS A 28 -5.177 0.527 5.470 1.00 0.00 C ATOM 389 O LYS A 28 -4.321 1.405 5.577 1.00 0.00 O ATOM 390 CB LYS A 28 -4.963 -1.635 6.720 1.00 0.00 C ATOM 391 CG LYS A 28 -5.090 -2.351 8.069 1.00 0.00 C ATOM 392 CD LYS A 28 -4.705 -3.828 7.959 1.00 0.00 C ATOM 393 CE LYS A 28 -4.898 -4.477 9.330 1.00 0.00 C ATOM 394 NZ LYS A 28 -4.613 -5.922 9.298 1.00 0.00 N ATOM 0 H LYS A 28 -7.409 -1.334 6.895 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.324 0.309 7.592 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.412 -2.255 5.944 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -3.907 -1.528 6.471 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.451 -1.861 8.804 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.115 -2.267 8.432 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -5.323 -4.327 7.212 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -3.669 -3.927 7.634 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.244 -3.994 10.056 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -5.922 -4.316 9.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -4.755 -6.325 10.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.254 -6.387 8.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -3.628 -6.075 9.001 1.00 0.00 H new ATOM 408 N ALA A 29 -5.738 0.202 4.305 1.00 0.00 N ATOM 409 CA ALA A 29 -5.377 0.867 3.064 1.00 0.00 C ATOM 410 C ALA A 29 -5.711 2.356 3.148 1.00 0.00 C ATOM 411 O ALA A 29 -4.920 3.168 2.680 1.00 0.00 O ATOM 412 CB ALA A 29 -6.057 0.197 1.868 1.00 0.00 C ATOM 0 H ALA A 29 -6.448 -0.523 4.200 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.301 0.774 2.914 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -5.771 0.713 0.951 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -5.746 -0.846 1.810 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -7.139 0.247 1.990 1.00 0.00 H new ATOM 418 N LEU A 30 -6.856 2.728 3.731 1.00 0.00 N ATOM 419 CA LEU A 30 -7.252 4.127 3.866 1.00 0.00 C ATOM 420 C LEU A 30 -6.268 4.863 4.764 1.00 0.00 C ATOM 421 O LEU A 30 -5.744 5.889 4.344 1.00 0.00 O ATOM 422 CB LEU A 30 -8.683 4.283 4.421 1.00 0.00 C ATOM 423 CG LEU A 30 -9.778 4.140 3.354 1.00 0.00 C ATOM 424 CD1 LEU A 30 -11.144 3.960 4.024 1.00 0.00 C ATOM 425 CD2 LEU A 30 -9.836 5.367 2.432 1.00 0.00 C ATOM 0 H LEU A 30 -7.529 2.068 4.120 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.241 4.562 2.867 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -8.845 3.536 5.198 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.775 5.260 4.895 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.533 3.264 2.753 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -11.914 3.859 3.259 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -11.130 3.064 4.644 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -11.362 4.828 4.646 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.623 5.228 1.691 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.048 6.257 3.024 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -8.878 5.488 1.926 1.00 0.00 H new ATOM 437 N VAL A 31 -5.993 4.353 5.968 1.00 0.00 N ATOM 438 CA VAL A 31 -5.075 5.005 6.904 1.00 0.00 C ATOM 439 C VAL A 31 -3.696 5.230 6.273 1.00 0.00 C ATOM 440 O VAL A 31 -3.106 6.309 6.388 1.00 0.00 O ATOM 441 CB VAL A 31 -4.931 4.193 8.211 1.00 0.00 C ATOM 442 CG1 VAL A 31 -4.291 5.070 9.295 1.00 0.00 C ATOM 443 CG2 VAL A 31 -6.247 3.630 8.766 1.00 0.00 C ATOM 0 H VAL A 31 -6.397 3.484 6.318 1.00 0.00 H new ATOM 0 HA VAL A 31 -5.506 5.976 7.146 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.307 3.338 7.951 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.191 4.495 10.216 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.306 5.398 8.963 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.921 5.940 9.478 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -6.048 3.076 9.683 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.932 4.450 8.979 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.697 2.964 8.030 1.00 0.00 H new ATOM 453 N ILE A 32 -3.168 4.220 5.584 1.00 0.00 N ATOM 454 CA ILE A 32 -1.858 4.316 4.962 1.00 0.00 C ATOM 455 C ILE A 32 -1.898 5.224 3.721 1.00 0.00 C ATOM 456 O ILE A 32 -0.886 5.838 3.381 1.00 0.00 O ATOM 457 CB ILE A 32 -1.317 2.894 4.708 1.00 0.00 C ATOM 458 CG1 ILE A 32 -1.181 2.110 6.041 1.00 0.00 C ATOM 459 CG2 ILE A 32 0.055 3.003 4.033 1.00 0.00 C ATOM 460 CD1 ILE A 32 -1.012 0.599 5.857 1.00 0.00 C ATOM 0 H ILE A 32 -3.634 3.323 5.445 1.00 0.00 H new ATOM 0 HA ILE A 32 -1.149 4.805 5.630 1.00 0.00 H new ATOM 0 HB ILE A 32 -2.014 2.356 4.065 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -0.325 2.497 6.593 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -2.064 2.295 6.652 1.00 0.00 H new ATOM 0 HG21 ILE A 32 0.450 2.004 3.847 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -0.046 3.535 3.087 1.00 0.00 H new ATOM 0 HG23 ILE A 32 0.739 3.548 4.684 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -0.924 0.121 6.833 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -1.879 0.197 5.333 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -0.113 0.402 5.274 1.00 0.00 H new ATOM 472 N ALA A 33 -3.040 5.356 3.044 1.00 0.00 N ATOM 473 CA ALA A 33 -3.195 6.203 1.869 1.00 0.00 C ATOM 474 C ALA A 33 -3.648 7.616 2.258 1.00 0.00 C ATOM 475 O ALA A 33 -4.038 8.387 1.379 1.00 0.00 O ATOM 476 CB ALA A 33 -4.187 5.563 0.898 1.00 0.00 C ATOM 0 H ALA A 33 -3.896 4.867 3.305 1.00 0.00 H new ATOM 0 HA ALA A 33 -2.226 6.294 1.378 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -4.300 6.200 0.021 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -3.816 4.585 0.591 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.153 5.447 1.389 1.00 0.00 H new ATOM 482 N HIS A 34 -3.597 7.985 3.542 1.00 0.00 N ATOM 483 CA HIS A 34 -4.034 9.297 4.042 1.00 0.00 C ATOM 484 C HIS A 34 -5.467 9.574 3.580 1.00 0.00 C ATOM 485 O HIS A 34 -5.814 10.623 3.029 1.00 0.00 O ATOM 486 CB HIS A 34 -2.991 10.394 3.770 1.00 0.00 C ATOM 487 CG HIS A 34 -1.671 10.114 4.452 1.00 0.00 C ATOM 488 ND1 HIS A 34 -0.446 10.670 4.154 1.00 0.00 N ATOM 489 CD2 HIS A 34 -1.484 9.252 5.497 1.00 0.00 C ATOM 490 CE1 HIS A 34 0.461 10.122 4.984 1.00 0.00 C ATOM 491 NE2 HIS A 34 -0.130 9.258 5.833 1.00 0.00 N ATOM 0 H HIS A 34 -3.245 7.372 4.277 1.00 0.00 H new ATOM 0 HA HIS A 34 -4.086 9.294 5.131 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -2.831 10.481 2.695 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -3.378 11.353 4.113 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -2.253 8.667 5.980 1.00 0.00 H new ATOM 0 HE1 HIS A 34 1.518 10.344 4.971 1.00 0.00 H new ATOM 0 HE2 HIS A 34 0.321 8.718 6.571 1.00 0.00 H new ATOM 499 N ASN A 35 -6.300 8.558 3.811 1.00 0.00 N ATOM 500 CA ASN A 35 -7.718 8.431 3.512 1.00 0.00 C ATOM 501 C ASN A 35 -8.047 8.545 2.021 1.00 0.00 C ATOM 502 O ASN A 35 -9.221 8.605 1.675 1.00 0.00 O ATOM 503 CB ASN A 35 -8.565 9.323 4.438 1.00 0.00 C ATOM 504 CG ASN A 35 -8.732 8.687 5.816 1.00 0.00 C ATOM 505 OD1 ASN A 35 -7.768 8.321 6.482 1.00 0.00 O ATOM 506 ND2 ASN A 35 -9.957 8.490 6.264 1.00 0.00 N ATOM 0 H ASN A 35 -5.953 7.712 4.263 1.00 0.00 H new ATOM 0 HA ASN A 35 -8.008 7.406 3.743 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -8.091 10.299 4.540 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -9.545 9.490 3.990 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -10.104 8.033 7.164 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -10.758 8.794 5.710 1.00 0.00 H new ATOM 513 N ASN A 36 -7.052 8.548 1.129 1.00 0.00 N ATOM 514 CA ASN A 36 -7.265 8.638 -0.311 1.00 0.00 C ATOM 515 C ASN A 36 -7.836 7.309 -0.802 1.00 0.00 C ATOM 516 O ASN A 36 -7.079 6.357 -0.989 1.00 0.00 O ATOM 517 CB ASN A 36 -5.944 8.949 -1.032 1.00 0.00 C ATOM 518 CG ASN A 36 -6.137 9.153 -2.533 1.00 0.00 C ATOM 519 OD1 ASN A 36 -7.186 8.862 -3.101 1.00 0.00 O ATOM 520 ND2 ASN A 36 -5.136 9.666 -3.222 1.00 0.00 N ATOM 0 H ASN A 36 -6.069 8.487 1.393 1.00 0.00 H new ATOM 0 HA ASN A 36 -7.964 9.445 -0.529 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -5.499 9.845 -0.600 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -5.241 8.133 -0.866 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -5.234 9.821 -4.225 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -4.264 9.908 -2.751 1.00 