USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1213 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A 56 ASNHD21 : A 56 ASN OD1 : A 152 CACA :(metal ligand) USER MOD NoAdj : A 56 ASNHD22 : A 56 ASN OD1 : A 152 CACA :(metal ligand) USER MOD Set 1.1: A 105 MET CE :methyl 147:sc= -0.509 (180deg=-1.04) USER MOD Set 1.2: A 120 MET CE :methyl 174:sc= 0 (180deg=-0.0286) USER MOD Single : A 1 THR N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 38:sc= 0.46 USER MOD Single : A 24 THR OG1 : rot -170:sc= 0.141 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.285) USER MOD Single : A 30 THR OG1 : rot 87:sc= 1.19 USER MOD Single : A 32 MET CE :methyl 154:sc= -0.458 (180deg=-3.01!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.007) USER MOD Single : A 47 MET CE :methyl 177:sc= 0 (180deg=-0.0221) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 58 THR OG1 : rot -140:sc= -0.0238 USER MOD Single : A 66 THR OG1 : rot 70:sc= 0.388 USER MOD Single : A 67 MET CE :methyl -168:sc= -0.341 (180deg=-0.583) USER MOD Single : A 68 MET CE :methyl -131:sc= -0.116 (180deg=-0.462) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 170:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0.575 USER MOD Single : A 103 HIS : no HD1:sc= -0.135 X(o=-0.14,f=-0.051) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot -82:sc= 1.25 USER MOD Single : A 131 GLN : amide:sc= -0.655 X(o=-0.66,f=-1.1) USER MOD Single : A 133 ASN : amide:sc= 0.298 X(o=0.3,f=-0.15) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.043 X(o=-0.043,f=-0.032) USER MOD Single : A 140 MET CE :methyl -136:sc= 0 (180deg=-0.124) USER MOD Single : A 141 MET CE :methyl 174:sc= -0.441 (180deg=-0.525) USER MOD Single : A 142 THR OG1 : rot 44:sc= 0.51 USER MOD Single : B 1 ARG N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ -121:sc= 0.461 (180deg=-1.09) USER MOD Single : B 5 GLN : amide:sc= 0.66 K(o=0.66,f=-2.1) USER MOD Single : B 6 LYS NZ :NH3+ -158:sc= 2.42 (180deg=1.85) USER MOD Single : B 7 THR OG1 : rot 106:sc= 0.816 USER MOD Single : B 9 HIS : no HE2:sc= 0.97 K(o=0.97,f=-3.3!) USER MOD Single : B 18 SER OG : rot -148:sc= 1.21 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 3.676 4.227 18.948 1.00 0.00 N ATOM 2 CA THR A 1 2.619 3.384 19.550 1.00 0.00 C ATOM 3 C THR A 1 2.810 1.990 19.060 1.00 0.00 C ATOM 4 O THR A 1 2.662 1.743 17.864 1.00 0.00 O ATOM 5 CB THR A 1 1.243 3.955 19.375 1.00 0.00 C ATOM 6 OG1 THR A 1 0.336 3.153 20.117 1.00 0.00 O ATOM 7 CG2 THR A 1 0.667 4.206 17.971 1.00 0.00 C ATOM 0 H1 THR A 1 3.566 5.208 19.275 1.00 0.00 H new ATOM 0 H2 THR A 1 4.610 3.870 19.234 1.00 0.00 H new ATOM 0 H3 THR A 1 3.596 4.196 17.912 1.00 0.00 H new ATOM 0 HA THR A 1 2.714 3.365 20.636 1.00 0.00 H new ATOM 0 HB THR A 1 1.368 4.977 19.732 1.00 0.00 H new ATOM 0 HG1 THR A 1 -0.572 3.509 20.019 1.00 0.00 H new ATOM 0 HG21 THR A 1 -0.337 4.621 18.059 1.00 0.00 H new ATOM 0 HG22 THR A 1 1.305 4.910 17.436 1.00 0.00 H new ATOM 0 HG23 THR A 1 0.624 3.265 17.422 1.00 0.00 H new ATOM 14 N GLU A 2 2.944 1.031 19.994 1.00 0.00 N ATOM 15 CA GLU A 2 3.084 -0.389 19.897 1.00 0.00 C ATOM 16 C GLU A 2 2.083 -1.090 19.045 1.00 0.00 C ATOM 17 O GLU A 2 2.453 -2.015 18.322 1.00 0.00 O ATOM 18 CB GLU A 2 3.068 -1.029 21.295 1.00 0.00 C ATOM 19 CG GLU A 2 4.073 -0.453 22.296 1.00 0.00 C ATOM 20 CD GLU A 2 3.461 0.645 23.155 1.00 0.00 C ATOM 21 OE1 GLU A 2 3.190 1.741 22.597 1.00 0.00 O ATOM 22 OE2 GLU A 2 3.372 0.457 24.397 1.00 0.00 O ATOM 0 H GLU A 2 2.955 1.306 20.976 1.00 0.00 H new ATOM 0 HA GLU A 2 4.044 -0.520 19.398 1.00 0.00 H new ATOM 0 HB2 GLU A 2 2.066 -0.924 21.712 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.259 -2.097 21.189 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.442 -1.252 22.939 1.00 0.00 H new ATOM 0 HG3 GLU A 2 4.933 -0.054 21.757 1.00 0.00 H new ATOM 29 N GLU A 3 0.838 -0.587 18.967 1.00 0.00 N ATOM 30 CA GLU A 3 -0.183 -1.121 18.121 1.00 0.00 C ATOM 31 C GLU A 3 0.142 -0.998 16.671 