0.00 H new ATOM 527 N ILE A 37 -9.149 7.224 -1.023 1.00 0.00 N ATOM 528 CA ILE A 37 -9.797 5.998 -1.484 1.00 0.00 C ATOM 529 C ILE A 37 -9.228 5.521 -2.836 1.00 0.00 C ATOM 530 O ILE A 37 -9.110 4.317 -3.050 1.00 0.00 O ATOM 531 CB ILE A 37 -11.335 6.194 -1.499 1.00 0.00 C ATOM 532 CG1 ILE A 37 -12.131 4.877 -1.649 1.00 0.00 C ATOM 533 CG2 ILE A 37 -11.788 7.192 -2.578 1.00 0.00 C ATOM 534 CD1 ILE A 37 -12.459 4.189 -0.319 1.00 0.00 C ATOM 0 H ILE A 37 -9.792 8.004 -0.887 1.00 0.00 H new ATOM 0 HA ILE A 37 -9.577 5.193 -0.783 1.00 0.00 H new ATOM 0 HB ILE A 37 -11.563 6.605 -0.515 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -13.061 5.086 -2.177 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -11.559 4.188 -2.271 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -12.873 7.294 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -11.327 8.162 -2.393 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -11.486 6.828 -3.560 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -13.018 3.273 -0.511 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -11.533 3.946 0.203 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -13.059 4.858 0.298 1.00 0.00 H new ATOM 546 N GLU A 38 -8.846 6.423 -3.746 1.00 0.00 N ATOM 547 CA GLU A 38 -8.317 6.065 -5.066 1.00 0.00 C ATOM 548 C GLU A 38 -6.981 5.316 -4.957 1.00 0.00 C ATOM 549 O GLU A 38 -6.707 4.377 -5.705 1.00 0.00 O ATOM 550 CB GLU A 38 -8.124 7.328 -5.931 1.00 0.00 C ATOM 551 CG GLU A 38 -9.350 8.260 -5.988 1.00 0.00 C ATOM 552 CD GLU A 38 -9.133 9.467 -6.915 1.00 0.00 C ATOM 553 OE1 GLU A 38 -8.057 10.098 -6.827 1.00 0.00 O ATOM 554 OE2 GLU A 38 -10.049 9.749 -7.737 1.00 0.00 O ATOM 0 H GLU A 38 -8.896 7.429 -3.586 1.00 0.00 H new ATOM 0 HA GLU A 38 -9.045 5.405 -5.537 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -7.274 7.891 -5.545 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.869 7.022 -6.946 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.216 7.694 -6.331 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -9.579 8.615 -4.983 1.00 0.00 H new ATOM 561 N MET A 39 -6.133 5.762 -4.037 1.00 0.00 N ATOM 562 CA MET A 39 -4.815 5.223 -3.734 1.00 0.00 C ATOM 563 C MET A 39 -4.996 3.951 -2.909 1.00 0.00 C ATOM 564 O MET A 39 -4.373 2.934 -3.195 1.00 0.00 O ATOM 565 CB MET A 39 -4.065 6.318 -2.972 1.00 0.00 C ATOM 566 CG MET A 39 -2.571 6.142 -2.709 1.00 0.00 C ATOM 567 SD MET A 39 -1.874 7.692 -2.046 1.00 0.00 S ATOM 568 CE MET A 39 -0.100 7.338 -2.049 1.00 0.00 C ATOM 0 H MET A 39 -6.364 6.561 -3.446 1.00 0.00 H new ATOM 0 HA MET A 39 -4.244 4.953 -4.622 1.00 0.00 H new ATOM 0 HB2 MET A 39 -4.195 7.250 -3.521 1.00 0.00 H new ATOM 0 HB3 MET A 39 -4.557 6.445 -2.008 1.00 0.00 H new ATOM 0 HG2 MET A 39 -2.410 5.328 -2.002 1.00 0.00 H new ATOM 0 HG3 MET A 39 -2.060 5.868 -3.632 1.00 0.00 H new ATOM 0 HE1 MET A 39 0.435 8.158 -1.570 1.00 0.00 H new ATOM 0 HE2 MET A 39 0.087 6.414 -1.503 1.00 0.00 H new ATOM 0 HE3 MET A 39 0.248 7.229 -3.076 1.00 0.00 H new ATOM 578 N ALA A 40 -5.899 3.969 -1.925 1.00 0.00 N ATOM 579 CA ALA A 40 -6.185 2.830 -1.069 1.00 0.00 C ATOM 580 C ALA A 40 -6.639 1.639 -1.923 1.00 0.00 C ATOM 581 O ALA A 40 -6.164 0.519 -1.739 1.00 0.00 O ATOM 582 CB ALA A 40 -7.242 3.224 -0.036 1.00 0.00 C ATOM 0 H ALA A 40 -6.458 4.793 -1.702 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.285 2.528 -0.533 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.458 2.371 0.607 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.869 4.050 0.570 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -8.154 3.533 -0.548 1.00 0.00 H new ATOM 588 N LYS A 41 -7.513 1.876 -2.907 1.00 0.00 N ATOM 589 CA LYS A 41 -8.005 0.831 -3.804 1.00 0.00 C ATOM 590 C LYS A 41 -6.856 0.162 -4.550 1.00 0.00 C ATOM 591 O LYS A 41 -6.942 -1.038 -4.813 1.00 0.00 O ATOM 592 CB LYS A 41 -8.998 1.428 -4.805 1.00 0.00 C ATOM 593 CG LYS A 41 -10.368 1.611 -4.153 1.00 0.00 C ATOM 594 CD LYS A 41 -11.344 2.275 -5.124 1.00 0.00 C ATOM 595 CE LYS A 41 -12.677 2.527 -4.416 1.00 0.00 C ATOM 596 NZ LYS A 41 -13.777 2.732 -5.371 1.00 0.00 N ATOM 0 H LYS A 41 -7.898 2.800 -3.102 1.00 0.00 H new ATOM 0 HA LYS A 41 -8.507 0.074 -3.202 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.628 2.388 -5.165 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -9.086 0.775 -5.673 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.760 0.643 -3.841 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.270 2.220 -3.254 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.929 3.216 -5.487 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -11.497 1.638 -5.995 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.910 1.681 -3.770 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.587 3.403 -3.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.534 3.281 -4.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.424 3.250 -6.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -14.151 1.810 -5.672 1.00 0.00 H new ATOM 610 N ASN A 42 -5.811 0.919 -4.899 1.00 0.00 N ATOM 611 CA ASN A 42 -4.646 0.388 -5.599 1.00 0.00 C ATOM 612 C ASN A 42 -3.940 -0.607 -4.681 1.00 0.00 C ATOM 613 O ASN A 42 -3.581 -1.685 -5.145 1.00 0.00 O ATOM 614 CB ASN A 42 -3.685 1.502 -6.058 1.00 0.00 C ATOM 615 CG ASN A 42 -4.228 2.363 -7.185 1.00 0.00 C ATOM 616 OD1 ASN A 42 -5.333 2.164 -7.679 1.00 0.00 O ATOM 617 ND2 ASN A 42 -3.493 3.365 -7.622 1.00 0.00 N ATOM 0 H ASN A 42 -5.753 1.918 -4.702 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.979 -0.116 -6.506 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.453 2.141 -5.206 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -2.748 1.049 -6.381 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -3.844 3.968 -8.366 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.573 3.537 -7.217 1.00 0.00 H new ATOM 624 N ILE A 43 -3.770 -0.274 -3.392 1.00 0.00 N ATOM 625 CA ILE A 43 -3.128 -1.132 -2.388 1.00 0.00 C ATOM 626 C ILE A 43 -3.851 -2.485 -2.397 1.00 0.00 C ATOM 627 O ILE A 43 -3.243 -3.537 -2.615 1.00 0.00 O ATOM 628 CB ILE A 43 -3.122 -0.455 -0.983 1.00 0.00 C ATOM 629 CG1 ILE A 43 -2.413 0.918 -1.022 1.00 0.00 C ATOM 630 CG2 ILE A 43 -2.431 -1.355 0.038 1.00 0.00 C ATOM 631 CD1 ILE A 43 -2.423 1.738 0.274 1.00 0.00 C ATOM 0 H ILE A 43 -4.083 0.619 -3.012 1.00 0.00 H new ATOM 0 HA ILE A 43 -2.078 -1.290 -2.633 1.00 0.00 H new ATOM 0 HB ILE A 43 -4.160 -0.300 -0.689 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.375 0.756 -1.314 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -2.875 1.517 -1.807 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -2.435 -0.869 1.013 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -2.962 -2.305 0.104 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -1.402 -1.535 -0.273 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.894 2.678 0.114 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.453 1.946 0.565 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -1.929 1.174 1.065 1.00 0.00 H new ATOM 643 N LEU A 44 -5.177 -2.436 -2.240 1.00 0.00 N ATOM 644 CA LEU A 44 -6.048 -3.605 -2.210 1.00 0.00 C ATOM 645 C LEU A 44 -6.054 -4.417 -3.509 1.00 0.00 C ATOM 646 O LEU A 44 -6.523 -5.548 -3.483 1.00 0.00 O ATOM 647 CB LEU A 44 -7.502 -3.174 -1.937 1.00 0.00 C ATOM 648 CG LEU A 44 -7.753 -2.432 -0.616 1.00 0.00 C ATOM 649 CD1 LEU A 44 -9.224 -2.011 -0.555 1.00 0.00 C ATOM 650 CD2 LEU A 44 -7.404 -3.300 0.593 1.00 0.00 C ATOM 0 H LEU A 44 -5.683 -1.558 -2.128 1.00 0.00 H new ATOM 0 HA LEU A 44 -5.647 -4.237 -1.418 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.829 -2.534 -2.757 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.132 -4.063 -1.955 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.109 -1.553 -0.583 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.413 -1.483 0.380 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.450 -1.354 -1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -9.858 -2.896 -0.606 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -7.595 -2.741 1.509 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.017 -4.201 0.583 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.351 -3.578 0.550 1.00 0.00 H new ATOM 662 N ARG A 45 -5.558 -3.887 -4.632 1.00 0.00 N ATOM 663 CA ARG A 45 -5.561 -4.587 -5.920 1.00 0.00 C ATOM 664 C ARG A 45 -4.186 -5.072 -6.369 1.00 0.00 C ATOM 665 O ARG A 45 -4.101 -5.821 -7.346 1.00 0.00 O ATOM 666 CB ARG A 45 -6.210 -3.651 -6.947 1.00 0.00 C ATOM 667 CG ARG A 45 -6.872 -4.409 -8.099 1.00 0.00 C ATOM 668 CD ARG A 45 -7.799 -3.450 -8.842 1.00 0.00 C ATOM 669 NE ARG A 45 -8.541 -4.125 -9.912 1.00 0.00 N ATOM 670 CZ ARG A 45 -9.602 -3.604 -10.535 1.00 0.00 C ATOM 671 NH1 ARG A 45 -10.108 -2.435 -10.160 1.00 0.00 N ATOM 672 NH2 ARG A 45 -10.175 -4.238 -11.544 1.00 0.00 N ATOM 0 H ARG A 45 -5.142 -2.957 -4.673 1.00 0.00 H new ATOM 0 HA ARG A 45 -6.135 -5.508 -5.818 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -6.956 -3.032 -6.448 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.453 -2.977 -7.348 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -6.115 -4.805 -8.776 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -7.435 -5.261 -7.718 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -8.502 -3.006 -8.137 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -7.213 -2.634 -9.265 1.00 0.00 H new ATOM 0 HE ARG A 45 -8.227 -5.052 -10.199 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -9.686 -1.921 -9.386 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -10.918 -2.051 -10.646 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.808 -5.137 -11.856 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -10.984 -3.828 -12.010 1.00 0.00 H new ATOM 686 N GLU A 46 -3.124 -4.651 -5.693 1.00 0.00 N ATOM 687 CA GLU A 46 -1.752 -5.041 -5.998 1.00 0.00 C ATOM 688 C GLU A 46 -1.292 -6.099 -5.002 1.00 0.00 C ATOM 689 O GLU A 46 -0.566 -7.012 -5.392 1.00 0.00 O ATOM 690 CB GLU A 46 -0.846 -3.804 -5.934 1.00 0.00 C ATOM 691 CG GLU A 46 -0.857 -2.994 -7.240 1.00 0.00 C ATOM 692 CD GLU A 46 0.244 -3.394 -8.236 1.00 0.00 C ATOM 693 OE1 GLU A 46 0.630 -4.585 -8.331 1.00 0.00 O ATOM 694 OE2 GLU A 46 0.689 -2.519 -9.010 1.00 0.00 O ATOM 0 H GLU A 46 -3.194 -4.014 -4.899 1.00 0.00 H new ATOM 0 HA GLU A 46 -1.698 -5.462 -7.002 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.168 -3.165 -5.112 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.175 -4.117 -5.714 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -1.828 -3.113 -7.721 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -0.748 -1.936 -7.000 1.00 0.00 H new ATOM 701 N PHE A 47 -1.731 -6.015 -3.743 1.00 0.00 N ATOM 702 CA PHE A 47 -1.364 -6.950 -2.691 1.00 0.00 C ATOM 703 C PHE A 47 -2.520 -7.912 -2.415 1.00 0.00 C ATOM 704 O PHE A 47 -2.475 -9.062 -2.855 1.00 0.00 O ATOM 705 CB PHE A 47 -0.942 -6.154 -1.452 1.00 0.00 C ATOM 706 CG PHE A 47 0.366 -5.393 -1.597 1.00 0.00 C ATOM 707 CD1 PHE A 47 0.393 -4.056 -2.049 1.00 0.00 C ATOM 708 CD2 PHE A 47 1.562 -5.995 -1.171 1.00 0.00 C ATOM 709 CE1 PHE A 47 1.603 -3.345 -2.078 1.00 0.00 C ATOM 710 CE2 PHE A 47 2.769 -5.287 -1.196 1.00 0.00 C ATOM 711 CZ PHE A 47 2.787 -3.963 -1.650 1.00 0.00 C ATOM 0 H PHE A 47 -2.363 -5.279 -3.427 1.00 0.00 H new ATOM 0 HA PHE A 47 -0.518 -7.565 -2.998 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -1.733 -5.445 -1.206 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -0.855 -6.840 -0.609 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -0.520 -3.579 -2.373 1.00 0.00 H new ATOM 0 HD2 PHE A 47 1.550 -7.016 -0.820 1.00 0.00 H new ATOM 0 HE1 PHE A 47 1.622 -2.324 -2.429 1.00 0.00 H new ATOM 0 HE2 PHE A 47 3.682 -5.760 -0.867 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.717 -3.415 -1.671 1.00 0.00 H new ATOM 721 N SER A 48 -3.548 -7.438 -1.705 1.00 0.00 N ATOM 722 CA SER A 48 -4.749 -8.174 -1.321 1.00 0.00 C ATOM 723 C SER A 48 -5.559 -8.646 -2.543 1.00 0.00 C ATOM 724 O SER A 48 -5.227 -8.316 -3.687 1.00 0.00 O ATOM 725 CB SER A 48 -5.558 -7.271 -0.377 1.00 0.00 C ATOM 726 OG SER A 48 -4.752 -6.846 0.705 1.00 0.00 O ATOM 0 H SER A 48 -3.562 -6.476 -1.365 1.00 0.00 H new ATOM 0 HA SER A 48 -4.480 -9.094 -0.803 1.00 0.00 H new ATOM 0 HB2 SER A 48 -5.932 -6.405 -0.923 1.00 0.00 H new ATOM 0 HB3 SER A 48 -6.427 -7.811 -0.002 1.00 0.00 H new ATOM 0 HG SER A 48 -5.246 -6.958 1.544 1.00 0.00 H new ATOM 732 N GLY A 49 -6.625 -9.422 -2.317 1.00 0.00 N ATOM 733 CA GLY A 49 -7.470 -9.948 -3.384 1.00 0.00 C ATOM 734 C GLY A 49 -8.901 -10.248 -2.922 1.00 0.00 C ATOM 735 O GLY A 49 -9.228 -10.019 -1.754 1.00 0.00 O ATOM 0 H GLY A 49 -6.923 -9.702 -1.383 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -7.502 -9.229 -4.203 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -7.022 -10.860 -3.778 1.00 0.00 H new ATOM 739 N PRO A 50 -9.764 -10.714 -3.845 1.00 0.00 N ATOM 740 CA PRO A 50 -11.159 -11.052 -3.574 1.00 0.00 C ATOM 741 C PRO A 50 -11.286 -12.343 -2.745 1.00 0.00 C ATOM 742 O PRO A 50 -10.289 -12.992 -2.440 1.00 0.00 O ATOM 743 CB PRO A 50 -11.803 -11.172 -4.961 1.00 0.00 C ATOM 744 CG PRO A 50 -10.661 -11.685 -5.829 1.00 0.00 C ATOM 745 CD PRO A 50 -9.434 -10.995 -5.237 1.00 0.00 C ATOM 0 HA PRO A 50 -11.658 -10.297 -2.967 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -12.647 -11.862 -4.955 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -12.179 -10.212 -5.315 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -10.575 -12.771 -5.780 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.803 -11.423 -6.877 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -8.554 -11.635 -5.308 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.204 -10.076 -5.777 1.00 0.00 H new ATOM 753 N SER A 51 -12.510 -12.749 -2.404 1.00 0.00 N ATOM 754 CA SER A 51 -12.787 -13.944 -1.609 1.00 0.00 C ATOM 755 C SER A 51 -14.065 -14.619 -2.123 1.00 0.00 C ATOM 756 O SER A 51 -14.508 -14.334 -3.241 1.00 0.00 O ATOM 757 CB SER A 51 -12.879 -13.486 -0.143 1.00 0.00 C ATOM 758 OG SER A 51 -12.874 -14.556 0.781 1.00 0.00 O ATOM 0 H SER A 51 -13.353 -12.245 -2.679 1.00 0.00 H new ATOM 0 HA SER A 51 -12.003 -14.697 -1.691 1.00 0.00 H new ATOM 0 HB2 SER A 51 -12.042 -12.823 0.076 1.00 0.00 H new ATOM 0 HB3 SER A 51 -13.791 -12.904 -0.009 1.00 0.00 H new ATOM 0 HG SER A 51 -12.933 -14.201 1.693 1.00 0.00 H new ATOM 764 N SER A 52 -14.576 -15.595 -1.381 1.00 0.00 N ATOM 765 CA SER A 52 -15.784 -16.370 -1.625 1.00 0.00 C ATOM 766 C SER A 52 -16.304 -16.795 -0.244 1.00 0.00 C ATOM 767 O SER A 52 -15.518 -16.831 0.709 1.00 0.00 O ATOM 768 CB SER A 52 -15.531 -17.546 -2.578 1.00 0.00 C ATOM 769 OG SER A 52 -14.409 -18.334 -2.219 1.00 0.00 O ATOM 0 H SER A 52 -14.115 -15.888 -0.520 1.00 0.00 H new ATOM 0 HA SER A 52 -16.542 -15.780 -2.140 1.00 0.00 H new ATOM 0 HB2 SER A 52 -16.417 -18.180 -2.603 1.00 0.00 H new ATOM 0 HB3 SER A 52 -15.386 -17.161 -3.587 1.00 0.00 H new ATOM 0 HG SER A 52 -14.303 -19.065 -2.863 1.00 0.00 H new ATOM 775 N GLY A 53 -17.583 -17.161 -0.122 1.00 0.00 N ATOM 776 CA GLY A 53 -18.146 -17.566 1.162 1.00 0.00 C ATOM 777 C GLY A 53 -18.415 -16.360 2.045 1.00 0.00 C ATOM 778 O GLY A 53 -18.027 -15.221 1.696 1.00 0.00 O ATOM 0 H GLY A 53 -18.245 -17.184 -0.898 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -19.073 -18.116 0.999 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -17.458 -18.244 1.667 1.00 0.00 H new TER 782 GLY A 53 ATOM 783 N GLY B 1 12.074 8.654 8.900 1.00 0.00 N ATOM 784 CA GLY B 1 13.100 9.456 8.213 1.00 0.00 C ATOM 785 C GLY B 1 14.453 9.399 8.908 1.00 0.00 C ATOM 786 O GLY B 1 14.578 8.861 10.013 1.00 0.00 O ATOM 0 H1 GLY B 1 11.214 8.617 8.316 1.00 0.00 H new ATOM 0 H2 GLY B 1 12.431 7.689 9.051 1.00 0.00 H new ATOM 0 H3 GLY B 1 11.851 9.089 9.818 1.00 0.00 H new ATOM 0 HA2 GLY B 1 13.207 9.100 7.188 1.00 0.00 H new ATOM 0 HA3 GLY B 1 12.768 10.493 8.158 1.00 0.00 H new ATOM 790 N SER B 2 15.498 9.917 8.256 1.00 0.00 N ATOM 791 CA SER B 2 16.857 9.966 8.774 1.00 0.00 C ATOM 792 C SER B 2 17.568 11.162 8.121 1.00 0.00 C ATOM 793 O SER B 2 18.151 11.025 7.044 1.00 0.00 O ATOM 794 CB SER B 2 17.547 8.612 8.519 1.00 0.00 C ATOM 795 OG SER B 2 18.466 8.313 9.555 1.00 0.00 O ATOM 0 H SER B 2 15.413 10.325 7.325 1.00 0.00 H new ATOM 0 HA SER B 2 16.884 10.119 9.853 1.00 0.00 H new ATOM 0 HB2 SER B 2 16.797 7.823 8.453 1.00 0.00 H new ATOM 0 HB3 SER B 2 18.067 8.638 7.562 1.00 0.00 H new ATOM 0 HG SER B 2 18.892 7.449 9.375 1.00 0.00 H new ATOM 801 N SER B 3 17.510 12.333 8.759 1.00 0.00 N ATOM 802 CA SER B 3 18.119 13.571 8.279 1.00 0.00 C ATOM 803 C SER B 3 19.636 13.420 8.121 1.00 0.00 C ATOM 804 O SER B 3 20.326 12.917 9.015 1.00 0.00 O ATOM 805 CB SER B 3 17.769 