1.00 0.00 C ATOM 32 O GLU A 3 -0.114 -1.903 15.879 1.00 0.00 O ATOM 33 CB GLU A 3 -1.530 -0.479 18.489 1.00 0.00 C ATOM 34 CG GLU A 3 -1.802 -0.644 19.986 1.00 0.00 C ATOM 35 CD GLU A 3 -3.159 -0.060 20.352 1.00 0.00 C ATOM 36 OE1 GLU A 3 -4.116 -0.494 19.656 1.00 0.00 O ATOM 37 OE2 GLU A 3 -3.371 0.811 21.237 1.00 0.00 O ATOM 0 H GLU A 3 0.532 0.219 19.512 1.00 0.00 H new ATOM 0 HA GLU A 3 -0.252 -2.195 18.295 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -1.520 0.579 18.228 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -2.331 -0.942 17.913 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.771 -1.701 20.252 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.020 -0.147 20.560 1.00 0.00 H new ATOM 44 N GLN A 4 0.767 0.070 16.145 1.00 0.00 N ATOM 45 CA GLN A 4 1.223 0.188 14.795 1.00 0.00 C ATOM 46 C GLN A 4 2.391 -0.667 14.444 1.00 0.00 C ATOM 47 O GLN A 4 2.554 -1.183 13.340 1.00 0.00 O ATOM 48 CB GLN A 4 1.596 1.623 14.386 1.00 0.00 C ATOM 49 CG GLN A 4 0.274 2.390 14.322 1.00 0.00 C ATOM 50 CD GLN A 4 0.593 3.861 14.097 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.701 4.308 13.804 1.00 0.00 O ATOM 52 NE2 GLN A 4 -0.501 4.656 14.241 1.00 0.00 N ATOM 0 H GLN A 4 0.966 0.904 16.698 1.00 0.00 H new ATOM 0 HA GLN A 4 0.346 -0.155 14.246 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.275 2.073 15.110 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.104 1.636 13.422 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.350 2.008 13.514 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -0.287 2.259 15.247 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.402 4.245 14.485 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.421 5.664 14.105 1.00 0.00 H new ATOM 61 N ILE A 5 3.330 -0.872 15.385 1.00 0.00 N ATOM 62 CA ILE A 5 4.476 -1.711 15.223 1.00 0.00 C ATOM 63 C ILE A 5 4.100 -3.128 14.960 1.00 0.00 C ATOM 64 O ILE A 5 4.696 -3.895 14.206 1.00 0.00 O ATOM 65 CB ILE A 5 5.377 -1.690 16.423 1.00 0.00 C ATOM 66 CG1 ILE A 5 5.664 -0.281 16.969 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.693 -2.430 16.130 1.00 0.00 C ATOM 68 CD1 ILE A 5 6.273 0.785 16.059 1.00 0.00 C ATOM 0 H ILE A 5 3.287 -0.431 16.304 1.00 0.00 H new ATOM 0 HA ILE A 5 5.006 -1.302 14.363 1.00 0.00 H new ATOM 0 HB ILE A 5 4.830 -2.211 17.209 1.00 0.00 H new ATOM 0 HG12 ILE A 5 4.723 0.117 17.348 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.330 -0.395 17.824 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.331 -2.402 17.014 1.00 0.00 H new ATOM 0 HG22 ILE A 5 6.478 -3.467 15.870 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.205 -1.947 15.298 1.00 0.00 H new ATOM 0 HD11 ILE A 5 6.402 1.711 16.619 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.242 0.443 15.696 1.00 0.00 H new ATOM 0 HD13 ILE A 5 5.610 0.963 15.212 1.00 0.00 H new ATOM 80 N ALA A 6 2.999 -3.614 15.561 1.00 0.00 N ATOM 81 CA ALA A 6 2.380 -4.889 15.374 1.00 0.00 C ATOM 82 C ALA A 6 1.819 -5.034 14.001 1.00 0.00 C ATOM 83 O ALA A 6 1.964 -6.079 13.368 1.00 0.00 O ATOM 84 CB ALA A 6 1.171 -5.076 16.306 1.00 0.00 C ATOM 0 H ALA A 6 2.493 -3.054 16.247 1.00 0.00 H new ATOM 0 HA ALA A 6 3.168 -5.616 15.573 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.727 -6.057 16.134 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.497 -5.002 17.344 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.431 -4.302 16.102 1.00 0.00 H new ATOM 90 N GLU A 7 1.101 -4.003 13.520 1.00 0.00 N ATOM 91 CA GLU A 7 0.547 -3.964 12.203 1.00 0.00 C ATOM 92 C GLU A 7 1.600 -3.989 11.149 1.00 0.00 C ATOM 93 O GLU A 7 1.432 -4.675 10.142 1.00 0.00 O ATOM 94 CB GLU A 7 -0.209 -2.639 12.005 1.00 0.00 C ATOM 95 CG GLU A 7 -1.468 -2.659 12.873 1.00 0.00 C ATOM 96 CD GLU A 7 -2.200 -1.338 13.063 1.00 0.00 C ATOM 97 OE1 GLU A 7 -1.831 -0.325 12.411 1.00 0.00 O ATOM 98 OE2 GLU A 7 -3.184 -1.324 13.849 1.00 0.00 O ATOM 0 H GLU A 7 0.899 -3.167 14.068 1.00 0.00 H new ATOM 0 HA GLU A 7 -0.098 -4.838 12.112 