14.701 9.255 1.00 0.00 C ATOM 806 OG SER B 3 18.134 15.974 8.760 1.00 0.00 O ATOM 0 H SER B 3 17.024 12.447 9.648 1.00 0.00 H new ATOM 0 HA SER B 3 17.724 13.811 7.292 1.00 0.00 H new ATOM 0 HB2 SER B 3 16.698 14.686 9.455 1.00 0.00 H new ATOM 0 HB3 SER B 3 18.273 14.526 10.205 1.00 0.00 H new ATOM 0 HG SER B 3 17.890 16.662 9.414 1.00 0.00 H new ATOM 812 N GLY B 4 20.172 13.916 7.008 1.00 0.00 N ATOM 813 CA GLY B 4 21.577 13.908 6.618 1.00 0.00 C ATOM 814 C GLY B 4 21.655 14.259 5.133 1.00 0.00 C ATOM 815 O GLY B 4 20.632 14.627 4.552 1.00 0.00 O ATOM 0 H GLY B 4 19.590 14.368 6.303 1.00 0.00 H new ATOM 0 HA2 GLY B 4 22.141 14.628 7.210 1.00 0.00 H new ATOM 0 HA3 GLY B 4 22.018 12.928 6.802 1.00 0.00 H new ATOM 819 N SER B 5 22.840 14.204 4.518 1.00 0.00 N ATOM 820 CA SER B 5 23.001 14.501 3.096 1.00 0.00 C ATOM 821 C SER B 5 22.201 13.442 2.327 1.00 0.00 C ATOM 822 O SER B 5 22.644 12.294 2.241 1.00 0.00 O ATOM 823 CB SER B 5 24.487 14.529 2.711 1.00 0.00 C ATOM 824 OG SER B 5 25.163 13.343 3.109 1.00 0.00 O ATOM 0 H SER B 5 23.709 13.954 4.991 1.00 0.00 H new ATOM 0 HA SER B 5 22.621 15.491 2.846 1.00 0.00 H new ATOM 0 HB2 SER B 5 24.580 14.654 1.632 1.00 0.00 H new ATOM 0 HB3 SER B 5 24.965 15.392 3.174 1.00 0.00 H new ATOM 0 HG SER B 5 24.572 12.572 2.984 1.00 0.00 H new ATOM 830 N SER B 6 21.032 13.817 1.823 1.00 0.00 N ATOM 831 CA SER B 6 20.127 12.947 1.093 1.00 0.00 C ATOM 832 C SER B 6 20.756 12.347 -0.168 1.00 0.00 C ATOM 833 O SER B 6 21.714 12.899 -0.724 1.00 0.00 O ATOM 834 CB SER B 6 18.804 13.692 0.839 1.00 0.00 C ATOM 835 OG SER B 6 18.945 15.112 0.800 1.00 0.00 O ATOM 0 H SER B 6 20.678 14.769 1.916 1.00 0.00 H new ATOM 0 HA SER B 6 19.907 12.074 1.707 1.00 0.00 H new ATOM 0 HB2 SER B 6 18.381 13.351 -0.106 1.00 0.00 H new ATOM 0 HB3 SER B 6 18.092 13.427 1.621 1.00 0.00 H new ATOM 0 HG SER B 6 18.071 15.523 0.634 1.00 0.00 H new ATOM 841 N GLY B 7 20.203 11.222 -0.621 1.00 0.00 N ATOM 842 CA GLY B 7 20.647 10.485 -1.795 1.00 0.00 C ATOM 843 C GLY B 7 19.499 9.699 -2.429 1.00 0.00 C ATOM 844 O GLY B 7 18.329 9.876 -2.063 1.00 0.00 O ATOM 0 H GLY B 7 19.404 10.786 -0.160 1.00 0.00 H new ATOM 0 HA2 GLY B 7 21.062 11.179 -2.526 1.00 0.00 H new ATOM 0 HA3 GLY B 7 21.448 9.800 -1.515 1.00 0.00 H new ATOM 848 N GLN B 8 19.836 8.851 -3.403 1.00 0.00 N ATOM 849 CA GLN B 8 18.907 8.008 -4.146 1.00 0.00 C ATOM 850 C GLN B 8 18.065 7.154 -3.204 1.00 0.00 C ATOM 851 O GLN B 8 18.586 6.473 -2.318 1.00 0.00 O ATOM 852 CB GLN B 8 19.652 7.090 -5.130 1.00 0.00 C ATOM 853 CG GLN B 8 19.659 7.622 -6.565 1.00 0.00 C ATOM 854 CD GLN B 8 20.724 8.686 -6.767 1.00 0.00 C ATOM 855 OE1 GLN B 8 20.470 9.872 -6.595 1.00 0.00 O ATOM 856 NE2 GLN B 8 21.929 8.280 -7.139 1.00 0.00 N ATOM 0 H GLN B 8 20.803 8.731 -3.705 1.00 0.00 H new ATOM 0 HA GLN B 8 18.252 8.674 -4.707 1.00 0.00 H new ATOM 0 HB2 GLN B 8 20.680 6.964 -4.791 1.00 0.00 H new ATOM 0 HB3 GLN B 8 19.189 6.103 -5.118 1.00 0.00 H new ATOM 0 HG2 GLN B 8 19.832 6.798 -7.257 1.00 0.00 H new ATOM 0 HG3 GLN B 8 18.680 8.038 -6.803 1.00 0.00 H new ATOM 0 HE21 GLN B 8 22.113 7.286 -7.275 1.00 0.00 H new ATOM 0 HE22 GLN B 8 22.673 8.961 -7.289 1.00 0.00 H new ATOM 865 N LEU B 9 16.756 7.154 -3.449 1.00 0.00 N ATOM 866 CA LEU B 9 15.766 6.416 -2.675 1.00 0.00 C ATOM 867 C LEU B 9 15.859 4.902 -2.886 1.00 0.00 C ATOM 868 O LEU B 9 15.191 4.138 -2.186 1.00 0.00 O ATOM 869 CB LEU B 9 14.375 6.973 -3.035 1.00 0.00 C ATOM 870 CG LEU B 9 13.363 6.933 -1.876 1.00 0.00 C ATOM 871 CD1 LEU B 9 13.823 7.795 -0.696 1.00 0.00 C ATOM 872 CD2 LEU B 9 12.029 7.483 -2.383 1.00 0.00 C ATOM 0 H LEU B 9 16.345 7.685 -4.216 1.00 0.00 H new ATOM 0 HA LEU B 9 15.958 6.558 -1.611 1.00 0.00 H new ATOM 0 HB2 LEU B 9 14.484 8.004 -3.372 1.00 0.00 H new ATOM 0 HB3 LEU B 9 13.973 6.404 -3.874 1.00 0.00 H new ATOM 0 HG LEU B 9 13.270 5.902 -1.534 1.00 0.00 H new ATOM 0 HD11 LEU B 9 13.084 7.742 0.103 1.00 0.00 H new ATOM 0 HD12 LEU B 9 14.781 7.427 -0.329 1.00 0.00 H new ATOM 0 HD13 LEU B 9 13.932 8.829 -1.022 1.00 0.00 H new ATOM 0 HD21 LEU B 9 11.297 7.463 -1.576 1.00 0.00 H new ATOM 0 HD22 LEU B 9 12.165 8.509 -2.725 1.00 0.00 H new ATOM 0 HD23 LEU B 9 11.673 6.869 -3.210 1.00 0.00 H new ATOM 884 N SER B 10 16.642 4.435 -3.861 1.00 0.00 N ATOM 885 CA SER B 10 16.820 3.019 -4.147 1.00 0.00 C ATOM 886 C SER B 10 17.619 2.325 -3.046 1.00 0.00 C ATOM 887 O SER B 10 17.409 1.132 -2.823 1.00 0.00 O ATOM 888 CB SER B 10 17.477 2.823 -5.521 1.00 0.00 C ATOM 889 OG SER B 10 18.426 3.839 -5.793 1.00 0.00 O ATOM 0 H SER B 10 17.176 5.044 -4.481 1.00 0.00 H new ATOM 0 HA SER B 10 15.834 2.554 -4.174 1.00 0.00 H new ATOM 0 HB2 SER B 10 17.965 1.849 -5.556 1.00 0.00 H new ATOM 0 HB3 SER B 10 16.710 2.823 -6.295 1.00 0.00 H new ATOM 0 HG SER B 10 18.827 3.685 -6.674 1.00 0.00 H new ATOM 895 N SER B 11 18.459 3.054 -2.300 1.00 0.00 N ATOM 896 CA SER B 11 19.257 2.462 -1.235 1.00 0.00 C ATOM 897 C SER B 11 18.387 1.860 -0.121 1.00 0.00 C ATOM 898 O SER B 11 18.871 1.041 0.662 1.00 0.00 O ATOM 899 CB SER B 11 20.195 3.514 -0.627 1.00 0.00 C ATOM 900 OG SER B 11 20.711 4.465 -1.551 1.00 0.00 O ATOM 0 H SER B 11 18.599 4.057 -2.420 1.00 0.00 H new ATOM 0 HA SER B 11 19.837 1.656 -1.684 1.00 0.00 H new ATOM 0 HB2 SER B 11 19.659 4.047 0.158 1.00 0.00 H new ATOM 0 HB3 SER B 11 21.031 3.002 -0.151 1.00 0.00 H new ATOM 0 HG SER B 11 20.052 5.177 -1.690 1.00 0.00 H new ATOM 906 N GLU B 12 17.122 2.268 -0.008 1.00 0.00 N ATOM 907 CA GLU B 12 16.173 1.796 0.996 1.00 0.00 C ATOM 908 C GLU B 12 15.473 0.506 0.531 1.00 0.00 C ATOM 909 O GLU B 12 14.995 -0.264 1.362 1.00 0.00 O ATOM 910 CB GLU B 12 15.143 2.911 1.219 1.00 0.00 C ATOM 911 CG GLU B 12 15.689 4.171 1.916 1.00 0.00 C ATOM 912 CD GLU B 12 15.379 4.209 3.414 1.00 0.00 C ATOM 913 OE1 GLU B 12 15.314 3.149 4.080 1.00 0.00 O ATOM 914 OE2 GLU B 12 15.108 5.309 3.949 1.00 0.00 O ATOM 0 H GLU B 12 16.718 2.962 -0.637 1.00 0.00 H new ATOM 0 HA GLU B 12 16.696 1.563 1.924 1.00 0.00 H new ATOM 0 HB2 GLU B 12 14.727 3.199 0.254 1.00 0.00 H new ATOM 0 HB3 GLU B 12 14.321 2.512 1.814 1.00 0.00 H new ATOM 0 HG2 GLU B 12 16.768 4.219 1.773 1.00 0.00 H new ATOM 0 HG3 GLU B 12 15.264 5.055 1.440 1.00 0.00 H new ATOM 921 N ILE B 13 15.403 0.244 -0.783 1.00 0.00 N ATOM 922 CA ILE B 13 14.776 -0.958 -1.350 1.00 0.00 C ATOM 923 C ILE B 13 15.550 -2.160 -0.807 1.00 0.00 C ATOM 924 O ILE B 13 14.979 -3.121 -0.300 1.00 0.00 O ATOM 925 CB ILE B 13 14.813 -0.909 -2.903 1.00 0.00 C ATOM 926 CG1 ILE B 13 14.036 0.318 -3.432 1.00 0.00 C ATOM 927 CG2 ILE B 13 14.277 -2.192 -3.574 1.00 0.00 C ATOM 928 CD1 ILE B 13 14.232 0.561 -4.932 1.00 0.00 C ATOM 0 H ILE B 13 15.786 0.871 -1.491 1.00 0.00 H new ATOM 0 HA ILE B 13 13.726 -1.028 -1.066 1.00 0.00 H new ATOM 0 HB ILE B 13 15.866 -0.826 -3.171 1.00 0.00 H new ATOM 0 HG12 ILE B 13 12.974 0.181 -3.229 1.00 0.00 H new ATOM 0 HG13 ILE B 13 14.354 1.204 -2.883 1.00 0.00 H new ATOM 0 HG21 ILE B 13 14.333 -2.087 -4.657 1.00 0.00 H new ATOM 0 HG22 ILE B 13 14.879 -3.045 -3.261 1.00 0.00 H new ATOM 0 HG23 ILE B 13 13.240 -2.351 -3.278 1.00 0.00 H new ATOM 0 HD11 ILE B 13 13.659 1.437 -5.237 1.00 0.00 H new ATOM 0 HD12 ILE B 13 15.289 0.729 -5.138 1.00 0.00 H new ATOM 0 HD13 ILE B 13 13.888 -0.310 -5.490 1.00 0.00 H new ATOM 940 N GLU B 14 16.877 -2.069 -0.878 1.00 0.00 N ATOM 941 CA GLU B 14 17.802 -3.097 -0.424 1.00 0.00 C ATOM 942 C GLU B 14 17.650 -3.370 1.074 1.00 0.00 C ATOM 943 O GLU B 14 17.926 -4.478 1.535 1.00 0.00 O ATOM 944 CB GLU B 14 19.227 -2.622 -0.706 1.00 0.00 C ATOM 945 CG GLU B 14 19.496 -2.373 -2.196 1.00 0.00 C ATOM 946 CD GLU B 14 20.829 -1.654 -2.337 1.00 0.00 C ATOM 947 OE1 GLU B 14 21.870 -2.288 -2.093 1.00 0.00 O ATOM 948 OE2 GLU B 14 20.803 -0.420 -2.578 1.00 0.00 O ATOM 0 H GLU B 14 17.349 -1.252 -1.265 1.00 0.00 H new ATOM 0 HA GLU B 14 17.584 -4.023 -0.957 1.00 0.00 H new ATOM 0 HB2 GLU B 14 19.413 -1.703 -0.151 1.00 0.00 H new ATOM 0 HB3 GLU B 14 19.932 -3.367 -0.335 1.00 0.00 H new ATOM 0 HG2 GLU B 14 19.517 -3.318 -2.739 1.00 0.00 H new ATOM 0 HG3 GLU B 14 18.696 -1.774 -2.630 1.00 0.00 H new ATOM 955 N ARG B 15 17.245 -2.369 1.860 1.00 0.00 N ATOM 956 CA ARG B 15 17.074 -2.553 3.299 1.00 0.00 C ATOM 957 C ARG B 15 15.872 -3.462 3.522 1.00 0.00 C ATOM 958 O ARG B 15 15.942 -4.395 4.324 1.00 0.00 O ATOM 959 CB ARG B 15 16.935 -1.193 4.011 1.00 0.00 C ATOM 960 CG ARG B 15 18.167 -0.294 3.813 1.00 0.00 C ATOM 961 CD ARG B 15 19.400 -0.778 4.588 1.00 0.00 C ATOM 962 NE ARG B 15 20.641 -0.528 3.839 1.00 0.00 N ATOM 963 CZ ARG B 15 21.874 -0.927 4.175 1.00 0.00 C ATOM 964 NH1 ARG B 15 22.095 -1.575 5.310 1.00 0.00 N ATOM 965 NH2 ARG B 15 22.869 -0.683 3.338 1.00 0.00 N ATOM 0 H ARG B 15 17.031 -1.430 1.525 1.00 0.00 H new ATOM 0 HA ARG B 15 17.953 -3.028 3.734 1.00 0.00 H new ATOM 0 HB2 ARG B 15 16.050 -0.679 3.635 1.00 0.00 H new ATOM 0 HB3 ARG B 15 16.778 -1.359 5.077 1.00 0.00 H new ATOM 0 HG2 ARG B 15 18.408 -0.248 2.751 1.00 0.00 H new ATOM 0 HG3 ARG B 15 17.923 0.720 4.128 1.00 0.00 H new ATOM 0 HD2 ARG B 15 19.447 -0.271 5.552 1.00 0.00 H new ATOM 0 HD3 ARG B 15 19.306 -1.844 4.793 1.00 0.00 H new ATOM 0 HE ARG B 15 20.553 0.005 2.974 1.00 0.00 H new ATOM 0 HH11 ARG B 15 21.320 -1.776 5.942 1.00 0.00 H new ATOM 0 HH12 ARG B 15 23.040 -1.872 5.552 1.00 0.00 H new ATOM 0 HH21 ARG B 15 22.688 -0.200 2.458 1.00 0.00 H new ATOM 0 HH22 ARG B 15 23.817 -0.978 3.573 1.00 0.00 H new ATOM 979 N LEU B 16 14.789 -3.214 2.786 1.00 0.00 N ATOM 980 CA LEU B 16 13.559 -3.986 2.873 1.00 0.00 C ATOM 981 C LEU B 16 13.768 -5.416 2.382 1.00 0.00 C ATOM 982 O LEU B 16 13.088 -6.311 2.881 1.00 0.00 O ATOM 983 CB LEU B 16 12.422 -3.274 2.135 1.00 0.00 C ATOM 984 CG LEU B 16 11.923 -2.059 2.939 1.00 0.00 C ATOM 985 CD1 LEU B 16 11.246 -1.062 2.006 1.00 0.00 C ATOM 986 CD2 LEU B 16 10.961 -2.491 4.054 1.00 0.00 C ATOM 0 H LEU B 16 14.745 -2.458 2.103 1.00 0.00 H new ATOM 0 HA LEU B 16 13.268 -4.057 3.921 1.00 0.00 H new ATOM 0 HB2 LEU B 16 12.767 -2.949 1.153 1.00 0.00 H new ATOM 0 HB3 LEU B 16 11.599 -3.969 1.969 1.00 0.00 H new ATOM 0 HG LEU B 16 12.782 -1.580 3.408 1.00 0.00 H new ATOM 0 HD11 LEU B 16 10.896 -0.205 2.582 1.00 0.00 H new ATOM 0 HD12 LEU B 16 11.959 -0.726 1.253 1.00 0.00 H new ATOM 0 HD13 LEU B 16 10.399 -1.541 1.515 1.00 0.00 H new ATOM 0 HD21 LEU B 16 10.625 -1.613 4.605 1.00 0.00 H new ATOM 0 HD22 LEU B 16 10.100 -2.996 3.616 1.00 0.00 H new ATOM 0 HD23 LEU B 16 11.474 -3.171 4.734 1.00 0.00 H new ATOM 998 N MET B 17 14.719 -5.661 1.474 1.00 0.00 N ATOM 999 CA MET B 17 14.990 -7.017 0.998 1.00 0.00 C ATOM 1000 C MET B 17 15.432 -7.861 2.195 1.00 0.00 C ATOM 1001 O MET B 17 14.973 -8.987 2.362 1.00 0.00 O ATOM 1002 CB MET B 17 16.072 -7.014 -0.088 1.00 0.00 C ATOM 1003 CG MET B 17 15.544 -6.425 -1.393 1.00 0.00 C ATOM 1004 SD MET B 17 16.816 -6.128 -2.648 1.00 0.00 S ATOM 1005 CE MET B 17 15.716 -6.112 -4.079 1.00 0.00 C ATOM 0 H MET B 17 15.309 -4.941 1.058 1.00 0.00 H new ATOM 0 HA MET B 17 14.088 -7.438 0.553 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.931 -6.437 0.253 1.00 0.00 H new ATOM 0 HB3 MET B 17 16.420 -8.032 -0.260 1.00 0.00 H new ATOM 0 HG2 MET B 17 14.795 -7.101 -1.805 1.00 0.00 H new ATOM 0 HG3 MET B 17 15.039 -5.484 -1.175 1.00 0.00 H new ATOM 0 HE1 MET B 17 15.890 -7.004 -4.682 1.00 0.00 H new ATOM 0 HE2 MET B 17 14.680 -6.099 -3.741 1.00 0.00 H new ATOM 0 HE3 MET B 17 15.913 -5.224 -4.680 1.00 0.00 H new ATOM 1015 N SER B 18 16.299 -7.308 3.057 1.00 0.00 N ATOM 1016 CA SER B 18 16.760 -8.031 4.237 1.00 0.00 C ATOM 1017 C SER B 18 15.643 -8.130 5.286 1.00 0.00 C ATOM 1018 O SER B 18 15.705 -8.988 6.165 1.00 0.00 O ATOM 1019 CB SER B 18 18.038 -7.390 4.799 1.00 0.00 C ATOM 1020 OG SER B 18 18.666 -8.228 5.757 1.00 0.00 O ATOM 0 H SER B 18 16.688 -6.371 2.955 1.00 0.00 H new ATOM 0 HA SER B 18 17.014 -9.051 3.948 1.00 0.00 H new ATOM 0 HB2 SER B 18 18.732 -7.185 3.984 1.00 0.00 H new ATOM 0 HB3 SER B 18 17.794 -6.432 5.258 1.00 0.00 H new ATOM 0 HG SER B 18 17.982 -8.698 6.278 1.00 0.00 H new ATOM 1026 N GLN B 19 14.629 -7.257 5.246 1.00 0.00 N ATOM 1027 CA GLN B 19 13.506 -7.287 6.183 1.00 0.00 C ATOM 1028 C GLN B 19 12.555 -8.451 5.862 1.00 0.00 C ATOM 1029 O GLN B 19 11.589 -8.648 6.598 1.00 0.00 O ATOM 1030 CB GLN B 19 12.761 -5.942 6.181 1.00 0.00 C ATOM 1031 CG GLN B 19 13.552 -4.804 6.839 1.00 0.00 C ATOM 1032 CD GLN B 19 13.539 -4.858 8.366 1.00 0.00 C ATOM 1033 OE1 GLN B 19 13.151 -5.843 8.991 1.00 0.00 O ATOM 1034 NE2 GLN B 19 13.970 -3.789 9.012 1.00 0.00 N ATOM 0 H GLN B 19 14.567 -6.507 4.558 1.00 0.00 H new ATOM 0 HA GLN B 19 13.902 -7.450 7.186 1.00 0.00 H new ATOM 0 HB2 GLN B 19 12.529 -5.665 5.152 1.00 0.00 H new ATOM 0 HB3 GLN B 19 11.810 -6.061 6.701 1.00 0.00 H new ATOM 0 HG2 GLN B 19 14.584 -4.840 6.491 1.00 0.00 H new ATOM 0 HG3 GLN B 19 13.139 -3.849 6.513 1.00 0.00 H new ATOM 0 HE21 GLN B 19 14.291 -2.973 8.491 1.00 0.00 H new ATOM 0 HE22 GLN B 19 13.981 -3.780 10.032 1.00 0.00 H new ATOM 1043 N GLY B 20 12.815 -9.208 4.789 1.00 0.00 N ATOM 1044 CA GLY B 20 12.029 -10.351 4.365 1.00 0.00 C ATOM 1045 C GLY B 20 11.019 -10.043 3.272 1.00 0.00 C ATOM 1046 O GLY B 20 10.296 -10.951 2.863 1.00 0.00 O ATOM 0 H GLY B 20 13.610 -9.027 4.176 1.00 0.00 H new ATOM 0 HA2 GLY B 20 12.704 -11.130 4.011 1.00 0.00 H new ATOM 0 HA3 GLY B 20 11.501 -10.755 5.229 1.00 0.00 H new ATOM 1050 N TYR B 21 10.931 -8.796 2.812 1.00 0.00 N ATOM 1051 CA TYR B 21 9.991 -8.406 1.773 1.00 0.00 C ATOM 1052 C TYR B 21 10.558 -8.753 0.403 1.00 0.00 C ATOM 1053 O TYR B 21 11.742 -8.526 0.139 1.00 0.00 O ATOM 1054 CB TYR B 21 9.691 -6.910 1.892 1.00 0.00 C ATOM 1055 CG TYR B 21 9.022 -6.550 3.202 1.00 0.00 C ATOM 1056 CD1 TYR B 21 7.722 -7.015 3.455 1.00 0.00 C ATOM 1057 CD2 TYR B 21 9.687 -5.779 4.174 1.00 0.00 C ATOM 1058 CE1 TYR B 21 7.075 -6.682 4.652 1.00 0.00 C ATOM 1059 CE2 TYR B 21 9.046 -5.448 5.384 1.00 0.00 C ATOM 1060 CZ TYR B 21 7.724 -5.888 5.618 1.00 0.00 C ATOM 1061 OH TYR B 21 7.032 -5.500 6.724 1.00 0.00 O ATOM 0 H TYR B 21 11.512 -8.030 3.152 1.00 0.00 H new ATOM 0 HA TYR B 21 9.056 -8.953 1.895 1.00 0.00 H new ATOM 0 HB2 TYR B 21 10.621 -6.349 1.797 1.00 0.00 H new ATOM 0 HB3 TYR B 21 9.049 -6.606 1.065 1.00 0.00 H new ATOM 0 HD1 TYR B 21 7.219 -7.631 2.725 1.00 0.00 H new ATOM 0 HD2 TYR B 21 10.696 -5.439 3.991 1.00 0.00 H new ATOM 0 HE1 TYR B 21 6.071 -7.036 4.836 1.00 0.00 H new ATOM 0 HE2 TYR B 21 9.563 -4.861 6.129 1.00 0.00 H new ATOM 0 HH TYR B 21 6.100 -5.321 6.481 1.00 0.00 H new ATOM 1071 N SER B 22 9.735 -9.338 -0.466 1.00 0.00 N ATOM 1072 CA SER B 22 10.158 -9.696 -1.812 1.00 0.00 C ATOM 1073 C SER B 22 10.221 -8.431 -2.667 1.00 0.00 C ATOM 1074 O SER B 22 9.450 -7.496 -2.445 1.00 0.00 O ATOM 1075 CB SER B 22 9.183 -10.707 -2.403 1.00 0.00 C ATOM 1076 OG SER B 22 9.115 -11.851 -1.575 1.00 0.00 O ATOM 0 H SER B 22 8.765 -9.574 -0.256 1.00 0.00 H new ATOM 0 HA SER B 22 11.147 -10.153 -1.787 1.00 0.00 H new ATOM 0 HB2 SER B 22 8.194 -10.258 -2.500 1.00 0.00 H new ATOM 0 HB3 SER B 22 9.503 -10.991 -3.405 1.00 0.00 H new ATOM 0 HG SER B 22 8.485 -12.496 -1.959 1.00 0.00 H new ATOM 1082 N TYR B 23 11.076 -8.425 -3.691 1.00 0.00 N ATOM 1083 CA TYR B 23 11.249 -7.285 -4.585 1.00 0.00 C ATOM 1084 C TYR B 23 9.921 -6.752 -5.132 1.00 0.00 C ATOM 1085 O TYR B 23 9.729 -5.540 -5.180 1.00 0.00 O ATOM 1086 CB TYR B 23 12.189 -7.674 -5.732 1.00 0.00 C ATOM 1087 CG TYR B 23 12.419 -6.543 -6.716 1.00 0.00 C ATOM 1088 CD1 TYR B 23 13.069 -5.373 -6.286 1.00 0.00 C ATOM 1089 CD2 TYR B 23 11.930 -6.624 -8.033 1.00 0.00 C ATOM 1090 CE1 TYR B 23 13.276 -4.304 -7.169 1.00 0.00 C ATOM 1091 CE2 TYR B 23 12.106 -5.546 -8.918 1.00 0.00 C ATOM 1092 CZ TYR B 23 12.790 -4.383 -8.489 1.00 0.00 C ATOM 1093 OH TYR B 23 12.985 -3.333 -9.328 1.00 0.00 O ATOM 0 H TYR B 23 11.672 -9.220 -3.923 1.00 0.00 H new ATOM 0 HA TYR B 23 11.688 -6.474 -4.004 1.00 0.00 H new ATOM 0 HB2 TYR B 23 13.147 -7.990 -5.319 1.00 0.00 H new ATOM 0 HB3 TYR B 23 11.772 -8.531 -6.262 1.00 0.00 H new ATOM 0 HD1 TYR B 23 13.412 -5.297 -5.265 1.00 0.00 H new ATOM 0 HD2 TYR B 23 11.419 -7.516 -8.364 1.00 0.00 H new ATOM 0 HE1 TYR B 23 13.806 -3.423 -6.839 1.00 0.00 H new ATOM 0 HE2 TYR B 23 11.720 -5.605 -9.925 1.00 0.00 H new ATOM 0 HH TYR B 23 12.595 -3.537 -10.203 1.00 0.00 H new ATOM 1103 N GLN B 24 9.013 -7.646 -5.530 1.00 0.00 N ATOM 1104 CA GLN B 24 7.715 -7.275 -6.079 1.00 0.00 C ATOM 1105 C GLN B 24 6.936 -6.444 -5.069 1.00 0.00 C ATOM 1106 O GLN B 24 6.502 -5.343 -5.391 1.00 0.00 O ATOM 1107 CB GLN B 24 6.897 -8.513 -6.469 1.00 0.00 C ATOM 1108 CG GLN B 24 7.606 -9.451 -7.455 1.00 0.00 C ATOM 1109 CD GLN B 24 8.644 -10.354 -6.786 1.00 0.00 C ATOM 1110 OE1 GLN B 24 8.581 -10.651 -5.597 1.00 0.00 O ATOM 1111 NE2 GLN B 24 9.647 -10.795 -7.516 1.00 0.00 N ATOM 0 H GLN B 24 9.163 -8.654 -5.478 1.00 0.00 H new ATOM 0 HA GLN B 24 7.891 -6.685 -6.978 1.00 0.00 H new ATOM 0 HB2 GLN B 24 6.652 -9.072 -5.566 1.00 0.00 H new ATOM 0 HB3 GLN B 24 5.954 -8.188 -6.908 1.00 0.00 H new ATOM 0 HG2 GLN B 24 6.862 -10.071 -7.955 1.00 0.00 H new ATOM 0 HG3 GLN B 24 8.095 -8.855 -8.226 1.00 0.00 H new ATOM 0 HE21 GLN B 24 9.704 -10.551 -8.505 1.00 0.00 H new ATOM 0 HE22 GLN B 24 10.367 -11.381 -7.093 1.00 0.00 H new ATOM 1120 N ASP B 25 6.780 -6.957 -3.848 1.00 0.00 N ATOM 1121 CA ASP B 25 6.062 -6.309 -2.757 1.00 0.00 C ATOM 1122 C ASP B 25 6.658 -4.924 -2.522 1.00 0.00 C ATOM 1123 O ASP B 25 5.930 -3.935 -2.434 1.00 0.00 O ATOM 1124 CB ASP B 25 6.129 -7.160 -1.470 1.00 0.00 C ATOM 1125 CG ASP B 25 5.246 -8.409 -1.514 1.00 0.00 C ATOM 1126 OD1 ASP B 25 5.305 -9.146 -2.519 1.00 0.00 O ATOM 1127 OD2 ASP B 25 4.501 -8.663 -0.535 1.00 0.00 O ATOM 0 H ASP B 25 7.164 -7.865 -3.586 1.00 0.00 H new ATOM 0 HA ASP B 25 5.011 -6.209 -3.028 1.00 0.00 H new ATOM 0 HB2 ASP B 25 7.162 -7.462 -1.297 1.00 0.00 H new ATOM 0 HB3 ASP B 25 5.831 -6.544 -0.621 1.00 0.00 H new ATOM 1132 N ILE B 26 7.988 -4.832 -2.452 1.00 0.00 N ATOM 1133 CA ILE B 26 8.685 -3.571 -2.227 1.00 0.00 C ATOM 1134 C ILE B 26 8.321 -2.566 -3.332 1.00 0.00 C ATOM 1135 O ILE B 26 7.924 -1.438 -3.022 1.00 0.00 O ATOM 1136 CB ILE B 26 10.208 -3.803 -2.082 1.00 0.00 C ATOM 1137 CG1 ILE B 26 10.538 -4.744 -0.901 1.00 0.00 C ATOM 1138 CG2 ILE B 26 10.906 -2.459 -1.828 1.00 0.00 C ATOM 1139 CD1 ILE B 26 11.971 -5.292 -0.941 1.00 0.00 C ATOM 0 H ILE B 26 8.610 -5.634 -2.550 1.00 0.00 H new ATOM 0 HA ILE B 26 8.359 -3.134 -1.283 1.00 0.00 H new ATOM 0 HB ILE B 26 10.558 -4.263 -3.006 1.00 0.00 H new ATOM 0 HG12 ILE B 26 10.388 -4.206 0.035 1.00 0.00 H new ATOM 0 HG13 ILE B 26 9.837 -5.579 -0.904 1.00 0.00 H new ATOM 0 HG21 ILE B 26 11.979 -2.620 -1.725 1.00 0.00 H new ATOM 0 HG22 ILE B 26 10.718 -1.787 -2.666 1.00 0.00 H new ATOM 0 HG23 ILE B 26 10.517 -2.014 -0.912 1.00 0.00 H new ATOM 0 HD11 ILE B 26 12.135 -5.945 -0.084 1.00 0.00 H new ATOM 0 HD12 ILE B 26 12.119 -5.857 -1.861 1.00 0.00 H new ATOM 0 HD13 ILE B 26 12.678 -4.463 -0.907 1.00 0.00 H new ATOM 1151 N GLN B 27 8.454 -2.952 -4.603 1.00 0.00 N ATOM 1152 CA GLN B 27 8.138 -2.078 -5.727 1.00 0.00 C ATOM 1153 C GLN B 27 6.660 -1.687 -5.737 1.00 0.00 C ATOM 1154 O GLN B 27 6.350 -0.522 -5.981 1.00 0.00 O ATOM 1155 CB GLN B 27 8.517 -2.749 -7.055 1.00 0.00 C ATOM 1156 CG GLN B 27 10.033 -2.867 -7.263 1.00 0.00 C ATOM 1157 CD GLN B 27 10.789 -1.542 -7.194 1.00 0.00 C ATOM 1158 OE1 GLN B 27 11.857 -1.456 -6.593 1.00 0.00 O ATOM 1159 NE2 GLN B 27 10.305 -0.473 -7.804 1.00 0.00 N ATOM 0 H GLN B 27 8.783 -3.877 -4.878 1.00 0.00 H new ATOM 0 HA GLN B 27 8.725 -1.167 -5.609 1.00 0.00 H new ATOM 0 HB2 GLN B 27 8.074 -3.744 -7.091 1.00 0.00 H new ATOM 0 HB3 GLN B 27 8.087 -2.178 -7.878 1.00 0.00 H new ATOM 0 HG2 GLN B 27 10.439 -3.541 -6.509 1.00 0.00 H new ATOM 0 HG3 GLN B 27 10.219 -3.326 -8.234 1.00 0.00 H new ATOM 0 HE21 GLN B 27 9.419 -0.530 -8.307 1.00 0.00 H new ATOM 0 HE22 GLN B 27 10.817 0.408 -7.772 1.00 0.00 H new ATOM 1168 N LYS B 28 5.749 -2.625 -5.464 1.00 0.00 N ATOM 1169 CA LYS B 28 4.313 -2.363 -5.434 1.00 0.00 C ATOM 1170 C LYS B 28 4.010 -1.294 -4.398 1.00 0.00 C ATOM 1171 O LYS B 28 3.276 -0.353 -4.691 1.00 0.00 O ATOM 1172 CB LYS B 28 3.537 -3.638 -5.094 1.00 0.00 C ATOM 1173 CG LYS B 28 3.441 -4.589 -6.285 1.00 0.00 C ATOM 1174 CD LYS B 28 2.761 -5.879 -5.829 1.00 0.00 C ATOM 1175 CE LYS B 28 2.605 -6.828 -7.012 1.00 0.00 C ATOM 1176 NZ LYS B 28 1.732 -7.957 -6.657 1.00 0.00 N ATOM 0 H LYS B 28 5.992 -3.594 -5.256 1.00 0.00 H new ATOM 0 HA LYS B 28 4.003 -2.018 -6.421 1.00 0.00 H new ATOM 0 HB2 LYS B 28 4.025 -4.147 -4.263 1.00 0.00 H new ATOM 0 HB3 LYS B 28 2.534 -3.373 -4.761 1.00 0.00 H new ATOM 0 HG2 LYS B 28 2.872 -4.127 -7.092 1.00 0.00 H new ATOM 0 HG3 LYS B 28 4.435 -4.804 -6.678 1.00 0.00 H new ATOM 0 HD2 LYS B 28 3.351 -6.354 -5.045 1.00 0.00 H new ATOM 0 HD3 LYS B 28 1.784 -5.654 -5.401 1.00 0.00 H new ATOM 0 HE2 LYS B 28 2.187 -6.291 -7.863 1.00 0.00 H new ATOM 0 HE3 LYS B 28 3.583 -7.200 -7.319 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 1.472 -8.479 -7.518 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 2.234 -8.593 -6.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 0.871 -7.599 -6.197 1.00 0.00 H new ATOM 1190 N ALA B 29 4.561 -1.422 -3.190 1.00 0.00 N ATOM 1191 CA ALA B 29 4.309 -0.434 -2.158 1.00 0.00 C ATOM 1192 C ALA B 29 4.822 0.934 -2.613 1.00 0.00 C ATOM 1193 O ALA B 29 4.150 1.936 -2.386 1.00 0.00 O ATOM 1194 CB ALA B 29 4.946 -0.875 -0.841 1.00 0.00 C ATOM 0 H ALA B 29 5.173 -2.189 -2.912 1.00 0.00 H new ATOM 0 HA ALA B 29 3.236 -0.346 -1.988 1.00 0.00 H new ATOM 0 HB1 ALA B 29 4.751 -0.126 -0.074 1.00 0.00 H new ATOM 0 HB2 ALA B 29 4.520 -1.830 -0.533 1.00 0.00 H new ATOM 0 HB3 ALA B 29 6.022 -0.984 -0.976 1.00 0.00 H new ATOM 1200 N LEU B 30 5.991 0.981 -3.261 1.00 0.00 N ATOM 1201 CA LEU B 30 6.585 2.221 -3.740 1.00 0.00 C ATOM 1202 C LEU B 30 5.721 2.902 -4.789 1.00 0.00 C ATOM 1203 O LEU B 30 5.410 4.080 -4.623 1.00 0.00 O ATOM 1204 CB LEU B 30 7.987 1.979 -4.330 1.00 0.00 C ATOM 1205 CG LEU B 30 9.124 2.120 -3.313 1.00 0.00 C ATOM 1206 CD1 LEU B 30 10.435 1.684 -3.971 1.00 0.00 C ATOM 1207 CD2 LEU B 30 9.273 3.571 -2.827 1.00 0.00 C ATOM 0 H LEU B 30 6.550 0.153 -3.466 1.00 0.00 H new ATOM 0 HA LEU B 30 6.662 2.875 -2.872 1.00 0.00 H new ATOM 0 HB2 LEU B 30 8.021 0.978 -4.761 1.00 0.00 H new ATOM 0 HB3 LEU B 30 8.153 2.683 -5.145 1.00 0.00 H new ATOM 0 HG LEU B 30 8.890 1.493 -2.453 1.00 0.00 H new ATOM 0 HD11 LEU B 30 11.251 1.781 -3.255 1.00 0.00 H new ATOM 0 HD12 LEU B 30 10.354 0.645 -4.291 1.00 0.00 H new ATOM 0 HD13 LEU B 30 10.635 2.315 -4.837 1.00 0.00 H new ATOM 0 HD21 LEU B 30 10.089 3.632 -2.107 1.00 0.00 H new ATOM 0 HD22 LEU B 30 9.490 4.219 -3.676 1.00 0.00 H new ATOM 0 HD23 LEU B 30 8.346 3.893 -2.353 1.00 0.00 H new ATOM 1219 N VAL B 31 5.357 2.199 -5.861 1.00 0.00 N ATOM 1220 CA VAL B 31 4.558 2.784 -6.931 1.00 0.00 C ATOM 1221 C VAL B 31 3.218 3.309 -6.418 1.00 0.00 C ATOM 1222 O VAL B 31 2.869 4.458 -6.692 1.00 0.00 O ATOM 1223 CB VAL B 31 4.491 1.830 -8.142 1.00 0.00 C ATOM 1224 CG1 VAL B 31 3.658 0.565 -7.929 1.00 0.00 C ATOM 1225 CG2 VAL B 31 3.978 2.551 -9.391 1.00 0.00 C ATOM 0 H VAL B 31 5.605 1.221 -6.009 1.00 0.00 H new ATOM 0 HA VAL B 31 5.051 3.680 -7.309 1.00 0.00 H new ATOM 0 HB VAL B 31 5.523 1.506 -8.275 1.00 0.00 H new ATOM 0 HG11 VAL B 31 3.674 -0.038 -8.837 1.00 0.00 H new ATOM 0 HG12 VAL B 31 4.076 -0.011 -7.103 1.00 0.00 H new ATOM 0 HG13 VAL B 31 2.630 0.841 -7.695 1.00 0.00 H new ATOM 0 HG21 VAL B 31 3.943 1.851 -10.226 1.00 0.00 H new ATOM 0 HG22 VAL B 31 2.978 2.940 -9.201 1.00 0.00 H new ATOM 0 HG23 VAL B 31 4.648 3.375 -9.636 1.00 0.00 H new ATOM 1235 N ILE B 32 2.501 2.518 -5.616 1.00 0.00 N ATOM 1236 CA ILE B 32 1.208 2.929 -5.083 1.00 0.00 C ATOM 1237 C ILE B 32 1.372 4.138 -4.160 1.00 0.00 C ATOM 1238 O ILE B 32 0.479 4.977 -4.107 1.00 0.00 O ATOM 1239 CB ILE B 32 0.519 1.748 -4.375 1.00 0.00 C ATOM 1240 CG1 ILE B 32 0.338 0.537 -5.318 1.00 0.00 C ATOM 1241 CG2 ILE B 32 -0.858 2.177 -3.845 1.00 0.00 C ATOM 1242 CD1 ILE B 32 0.065 -0.751 -4.538 1.00 0.00 C ATOM 0 H ILE B 32 2.799 1.587 -5.323 1.00 0.00 H new ATOM 0 HA ILE B 32 0.563 3.234 -5.906 1.00 0.00 H new ATOM 0 HB ILE B 32 1.164 1.449 -3.549 1.00 0.00 H new ATOM 0 HG12 ILE B 32 -0.487 0.729 -6.003 1.00 0.00 H new ATOM 0 HG13 ILE B 32 1.234 0.412 -5.926 1.00 0.00 H new ATOM 0 HG21 ILE B 32 -1.335 1.333 -3.347 1.00 0.00 H new ATOM 0 HG22 ILE B 32 -0.736 2.996 -3.136 1.00 0.00 H new ATOM 0 HG23 ILE B 32 -1.481 2.507 -4.676 1.00 0.00 H new ATOM 0 HD11 ILE B 32 -0.057 -1.580 -5.235 1.00 0.00 H new ATOM 0 HD12 ILE B 32 0.903 -0.957 -3.872 1.00 0.00 H new ATOM 0 HD13 ILE B 32 -0.846 -0.635 -3.951 1.00 0.00 H new ATOM 1254 N ALA B 33 2.493 4.252 -3.441 1.00 0.00 N ATOM 1255 CA ALA B 33 2.755 5.362 -2.545 1.00 0.00 C ATOM 1256 C ALA B 33 3.316 6.579 -3.298 1.00 0.00 C ATOM 1257 O ALA B 33 3.722 7.561 -2.665 1.00 0.00 O ATOM 1258 CB ALA B 33 3.707 4.883 -1.455 1.00 0.00 C ATOM 0 H ALA B 33 3.246 3.565 -3.471 1.00 0.00 H new ATOM 0 HA ALA B 33 1.821 5.694 -2.092 