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.426 -1.797 12.280 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -0.475 -2.509 10.956 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -2.167 -3.374 12.439 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.194 -3.039 13.857 1.00 0.00 H new ATOM 105 N PHE A 8 2.753 -3.341 11.390 1.00 0.00 N ATOM 106 CA PHE A 8 3.847 -3.297 10.470 1.00 0.00 C ATOM 107 C PHE A 8 4.603 -4.580 10.398 1.00 0.00 C ATOM 108 O PHE A 8 4.981 -5.023 9.315 1.00 0.00 O ATOM 109 CB PHE A 8 4.813 -2.215 10.981 1.00 0.00 C ATOM 110 CG PHE A 8 5.252 -1.437 9.788 1.00 0.00 C ATOM 111 CD1 PHE A 8 4.475 -0.498 9.151 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.516 -1.628 9.282 1.00 0.00 C ATOM 113 CE1 PHE A 8 4.959 0.209 8.076 1.00 0.00 C ATOM 114 CE2 PHE A 8 7.010 -0.956 8.188 1.00 0.00 C ATOM 115 CZ PHE A 8 6.236 0.018 7.604 1.00 0.00 C ATOM 0 H PHE A 8 2.930 -2.830 12.255 1.00 0.00 H new ATOM 0 HA PHE A 8 3.450 -3.096 9.475 1.00 0.00 H new ATOM 0 HB2 PHE A 8 4.320 -1.567 11.706 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.668 -2.666 11.485 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.470 -0.313 9.500 1.00 0.00 H new ATOM 0 HD2 PHE A 8 7.157 -2.346 9.771 1.00 0.00 H new ATOM 0 HE1 PHE A 8 4.320 0.932 7.590 1.00 0.00 H new ATOM 0 HE2 PHE A 8 7.988 -1.190 7.795 1.00 0.00 H new ATOM 0 HZ PHE A 8 6.622 0.619 6.794 1.00 0.00 H new ATOM 125 N LYS A 9 4.854 -5.190 11.571 1.00 0.00 N ATOM 126 CA LYS A 9 5.497 -6.466 11.612 1.00 0.00 C ATOM 127 C LYS A 9 4.720 -7.550 10.947 1.00 0.00 C ATOM 128 O LYS A 9 5.253 -8.475 10.337 1.00 0.00 O ATOM 129 CB LYS A 9 5.769 -6.843 13.078 1.00 0.00 C ATOM 130 CG LYS A 9 6.333 -8.258 13.218 1.00 0.00 C ATOM 131 CD LYS A 9 6.449 -8.789 14.648 1.00 0.00 C ATOM 132 CE LYS A 9 7.048 -10.196 14.619 1.00 0.00 C ATOM 133 NZ LYS A 9 7.039 -10.862 15.941 1.00 0.00 N ATOM 0 H LYS A 9 4.614 -4.803 12.484 1.00 0.00 H new ATOM 0 HA LYS A 9 6.427 -6.372 11.052 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.471 -6.130 13.510 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.844 -6.765 13.649 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.701 -8.939 12.648 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.322 -8.282 12.760 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.077 -8.127 15.244 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.467 -8.809 15.121 1.00 0.00 H new ATOM 0 HE2 LYS A 9 6.491 -10.806 13.908 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.074 -10.140 14.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.457 -11.810 15.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.594 -10.299 16.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 6.060 -10.945 16.281 1.00 0.00 H new ATOM 147 N GLU A 10 3.382 -7.467 11.056 1.00 0.00 N ATOM 148 CA GLU A 10 2.513 -8.458 10.501 1.00 0.00 C ATOM 149 C GLU A 10 2.478 -8.325 9.017 1.00 0.00 C ATOM 150 O GLU A 10 2.165 -9.313 8.355 1.00 0.00 O ATOM 151 CB GLU A 10 1.159 -8.379 11.225 1.00 0.00 C ATOM 152 CG GLU A 10 0.282 -9.561 10.808 1.00 0.00 C ATOM 153 CD GLU A 10 -0.984 -9.841 11.605 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.793 -10.348 12.742 1.00 0.00 O ATOM 155 OE2 GLU A 10 -2.094 -9.670 11.034 1.00 0.00 O ATOM 0 H GLU A 10 2.898 -6.706 11.533 1.00 0.00 H new ATOM 0 HA GLU A 10 2.874 -9.473 10.667 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.312 -8.390 12.304 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.660 -7.440 10.983 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.007 -9.409 9.768 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.899 -10.459 10.839 1.00 0.00 H new ATOM 162 N ALA A 11 2.797 -7.149 8.448 1.00 0.00 N ATOM 163 CA ALA A 11 3.096 -6.870 7.078 1.00 0.00 C ATOM 164 C ALA A 11 4.317 -7.622 6.673 1.00 0.00 C ATOM 165 O ALA A 11 4.336 -8.370 5.697 1.00 0.00 O ATOM 166 CB ALA A 11 3.062 -5.389 6.665 1.00 0.00 C ATOM 0 H ALA A 11 2.850 -6.302 9.014 1.00 0.00 H new ATOM 0 