1.00 0.00 H new ATOM 0 HB1 ALA B 33 3.917 5.704 -0.769 1.00 0.00 H new ATOM 0 HB2 ALA B 33 3.248 4.061 -0.906 1.00 0.00 H new ATOM 0 HB3 ALA B 33 4.637 4.542 -1.909 1.00 0.00 H new ATOM 1264 N HIS B 34 3.336 6.541 -4.634 1.00 0.00 N ATOM 1265 CA HIS B 34 3.857 7.580 -5.512 1.00 0.00 C ATOM 1266 C HIS B 34 5.324 7.828 -5.117 1.00 0.00 C ATOM 1267 O HIS B 34 5.731 8.948 -4.794 1.00 0.00 O ATOM 1268 CB HIS B 34 2.984 8.850 -5.506 1.00 0.00 C ATOM 1269 CG HIS B 34 1.486 8.672 -5.486 1.00 0.00 C ATOM 1270 ND1 HIS B 34 0.607 9.483 -4.797 1.00 0.00 N ATOM 1271 CD2 HIS B 34 0.751 7.718 -6.137 1.00 0.00 C ATOM 1272 CE1 HIS B 34 -0.635 9.034 -5.037 1.00 0.00 C ATOM 1273 NE2 HIS B 34 -0.598 7.963 -5.847 1.00 0.00 N ATOM 0 H HIS B 34 2.970 5.743 -5.153 1.00 0.00 H new ATOM 0 HA HIS B 34 3.822 7.253 -6.551 1.00 0.00 H new ATOM 0 HB2 HIS B 34 3.263 9.444 -4.636 1.00 0.00 H new ATOM 0 HB3 HIS B 34 3.240 9.437 -6.388 1.00 0.00 H new ATOM 0 HD2 HIS B 34 1.139 6.924 -6.758 1.00 0.00 H new ATOM 0 HE1 HIS B 34 -1.537 9.472 -4.636 1.00 0.00 H new ATOM 0 HE2 HIS B 34 -1.399 7.430 -6.186 1.00 0.00 H new ATOM 1281 N ASN B 35 6.115 6.751 -5.088 1.00 0.00 N ATOM 1282 CA ASN B 35 7.535 6.680 -4.732 1.00 0.00 C ATOM 1283 C ASN B 35 7.812 6.985 -3.251 1.00 0.00 C ATOM 1284 O ASN B 35 8.970 6.916 -2.850 1.00 0.00 O ATOM 1285 CB ASN B 35 8.417 7.614 -5.592 1.00 0.00 C ATOM 1286 CG ASN B 35 8.415 7.334 -7.079 1.00 0.00 C ATOM 1287 OD1 ASN B 35 7.500 7.730 -7.795 1.00 0.00 O ATOM 1288 ND2 ASN B 35 9.420 6.644 -7.586 1.00 0.00 N ATOM 0 H ASN B 35 5.748 5.831 -5.333 1.00 0.00 H new ATOM 0 HA ASN B 35 7.801 5.642 -4.932 1.00 0.00 H new ATOM 0 HB2 ASN B 35 8.088 8.641 -5.434 1.00 0.00 H new ATOM 0 HB3 ASN B 35 9.443 7.549 -5.230 1.00 0.00 H new ATOM 0 HD21 ASN B 35 9.442 6.434 -8.584 1.00 0.00 H new ATOM 0 HD22 ASN B 35 10.174 6.321 -6.980 1.00 0.00 H new ATOM 1295 N ASN B 36 6.812 7.330 -2.428 1.00 0.00 N ATOM 1296 CA ASN B 36 7.045 7.667 -1.021 1.00 0.00 C ATOM 1297 C ASN B 36 7.507 6.438 -0.233 1.00 0.00 C ATOM 1298 O ASN B 36 6.691 5.589 0.118 1.00 0.00 O ATOM 1299 CB ASN B 36 5.806 8.333 -0.398 1.00 0.00 C ATOM 1300 CG ASN B 36 6.075 8.841 1.020 1.00 0.00 C ATOM 1301 OD1 ASN B 36 6.884 8.302 1.765 1.00 0.00 O ATOM 1302 ND2 ASN B 36 5.398 9.894 1.449 1.00 0.00 N ATOM 0 H ASN B 36 5.835 7.382 -2.715 1.00 0.00 H new ATOM 0 HA ASN B 36 7.852 8.398 -0.972 1.00 0.00 H new ATOM 0 HB2 ASN B 36 5.488 9.165 -1.026 1.00 0.00 H new ATOM 0 HB3 ASN B 36 4.984 7.618 -0.376 1.00 0.00 H new ATOM 0 HD21 ASN B 36 5.552 10.250 2.392 1.00 0.00 H new ATOM 0 HD22 ASN B 36 4.722 10.350 0.836 1.00 0.00 H new ATOM 1309 N ILE B 37 8.804 6.364 0.080 1.00 0.00 N ATOM 1310 CA ILE B 37 9.434 5.268 0.809 1.00 0.00 C ATOM 1311 C ILE B 37 8.798 4.994 2.182 1.00 0.00 C ATOM 1312 O ILE B 37 8.600 3.830 2.532 1.00 0.00 O ATOM 1313 CB ILE B 37 10.964 5.529 0.897 1.00 0.00 C ATOM 1314 CG1 ILE B 37 11.768 4.283 1.319 1.00 0.00 C ATOM 1315 CG2 ILE B 37 11.346 6.695 1.825 1.00 0.00 C ATOM 1316 CD1 ILE B 37 12.027 3.348 0.137 1.00 0.00 C ATOM 0 H ILE B 37 9.466 7.096 -0.179 1.00 0.00 H new ATOM 0 HA ILE B 37 9.262 4.348 0.250 1.00 0.00 H new ATOM 0 HB ILE B 37 11.231 5.801 -0.124 1.00 0.00 H new ATOM 0 HG12 ILE B 37 12.719 4.593 1.752 1.00 0.00 H new ATOM 0 HG13 ILE B 37 11.224 3.745 2.096 1.00 0.00 H new ATOM 0 HG21 ILE B 37 12.429 6.814 1.833 1.00 0.00 H new ATOM 0 HG22 ILE B 37 10.883 7.614 1.465 1.00 0.00 H new ATOM 0 HG23 ILE B 37 10.997 6.485 2.836 1.00 0.00 H new ATOM 0 HD11 ILE B 37 12.596 2.482 0.476 1.00 0.00 H new ATOM 0 HD12 ILE B 37 11.076 3.017 -0.280 1.00 0.00 H new ATOM 0 HD13 ILE B 37 12.594 3.878 -0.629 1.00 0.00 H new ATOM 1328 N GLU B 38 8.489 6.032 2.962 1.00 0.00 N ATOM 1329 CA GLU B 38 7.914 5.934 4.306 1.00 0.00 C ATOM 1330 C GLU B 38 6.495 5.376 4.236 1.00 0.00 C ATOM 1331 O GLU B 38 6.146 4.422 4.935 1.00 0.00 O ATOM 1332 CB GLU B 38 7.951 7.318 4.993 1.00 0.00 C ATOM 1333 CG GLU B 38 9.396 7.852 5.057 1.00 0.00 C ATOM 1334 CD GLU B 38 9.594 9.193 5.771 1.00 0.00 C ATOM 1335 OE1 GLU B 38 8.876 10.178 5.481 1.00 0.00 O ATOM 1336 OE2 GLU B 38 10.610 9.335 6.500 1.00 0.00 O ATOM 0 H GLU B 38 8.637 6.997 2.666 1.00 0.00 H new ATOM 0 HA GLU B 38 8.507 5.244 4.906 1.00 0.00 H new ATOM 0 HB2 GLU B 38 7.322 8.019 4.445 1.00 0.00 H new ATOM 0 HB3 GLU B 38 7.541 7.242 6.000 1.00 0.00 H new ATOM 0 HG2 GLU B 38 10.015 7.105 5.554 1.00 0.00 H new ATOM 0 HG3 GLU B 38 9.770 7.949 4.038 1.00 0.00 H new ATOM 1343 N MET B 39 5.688 5.962 3.355 1.00 0.00 N ATOM 1344 CA MET B 39 4.305 5.582 3.113 1.00 0.00 C ATOM 1345 C MET B 39 4.290 4.132 2.621 1.00 0.00 C ATOM 1346 O MET B 39 3.503 3.318 3.097 1.00 0.00 O ATOM 1347 CB MET B 39 3.749 6.579 2.094 1.00 0.00 C ATOM 1348 CG MET B 39 2.237 6.619 1.902 1.00 0.00 C ATOM 1349 SD MET B 39 1.706 8.177 1.112 1.00 0.00 S ATOM 1350 CE MET B 39 -0.096 8.149 1.347 1.00 0.00 C ATOM 0 H MET B 39 5.993 6.741 2.771 1.00 0.00 H new ATOM 0 HA MET B 39 3.678 5.619 4.004 1.00 0.00 H new ATOM 0 HB2 MET B 39 4.078 7.577 2.385 1.00 0.00 H new ATOM 0 HB3 MET B 39 4.205 6.363 1.128 1.00 0.00 H new ATOM 0 HG2 MET B 39 1.924 5.774 1.289 1.00 0.00 H new ATOM 0 HG3 MET B 39 1.743 6.512 2.868 1.00 0.00 H new ATOM 0 HE1 MET B 39 -0.528 9.070 0.956 1.00 0.00 H new ATOM 0 HE2 MET B 39 -0.519 7.296 0.816 1.00 0.00 H new ATOM 0 HE3 MET B 39 -0.323 8.064 2.410 1.00 0.00 H new ATOM 1360 N ALA B 40 5.204 3.779 1.713 1.00 0.00 N ATOM 1361 CA ALA B 40 5.335 2.440 1.165 1.00 0.00 C ATOM 1362 C ALA B 40 5.691 1.451 2.281 1.00 0.00 C ATOM 1363 O ALA B 40 5.128 0.358 2.342 1.00 0.00 O ATOM 1364 CB ALA B 40 6.393 2.454 0.060 1.00 0.00 C ATOM 0 H ALA B 40 5.886 4.437 1.334 1.00 0.00 H new ATOM 0 HA ALA B 40 4.389 2.116 0.731 1.00 0.00 H new ATOM 0 HB1 ALA B 40 6.497 1.452 -0.357 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.088 3.144 -0.727 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.348 2.776 0.475 1.00 0.00 H new ATOM 1370 N LYS B 41 6.617 1.811 3.180 1.00 0.00 N ATOM 1371 CA LYS B 41 7.004 0.945 4.296 1.00 0.00 C ATOM 1372 C LYS B 41 5.772 0.641 5.141 1.00 0.00 C ATOM 1373 O LYS B 41 5.617 -0.499 5.571 1.00 0.00 O ATOM 1374 CB LYS B 41 8.086 1.604 5.161 1.00 0.00 C ATOM 1375 CG LYS B 41 9.494 1.450 4.588 1.00 0.00 C ATOM 1376 CD LYS B 41 10.481 2.375 5.305 1.00 0.00 C ATOM 1377 CE LYS B 41 11.875 2.204 4.700 1.00 0.00 C ATOM 1378 NZ LYS B 41 12.888 3.006 5.410 1.00 0.00 N ATOM 0 H LYS B 41 7.113 2.702 3.153 1.00 0.00 H new ATOM 0 HA LYS B 41 7.417 0.020 3.895 1.00 0.00 H new ATOM 0 HB2 LYS B 41 7.859 2.665 5.269 1.00 0.00 H new ATOM 0 HB3 LYS B 41 8.058 1.169 6.160 1.00 0.00 H new ATOM 0 HG2 LYS B 41 9.821 0.415 4.689 1.00 0.00 H new ATOM 0 HG3 LYS B 41 9.484 1.679 3.522 1.00 0.00 H new ATOM 0 HD2 LYS B 41 10.157 3.412 5.211 1.00 0.00 H new ATOM 0 HD3 LYS B 41 10.505 2.143 6.370 1.00 0.00 H new ATOM 0 HE2 LYS B 41 12.158 1.152 4.733 1.00 0.00 H new ATOM 0 HE3 LYS B 41 11.853 2.496 3.650 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 13.788 2.969 4.889 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 12.566 3.993 5.475 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 13.026 2.623 6.367 1.00 0.00 H new ATOM 1392 N ASN B 42 4.884 1.620 5.353 1.00 0.00 N ATOM 1393 CA ASN B 42 3.670 1.400 6.134 1.00 0.00 C ATOM 1394 C ASN B 42 2.813 0.324 5.456 1.00 0.00 C ATOM 1395 O ASN B 42 2.269 -0.527 6.155 1.00 0.00 O ATOM 1396 CB ASN B 42 2.870 2.699 6.339 1.00 0.00 C ATOM 1397 CG ASN B 42 3.565 3.719 7.230 1.00 0.00 C ATOM 1398 OD1 ASN B 42 4.223 3.373 8.210 1.00 0.00 O ATOM 1399 ND2 ASN B 42 3.398 5.001 6.969 1.00 0.00 N ATOM 0 H ASN B 42 4.987 2.569 4.994 1.00 0.00 H new ATOM 0 HA ASN B 42 3.961 1.055 7.126 1.00 0.00 H new ATOM 0 HB2 ASN B 42 2.677 3.152 5.367 1.00 0.00 H new ATOM 0 HB3 ASN B 42 1.901 2.452 6.773 1.00 0.00 H new ATOM 0 HD21 ASN B 42 3.814 5.704 7.579 1.00 0.00 H new ATOM 0 HD22 ASN B 42 2.853 5.289 6.157 1.00 0.00 H new ATOM 1406 N ILE B 43 2.708 0.323 4.117 1.00 0.00 N ATOM 1407 CA ILE B 43 1.935 -0.676 3.366 1.00 0.00 C ATOM 1408 C ILE B 43 2.526 -2.050 3.695 1.00 0.00 C ATOM 1409 O ILE B 43 1.816 -2.962 4.123 1.00 0.00 O ATOM 1410 CB ILE B 43 1.906 -0.391 1.837 1.00 0.00 C ATOM 1411 CG1 ILE B 43 1.369 1.026 1.536 1.00 0.00 C ATOM 1412 CG2 ILE B 43 1.029 -1.429 1.137 1.00 0.00 C ATOM 1413 CD1 ILE B 43 1.488 1.489 0.081 1.00 0.00 C ATOM 0 H ILE B 43 3.160 1.019 3.524 1.00 0.00 H new ATOM 0 HA ILE B 43 0.888 -0.636 3.667 1.00 0.00 H new ATOM 0 HB ILE B 43 2.928 -0.453 1.463 1.00 0.00 H new ATOM 0 HG12 ILE B 43 0.319 1.065 1.825 1.00 0.00 H new ATOM 0 HG13 ILE B 43 1.900 1.737 2.168 1.00 0.00 H new ATOM 0 HG21 ILE B 43 1.010 -1.227 0.066 1.00 0.00 H new ATOM 0 HG22 ILE B 43 1.435 -2.425 1.311 1.00 0.00 H new ATOM 0 HG23 ILE B 43 0.015 -1.376 1.534 1.00 0.00 H new ATOM 0 HD11 ILE B 43 1.081 2.496 -0.015 1.00 0.00 H new ATOM 0 HD12 ILE B 43 2.537 1.492 -0.215 1.00 0.00 H new ATOM 0 HD13 ILE B 43 0.931 0.809 -0.564 1.00 0.00 H new ATOM 1425 N LEU B 44 3.843 -2.196 3.541 1.00 0.00 N ATOM 1426 CA LEU B 44 4.551 -3.437 3.824 1.00 0.00 C ATOM 1427 C LEU B 44 4.429 -3.853 5.294 1.00 0.00 C ATOM 1428 O LEU B 44 4.591 -5.032 5.603 1.00 0.00 O ATOM 1429 CB LEU B 44 6.040 -3.292 3.471 1.00 0.00 C ATOM 1430 CG LEU B 44 6.347 -3.042 1.987 1.00 0.00 C ATOM 1431 CD1 LEU B 44 7.855 -2.844 1.822 1.00 0.00 C ATOM 1432 CD2 LEU B 44 5.886 -4.202 1.100 1.00 0.00 C ATOM 0 H LEU B 44 4.451 -1.446 3.213 1.00 0.00 H new ATOM 0 HA LEU B 44 4.089 -4.211 3.211 1.00 0.00 H new ATOM 0 HB2 LEU B 44 6.455 -2.469 4.053 1.00 0.00 H new ATOM 0 HB3 LEU B 44 6.559 -4.198 3.784 1.00 0.00 H new ATOM 0 HG LEU B 44 5.802 -2.152 1.673 1.00 0.00 H new ATOM 0 HD11 LEU B 44 8.086 -2.666 0.772 1.00 0.00 H new ATOM 0 HD12 LEU B 44 8.177 -1.988 2.415 1.00 0.00 H new ATOM 0 HD13 LEU B 44 8.379 -3.738 2.162 1.00 0.00 H new ATOM 0 HD21 LEU B 44 6.124 -3.981 0.059 1.00 0.00 H new ATOM 0 HD22 LEU B 44 6.396 -5.116 1.403 1.00 0.00 H new ATOM 0 HD23 LEU B 44 4.809 -4.335 1.206 1.00 0.00 H new ATOM 1444 N ARG B 45 4.160 -2.929 6.216 1.00 0.00 N ATOM 1445 CA ARG B 45 4.038 -3.232 7.634 1.00 0.00 C ATOM 1446 C ARG B 45 2.663 -3.791 7.989 1.00 0.00 C ATOM 1447 O ARG B 45 2.619 -4.762 8.745 1.00 0.00 O ATOM 1448 CB ARG B 45 4.341 -1.958 8.441 1.00 0.00 C ATOM 1449 CG ARG B 45 4.584 -2.213 9.934 1.00 0.00 C ATOM 1450 CD ARG B 45 5.872 -3.010 10.195 1.00 0.00 C ATOM 1451 NE ARG B 45 6.245 -2.891 11.610 1.00 0.00 N ATOM 1452 CZ ARG B 45 7.453 -2.599 12.095 1.00 0.00 C ATOM 1453 NH1 ARG B 45 8.569 -2.867 11.422 1.00 0.00 N ATOM 1454 NH2 ARG B 45 7.528 -2.013 13.279 1.00 0.00 N ATOM 0 H ARG B 45 4.020 -1.943 5.994 1.00 0.00 H new ATOM 0 HA ARG B 45 4.758 -4.010 7.886 1.00 0.00 H new ATOM 0 HB2 ARG B 45 5.220 -1.471 8.018 1.00 0.00 H new ATOM 0 HB3 ARG B 45 3.508 -1.263 8.332 1.00 0.00 H new ATOM 0 HG2 ARG B 45 4.639 -1.259 10.458 1.00 0.00 H new ATOM 0 HG3 ARG B 45 3.735 -2.756 10.349 1.00 0.00 H new ATOM 0 HD2 ARG B 45 5.723 -4.058 9.934 1.00 0.00 H new ATOM 0 HD3 ARG B 45 6.678 -2.636 9.563 1.00 0.00 H new ATOM 0 HE ARG B 45 5.504 -3.048 12.293 1.00 0.00 H new ATOM 0 HH11 ARG B 45 8.517 -3.310 10.504 1.00 0.00 H new ATOM 0 HH12 ARG B 45 9.476 -2.630 11.824 1.00 0.00 H new ATOM 0 HH21 ARG B 45 6.676 -1.796 13.796 1.00 0.00 H new ATOM 0 HH22 ARG B 45 8.438 -1.778 13.675 1.00 0.00 H new ATOM 1468 N GLU B 46 1.575 -3.239 7.444 1.00 0.00 N ATOM 1469 CA GLU B 46 0.217 -3.694 7.767 1.00 0.00 C ATOM 1470 C GLU B 46 -0.350 -4.735 6.797 1.00 0.00 C ATOM 1471 O GLU B 46 -1.324 -5.400 7.157 1.00 0.00 O ATOM 1472 CB GLU B 46 -0.749 -2.497 7.914 1.00 0.00 C ATOM 1473 CG GLU B 46 -0.172 -1.426 8.859 1.00 0.00 C ATOM 1474 CD GLU B 46 -1.124 -0.331 9.357 1.00 0.00 C ATOM 1475 OE1 GLU B 46 -2.366 -0.479 9.350 1.00 0.00 O ATOM 1476 OE2 GLU B 46 -0.592 0.723 9.795 1.00 0.00 O ATOM 0 H GLU B 46 1.608 -2.472 6.773 1.00 0.00 H new ATOM 0 HA GLU B 46 0.306 -4.206 8.725 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -0.938 -2.057 6.935 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -1.708 -2.846 8.298 1.00 0.00 H new ATOM 0 HG2 GLU B 46 0.241 -1.934 9.731 1.00 0.00 H new ATOM 0 HG3 GLU B 46 0.660 -0.941 8.349 1.00 0.00 H new ATOM 1483 N PHE B 47 0.238 -4.921 5.609 1.00 0.00 N ATOM 1484 CA PHE B 47 -0.239 -5.891 4.622 1.00 0.00 C ATOM 1485 C PHE B 47 0.770 -7.015 4.409 1.00 0.00 C ATOM 1486 O PHE B 47 0.484 -8.159 4.766 1.00 0.00 O ATOM 1487 CB PHE B 47 -0.578 -5.223 3.284 1.00 0.00 C ATOM 1488 CG PHE B 47 -1.851 -4.402 3.273 1.00 0.00 C ATOM 1489 CD1 PHE B 47 -1.868 -3.092 3.789 1.00 0.00 C ATOM 1490 CD2 PHE B 47 -3.005 -4.924 2.659 1.00 0.00 C ATOM 1491 CE1 PHE B 47 -3.055 -2.342 3.757 1.00 0.00 C ATOM 1492 CE2 PHE B 47 -4.192 -4.180 2.644 1.00 0.00 C ATOM 1493 CZ PHE B 47 -4.219 -2.897 3.203 1.00 0.00 C ATOM 0 H PHE B 47 1.061 -4.400 5.306 1.00 0.00 H new ATOM 0 HA PHE B 47 -1.155 -6.323 5.026 1.00 0.00 H new ATOM 0 HB2 PHE B 47 0.253 -4.578 2.998 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -0.658 -5.997 2.521 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -0.969 -2.665 4.209 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -2.975 -5.900 2.198 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -3.072 -1.339 4.158 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -5.085 -4.596 2.202 1.00 0.00 H new ATOM 0 HZ PHE B 47 -5.139 -2.332 3.208 1.00 0.00 H new ATOM 1503 N SER B 48 1.916 -6.703 3.801 1.00 0.00 N ATOM 1504 CA SER B 48 2.971 -7.666 3.507 1.00 0.00 C ATOM 1505 C SER B 48 3.628 -8.178 4.799 1.00 0.00 C ATOM 1506 O SER B 48 3.302 -7.740 5.907 1.00 0.00 O ATOM 1507 CB SER B 48 3.978 -6.989 2.561 1.00 0.00 C ATOM 1508 OG SER B 48 4.865 -7.908 1.956 1.00 0.00 O ATOM 0 H SER B 48 2.138 -5.756 3.495 1.00 0.00 H new ATOM 0 HA SER B 48 2.559 -8.548 3.016 1.00 0.00 H new ATOM 0 HB2 SER B 48 3.435 -6.451 1.784 1.00 0.00 H new ATOM 0 HB3 SER B 48 4.553 -6.250 3.119 1.00 0.00 H new ATOM 0 HG SER B 48 4.449 -8.284 1.152 1.00 0.00 H new ATOM 1514 N GLY B 49 4.570 -9.112 4.669 1.00 0.00 N ATOM 1515 CA GLY B 49 5.299 -9.687 5.788 1.00 0.00 C ATOM 1516 C GLY B 49 6.535 -10.461 5.317 1.00 0.00 C ATOM 1517 O GLY B 49 6.676 -10.716 4.113 1.00 0.00 O ATOM 0 H GLY B 49 4.849 -9.494 3.765 1.00 0.00 H new ATOM 0 HA2 GLY B 49 5.604 -8.894 6.471 1.00 0.00 H new ATOM 0 HA3 GLY B 49 4.642 -10.354 6.347 1.00 0.00 H new ATOM 1521 N PRO B 50 7.423 -10.832 6.253 1.00 0.00 N ATOM 1522 CA PRO B 50 8.637 -11.589 5.971 1.00 0.00 C ATOM 1523 C PRO B 50 8.312 -13.026 5.536 1.00 0.00 C ATOM 1524 O PRO B 50 7.161 -13.462 5.618 1.00 0.00 O ATOM 1525 CB PRO B 50 9.446 -11.556 7.270 1.00 0.00 C ATOM 1526 CG PRO B 50 8.392 -11.371 8.356 1.00 0.00 C ATOM 1527 CD PRO B 50 7.308 -10.549 7.676 1.00 0.00 C ATOM 0 HA PRO B 50 9.200 -11.158 5.143 1.00 0.00 H new ATOM 0 HB2 PRO B 50 10.009 -12.478 7.413 1.00 0.00 H new ATOM 0 HB3 PRO B 50 10.167 -10.739 7.270 1.00 0.00 H new ATOM 0 HG2 PRO B 50 8.007 -12.329 8.706 1.00 0.00 H new ATOM 0 HG3 PRO B 50 8.800 -10.854 9.225 1.00 0.00 H new ATOM 0 HD2 PRO B 50 6.321 -10.821 8.049 1.00 0.00 H new ATOM 0 HD3 PRO B 50 7.442 -9.486 7.874 1.00 0.00 H new ATOM 1535 N SER B 51 9.333 -13.773 5.119 1.00 0.00 N ATOM 1536 CA SER B 51 9.241 -15.154 4.656 1.00 0.00 C ATOM 1537 C SER B 51 10.289 -16.013 5.384 1.00 0.00 C ATOM 1538 O SER B 51 10.880 -15.563 6.366 1.00 0.00 O ATOM 1539 CB SER B 51 9.429 -15.141 3.130 1.00 0.00 C ATOM 1540 OG SER B 51 8.525 -16.029 2.512 1.00 0.00 O ATOM 0 H SER B 51 10.288 -13.415 5.094 1.00 0.00 H new ATOM 0 HA SER B 51 8.271 -15.597 4.882 1.00 0.00 H new ATOM 0 HB2 SER B 51 9.275 -14.132 2.748 1.00 0.00 H new ATOM 0 HB3 SER B 51 10.452 -15.423 2.882 1.00 0.00 H new ATOM 0 HG SER B 51 8.657 -16.007 1.541 1.00 0.00 H new ATOM 1546 N SER B 52 10.488 -17.269 4.983 1.00 0.00 N ATOM 1547 CA SER B 52 11.483 -18.147 5.594 1.00 0.00 C ATOM 1548 C SER B 52 12.138 -18.954 4.478 1.00 0.00 C ATOM 1549 O SER B 52 11.471 -19.327 3.510 1.00 0.00 O ATOM 1550 CB SER B 52 10.874 -18.994 6.719 1.00 0.00 C ATOM 1551 OG SER B 52 9.764 -19.788 6.329 1.00 0.00 O ATOM 0 H SER B 52 9.963 -17.705 4.225 1.00 0.00 H new ATOM 0 HA SER B 52 12.261 -17.571 6.094 1.00 0.00 H new ATOM 0 HB2 SER B 52 11.647 -19.648 7.122 1.00 0.00 H new ATOM 0 HB3 SER B 52 10.564 -18.331 7.527 1.00 0.00 H new ATOM 0 HG SER B 52 9.438 -20.296 7.101 1.00 0.00 H new ATOM 1557 N GLY B 53 13.408 -19.320 4.652 1.00 0.00 N ATOM 1558 CA GLY B 53 14.163 -20.051 3.648 1.00 0.00 C ATOM 1559 C GLY B 53 14.889 -18.972 2.897 1.00 0.00 C ATOM 1560 O GLY B 53 15.952 -18.559 3.399 1.00 0.00 O ATOM 0 H GLY B 53 13.939 -19.115 5.498 1.00 0.00 H new ATOM 0 HA2 GLY B 53 14.856 -20.758 4.104 1.00 0.00 H new ATOM 0 HA3 GLY B 53 13.508 -20.624 2.992 1.00 0.00 H new TER 1564 GLY B 53