HA ALA A 11 2.261 -7.244 6.485 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.304 -5.301 5.606 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.066 -4.984 6.844 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.791 -4.831 7.252 1.00 0.00 H new ATOM 172 N PHE A 12 5.434 -7.377 7.381 1.00 0.00 N ATOM 173 CA PHE A 12 6.771 -7.853 7.212 1.00 0.00 C ATOM 174 C PHE A 12 6.870 -9.340 7.228 1.00 0.00 C ATOM 175 O PHE A 12 7.640 -9.985 6.518 1.00 0.00 O ATOM 176 CB PHE A 12 7.667 -7.232 8.297 1.00 0.00 C ATOM 177 CG PHE A 12 9.067 -7.240 7.786 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.849 -8.363 7.926 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.600 -6.121 7.192 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.116 -8.402 7.395 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.865 -6.177 6.656 1.00 0.00 C ATOM 182 CZ PHE A 12 11.653 -7.297 6.778 1.00 0.00 C ATOM 0 H PHE A 12 5.385 -6.754 8.187 1.00 0.00 H new ATOM 0 HA PHE A 12 7.110 -7.544 6.223 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.347 -6.214 8.521 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.595 -7.800 9.224 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.464 -9.221 8.457 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.030 -5.205 7.147 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.696 -9.310 7.463 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.250 -5.319 6.125 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.665 -7.308 6.400 1.00 0.00 H new ATOM 192 N SER A 13 6.062 -9.954 8.111 1.00 0.00 N ATOM 193 CA SER A 13 5.883 -11.366 8.249 1.00 0.00 C ATOM 194 C SER A 13 5.220 -12.101 7.136 1.00 0.00 C ATOM 195 O SER A 13 5.398 -13.310 6.990 1.00 0.00 O ATOM 196 CB SER A 13 5.150 -11.700 9.559 1.00 0.00 C ATOM 197 OG SER A 13 5.724 -12.826 10.207 1.00 0.00 O ATOM 0 H SER A 13 5.495 -9.426 8.774 1.00 0.00 H new ATOM 0 HA SER A 13 6.913 -11.724 8.239 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.185 -10.839 10.226 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.099 -11.897 9.348 1.00 0.00 H new ATOM 0 HG SER A 13 5.236 -13.010 11.037 1.00 0.00 H new ATOM 203 N LEU A 14 4.394 -11.429 6.315 1.00 0.00 N ATOM 204 CA LEU A 14 3.980 -11.890 5.026 1.00 0.00 C ATOM 205 C LEU A 14 5.057 -12.064 4.012 1.00 0.00 C ATOM 206 O LEU A 14 5.242 -13.132 3.431 1.00 0.00 O ATOM 207 CB LEU A 14 2.870 -11.051 4.368 1.00 0.00 C ATOM 208 CG LEU A 14 1.505 -11.013 5.076 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.594 -10.022 4.333 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.837 -12.397 5.147 1.00 0.00 C ATOM 0 H LEU A 14 3.996 -10.522 6.561 1.00 0.00 H new ATOM 0 HA LEU A 14 3.598 -12.874 5.297 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.231 -10.027 4.275 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.716 -11.428 3.357 1.00 0.00 H new ATOM 0 HG LEU A 14 1.665 -10.692 6.105 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.379 -9.984 4.824 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.047 -9.031 4.347 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.467 -10.348 3.301 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.123 -12.312 5.656 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.680 -12.777 4.138 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.480 -13.084 5.697 1.00 0.00 H new ATOM 222 N PHE A 15 5.824 -10.982 3.786 1.00 0.00 N ATOM 223 CA PHE A 15 6.994 -11.073 2.970 1.00 0.00 C ATOM 224 C PHE A 15 8.058 -12.013 3.421 1.00 0.00 C ATOM 225 O PHE A 15 8.600 -12.813 2.660 1.00 0.00 O ATOM 226 CB PHE A 15 7.665 -9.716 2.698 1.00 0.00 C ATOM 227 CG PHE A 15 6.801 -8.748 1.966 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.952 -7.944 2.689 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.990 -8.590 0.613 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.258 -6.975 2.005 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.343 -7.582 -0.063 1.00 0.00 C ATOM 232 CZ PHE A 15 5.414 -6.855 0.644 1.00 0.00 C ATOM 0 H PHE A 15 5.637 -10.053 4.164 1.00 0.00 H new ATOM 0 HA PHE A 15 6.560 -11.485 2.059 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.964 -9.274 3.648 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.576 -9.882 2.122 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.835 -8.069 3.755 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.649 -9.260 0.080 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.592 -6.310 2.535 1.00 0.00 H new ATOM 0 HE2 PHE A 15 6.555 -7.371 -1.101 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.782 -6.162 0.109 1.00 0.00 H new ATOM 242 N ASP A 16 8.550 -11.967 4.672 1.00 0.00 N ATOM 243 CA ASP A 16 9.617 -12.751 5.211 1.00 0.00 C ATOM 244 C ASP A 16 9.283 -14.190 5.404 1.00 0.00 C ATOM 245 O ASP A 16 8.248 -14.499 5.992 1.00 0.00 O ATOM 246 CB ASP A 16 10.264 -12.241 6.509 1.00 0.00 C ATOM 247 CG ASP A 16 11.770 -12.463 6.490 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.487 -11.549 6.002 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.233 -13.605 6.756 1.00 0.00 O ATOM 0 H ASP A 16 8.166 -11.324 5.365 1.00 0.00 H new ATOM 0 HA ASP A 16 10.351 -12.636 4.414 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.051 -11.179 6.633 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.827 -12.756 7.364 1.00 0.00 H new ATOM 254 N LYS A 17 10.178 -15.110 5.002 1.00 0.00 N ATOM 255 CA LYS A 17 9.893 -16.510 5.060 1.00 0.00 C ATOM 256 C LYS A 17 10.649 -17.190 6.149 1.00 0.00 C ATOM 257 O LYS A 17 10.234 -18.199 6.717 1.00 0.00 O ATOM 258 CB LYS A 17 10.262 -17.136 3.704 1.00 0.00 C ATOM 259 CG LYS A 17 9.464 -18.429 3.522 1.00 0.00 C ATOM 260 CD LYS A 17 9.646 -19.109 2.163 1.00 0.00 C ATOM 261 CE LYS A 17 8.561 -20.125 1.802 1.00 0.00 C ATOM 262 NZ LYS A 17 8.647 -21.335 2.650 1.00 0.00 N ATOM 0 H LYS A 17 11.102 -14.883 4.635 1.00 0.00 H new ATOM 0 HA LYS A 17 8.832 -16.640 5.274 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.041 -16.440 2.895 1.00 0.00 H new ATOM 0 HB3 LYS A 17 11.331 -17.344 3.663 1.00 0.00 H new ATOM 0 HG2 LYS A 17 9.752 -19.130 4.305 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.406 -18.209 3.664 1.00 0.00 H new ATOM 0 HD2 LYS A 17 9.676 -18.341 1.390 1.00 0.00 H new ATOM 0 HD3 LYS A 17 10.613 -19.612 2.151 1.00 0.00 H new ATOM 0 HE2 LYS A 17 7.579 -19.667 1.919 1.00 0.00 H new ATOM 0 HE3 LYS A 17 8.659 -20.407 0.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 7.897 -22.003 2.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 9.575 -21.785 2.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 8.529 -21.068 3.648 1.00 0.00 H new ATOM 276 N ASP A 18 11.804 -16.629 6.549 1.00 0.00 N ATOM 277 CA ASP A 18 12.476 -17.068 7.732 1.00 0.00 C ATOM 278 C ASP A 18 11.853 -16.620 9.009 1.00 0.00 C ATOM 279 O ASP A 18 11.717 -17.353 9.987 1.00 0.00 O ATOM 280 CB ASP A 18 13.823 -16.327 7.768 1.00 0.00 C ATOM 281 CG ASP A 18 14.654 -16.432 6.497 1.00 0.00 C ATOM 282 OD1 ASP A 18 14.957 -17.549 6.000 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.957 -15.348 5.930 1.00 0.00 O ATOM 0 H ASP A 18 12.273 -15.871 6.053 1.00 0.00 H new ATOM 0 HA ASP A 18 12.488 -18.157 7.679 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.635 -15.273 7.974 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.411 -16.714 8.600 1.00 0.00 H new ATOM 288 N GLY A 19 11.392 -15.356 8.993 1.00 0.00 N ATOM 289 CA GLY A 19 10.893 -14.634 10.121 1.00 0.00 C ATOM 290 C GLY A 19 11.888 -13.776 10.824 1.00 0.00 C ATOM 291 O GLY A 19 11.625 -13.465 11.985 1.00 0.00 O ATOM 0 H GLY A 19 11.367 -14.804 8.136 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.066 -14.005 9.791 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.485 -15.348 10.836 1.00 0.00 H new ATOM 295 N ASP A 20 13.032 -13.466 10.188 1.00 0.00 N ATOM 296 CA ASP A 20 14.212 -12.893 10.758 1.00 0.00 C ATOM 297 C ASP A 20 14.015 -11.429 10.950 1.00 0.00 C ATOM 298 O ASP A 20 13.525 -10.920 11.956 1.00 0.00 O ATOM 299 CB ASP A 20 15.424 -13.357 9.933 1.00 0.00 C ATOM 300 CG ASP A 20 15.554 -13.099 8.439 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.696 -12.429 7.804 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.566 -13.579 7.862 1.00 0.00 O ATOM 0 H ASP A 20 13.139 -13.632 9.187 1.00 0.00 H new ATOM 0 HA ASP A 20 14.424 -13.244 11.768 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.304 -12.917 10.401 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.497 -14.436 10.069 1.00 0.00 H new ATOM 307 N GLY A 21 14.346 -10.651 9.904 1.00 0.00 N ATOM 308 CA GLY A 21 13.834 -9.327 9.730 1.00 0.00 C ATOM 309 C GLY A 21 14.474 -8.622 8.584 1.00 0.00 C ATOM 310 O GLY A 21 14.595 -7.398 8.618 1.00 0.00 O ATOM 0 H GLY A 21 14.982 -10.948 9.164 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.757 -9.374 9.570 1.00 0.00 H new ATOM 0 HA3 GLY A 21 13.996 -8.754 10.643 1.00 0.00 H new ATOM 314 N THR A 22 14.893 -9.426 7.592 1.00 0.00 N ATOM 315 CA THR A 22 15.496 -8.857 6.427 1.00 0.00 C ATOM 316 C THR A 22 14.926 -9.565 5.246 1.00 0.00 C ATOM 317 O THR A 22 15.229 -10.755 5.177 1.00 0.00 O ATOM 318 CB THR A 22 16.994 -8.856 6.345 1.00 0.00 C ATOM 319 OG1 THR A 22 17.572 -10.135 6.559 1.00 0.00 O ATOM 320 CG2 THR A 22 17.569 -7.834 7.340 1.00 0.00 C ATOM 0 H THR A 22 14.818 -10.443 7.593 1.00 0.00 H new ATOM 0 HA THR A 22 15.259 -7.794 6.466 1.00 0.00 H new ATOM 0 HB THR A 22 17.254 -8.572 5.325 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.009 -10.822 6.144 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.657 -7.837 7.277 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.194 -6.840 7.098 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.264 -8.100 8.352 1.00 0.00 H new ATOM 328 N ILE A 23 14.245 -8.975 4.248 1.00 0.00 N ATOM 329 CA ILE A 23 13.706 -9.609 3.085 1.00 0.00 C ATOM 330 C ILE A 23 14.677 -9.689 1.957 1.00 0.00 C ATOM 331 O ILE A 23 15.232 -8.678 1.530 1.00 0.00 O ATOM 332 CB ILE A 23 12.392 -9.041 2.636 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.424 -8.918 3.825 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.831 -9.818 1.433 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.419 -7.780 3.658 1.00 0.00 C ATOM 0 H ILE A 23 14.057 -7.973 4.257 1.00 0.00 H new ATOM 0 HA ILE A 23 13.503 -10.630 3.408 1.00 0.00 H new ATOM 0 HB ILE A 23 12.541 -8.025 2.269 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.885 -9.857 3.947 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.997 -8.759 4.739 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.878 -9.383 1.131 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.535 -9.762 0.603 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.681 -10.861 1.711 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.763 -7.743 4.528 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.953 -6.834 3.565 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.823 -7.950 2.761 1.00 0.00 H new ATOM 347 N THR A 24 14.974 -10.874 1.396 1.00 0.00 N ATOM 348 CA THR A 24 15.776 -11.082 0.231 1.00 0.00 C ATOM 349 C THR A 24 15.069 -10.817 -1.054 1.00 0.00 C ATOM 350 O THR A 24 13.878 -10.545 -1.195 1.00 0.00 O ATOM 351 CB THR A 24 16.470 -12.412 0.231 1.00 0.00 C ATOM 352 OG1 THR A 24 15.603 -13.472 -0.146 1.00 0.00 O ATOM 353 CG2 THR A 24 17.104 -12.655 1.611 1.00 0.00 C ATOM 0 H THR A 24 14.628 -11.750 1.786 1.00 0.00 H new ATOM 0 HA THR A 24 16.552 -10.319 0.295 1.00 0.00 H new ATOM 0 HB THR A 24 17.258 -12.391 -0.522 1.00 0.00 H new ATOM 0 HG1 THR A 24 16.046 -14.331 0.018 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.609 -13.621 1.614 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.826 -11.867 1.823 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.326 -12.650 2.375 1.00 0.00 H new ATOM 361 N THR A 25 15.841 -10.942 -2.148 1.00 0.00 N ATOM 362 CA THR A 25 15.378 -11.170 -3.482 1.00 0.00 C ATOM 363 C THR A 25 14.453 -12.327 -3.645 1.00 0.00 C ATOM 364 O THR A 25 13.351 -12.331 -4.191 1.00 0.00 O ATOM 365 CB THR A 25 16.493 -11.364 -4.466 1.00 0.00 C ATOM 366 OG1 THR A 25 17.516 -12.221 -3.979 1.00 0.00 O ATOM 367 CG2 THR A 25 17.138 -10.021 -4.845 1.00 0.00 C ATOM 0 H THR A 25 16.858 -10.879 -2.096 1.00 0.00 H new ATOM 0 HA THR A 25 14.828 -10.251 -3.688 1.00 0.00 H new ATOM 0 HB THR A 25 16.033 -11.828 -5.339 1.00 0.00 H new ATOM 0 HG1 THR A 25 18.216 -12.314 -4.659 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.943 -10.193 -5.560 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.387 -9.371 -5.294 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.542 -9.546 -3.951 1.00 0.00 H new ATOM 375 N LYS A 26 14.926 -13.469 -3.115 1.00 0.00 N ATOM 376 CA LYS A 26 14.311 -14.746 -3.301 1.00 0.00 C ATOM 377 C LYS A 26 12.984 -14.790 -2.625 1.00 0.00 C ATOM 378 O LYS A 26 11.973 -15.338 -3.063 1.00 0.00 O ATOM 379 CB LYS A 26 15.148 -15.859 -2.648 1.00 0.00 C ATOM 380 CG LYS A 26 16.548 -16.035 -3.240 1.00 0.00 C ATOM 381 CD LYS A 26 17.011 -17.474 -3.006 1.00 0.00 C ATOM 382 CE LYS A 26 18.526 -17.650 -3.122 1.00 0.00 C ATOM 383 NZ LYS A 26 18.899 -17.181 -4.476 1.00 0.00 N ATOM 0 H LYS A 26 15.766 -13.504 -2.537 1.00 0.00 H new ATOM 0 HA LYS A 26 14.222 -14.896 -4.377 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.242 -15.647 -1.583 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.608 -16.802 -2.739 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.536 -15.812 -4.307 1.00 0.00 H new ATOM 0 HG3 LYS A 26 17.244 -15.336 -2.776 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.690 -17.795 -2.015 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.520 -18.128 -3.727 1.00 0.00 H new ATOM 0 HE2 LYS A 26 19.044 -17.074 -2.355 1.00 0.00 H new ATOM 0 HE3 LYS A 26 18.808 -18.694 -2.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.866 -17.493 -4.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 18.239 -17.577 -5.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.855 -16.142 -4.508 1.00 0.00 H new ATOM 397 N GLU A 27 12.876 -14.106 -1.472 1.00 0.00 N ATOM 398 CA GLU A 27 11.704 -14.110 -0.652 1.00 0.00 C ATOM 399 C GLU A 27 10.567 -13.296 -1.166 1.00 0.00 C ATOM 400 O GLU A 27 9.391 -13.536 -0.896 1.00 0.00 O ATOM 401 CB GLU A 27 11.919 -13.672 0.807 1.00 0.00 C ATOM 402 CG GLU A 27 12.682 -14.630 1.724 1.00 0.00 C ATOM 403 CD GLU A 27 13.149 -14.004 3.030 1.00 0.00 C ATOM 404 OE1 GLU A 27 14.032 -13.111 3.135 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.657 -14.457 4.098 1.00 0.00 O ATOM 0 H GLU A 27 13.630 -13.530 -1.098 1.00 0.00 H new ATOM 0 HA GLU A 27 11.455 -15.170 -0.690 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.449 -12.720 0.798 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.941 -13.488 1.251 1.00 0.00 H new ATOM 0 HG2 GLU A 27 12.043 -15.484 1.951 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.550 -15.015 1.188 1.00 0.00 H new ATOM 412 N LEU A 28 10.968 -12.278 -1.948 1.00 0.00 N ATOM 413 CA LEU A 28 10.254 -11.230 -2.610 1.00 0.00 C ATOM 414 C LEU A 28 9.750 -11.733 -3.919 1.00 0.00 C ATOM 415 O LEU A 28 8.603 -11.497 -4.293 1.00 0.00 O ATOM 416 CB LEU A 28 11.221 -10.051 -2.812 1.00 0.00 C ATOM 417 CG LEU A 28 10.565 -8.801 -3.422 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.524 -8.195 -2.466 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.628 -7.788 -3.880 1.00 0.00 C ATOM 0 H LEU A 28 11.964 -12.181 -2.144 1.00 0.00 H new ATOM 0 HA LEU A 28 9.400 -10.901 -2.018 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.660 -9.786 -1.850 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.038 -10.372 -3.458 1.00 0.00 H new ATOM 0 HG LEU A 28 10.018 -9.099 -4.317 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.078 -7.313 -2.926 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.746 -8.931 -2.262 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.009 -7.911 -1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.137 -6.914 -4.307 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.232 -7.483 -3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.269 -8.248 -4.632 1.00 0.00 H new ATOM 431 N GLY A 29 10.585 -12.497 -4.645 1.00 0.00 N ATOM 432 CA GLY A 29 10.266 -13.188 -5.856 1.00 0.00 C ATOM 433 C GLY A 29 9.260 -14.245 -5.554 1.00 0.00 C ATOM 434 O GLY A 29 8.206 -14.190 -6.186 1.00 0.00 O ATOM 0 H GLY A 29 11.555 -12.642 -4.364 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.871 -12.491 -6.595 1.00 0.00 H new ATOM 0 HA3 GLY A 29 11.164 -13.633 -6.285 1.00 0.00 H new ATOM 438 N THR A 30 9.435 -15.138 -4.564 1.00 0.00 N ATOM 439 CA THR A 30 8.484 -16.030 -3.977 1.00 0.00 C ATOM 440 C THR A 30 7.078 -15.585 -3.762 1.00 0.00 C ATOM 441 O THR A 30 6.147 -16.267 -4.186 1.00 0.00 O ATOM 442 CB THR A 30 8.865 -16.527 -2.614 1.00 0.00 C ATOM 443 OG1 THR A 30 10.140 -17.151 -2.595 1.00 0.00 O ATOM 444 CG2 THR A 30 8.017 -17.679 -2.048 1.00 0.00 C ATOM 0 H THR A 30 10.350 -15.244 -4.127 1.00 0.00 H new ATOM 0 HA THR A 30 8.514 -16.768 -4.779 1.00 0.00 H new ATOM 0 HB THR A 30 8.765 -15.603 -2.045 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.833 -16.474 -2.450 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.387 -17.952 -1.060 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.977 -17.362 -1.972 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.085 -18.541 -2.711 1.00 0.00 H new ATOM 452 N VAL A 31 6.843 -14.388 -3.196 1.00 0.00 N ATOM 453 CA VAL A 31 5.493 -14.046 -2.870 1.00 0.00 C ATOM 454 C VAL A 31 4.675 -13.531 -4.004 1.00 0.00 C ATOM 455 O VAL A 31 3.480 -13.797 -4.118 1.00 0.00 O ATOM 456 CB VAL A 31 5.419 -13.137 -1.679 1.00 0.00 C ATOM 457 CG1 VAL A 31 6.502 -12.050 -1.765 1.00 0.00 C ATOM 458 CG2 VAL A 31 4.078 -12.479 -1.313 1.00 0.00 C ATOM 0 H VAL A 31 7.549 -13.687 -2.972 1.00 0.00 H new ATOM 0 HA VAL A 31 5.031 -14.998 -2.609 1.00 0.00 H new ATOM 0 HB VAL A 31 5.576 -13.843 -0.863 1.00 0.00 H new ATOM 0 HG11 VAL A 31 6.434 -11.399 -0.893 1.00 0.00 H new ATOM 0 HG12 VAL A 31 7.486 -12.518 -1.793 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.355 -11.461 -2.670 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.208 -11.856 -0.428 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.737 -11.862 -2.144 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.338 -13.252 -1.108 1.00 0.00 H new ATOM 468 N MET A 32 5.363 -12.889 -4.965 1.00 0.00 N ATOM 469 CA MET A 32 4.810 -12.348 -6.168 1.00 0.00 C ATOM 470 C MET A 32 4.542 -13.502 -7.071 1.00 0.00 C ATOM 471 O MET A 32 3.642 -13.394 -7.902 1.00 0.00 O ATOM 472 CB MET A 32 5.874 -11.491 -6.874 1.00 0.00 C ATOM 473 CG MET A 32 6.300 -10.220 -6.136 1.00 0.00 C ATOM 474 SD MET A 32 7.745 -9.431 -6.908 1.00 0.00 S ATOM 475 CE MET A 32 7.958 -8.057 -5.741 1.00 0.00 C ATOM 0 H MET A 32 6.370 -12.739 -4.897 1.00 0.00 H new ATOM 0 HA MET A 32 3.921 -11.758 -5.946 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.758 -12.106 -7.040 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.494 -11.209 -7.856 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.469 -9.515 -6.120 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.532 -10.464 -5.099 1.00 0.00 H new ATOM 0 HE1 MET A 32 9.000 -7.737 -5.742 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.322 -7.224 -6.040 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.680 -8.384 -4.739 1.00 0.00 H new ATOM 485 N ARG A 33 5.252 -14.638 -6.950 1.00 0.00 N ATOM 486 CA ARG A 33 5.005 -15.893 -7.590 1.00 0.00 C ATOM 487 C ARG A 33 3.912 -16.740 -7.033 1.00 0.00 C ATOM 488 O ARG A 33 3.316 -17.545 -7.747 1.00 0.00 O ATOM 489 CB ARG A 33 6.340 -16.656 -7.540 1.00 0.00 C ATOM 490 CG ARG A 33 6.517 -17.745 -8.599 1.00 0.00 C ATOM 491 CD ARG A 33 7.560 -18.811 -8.259 1.00 0.00 C ATOM 492 NE ARG A 33 8.874 -18.135 -8.452 1.00 0.00 N ATOM 493 CZ ARG A 33 9.863 -18.268 -7.520 1.00 0.00 C ATOM 494 NH1 ARG A 33 9.575 -18.785 -6.290 1.00 0.00 N ATOM 495 NH2 ARG A 33 11.150 -18.001 -7.886 1.00 0.00 N ATOM 0 H ARG A 33 6.074 -14.680 -6.348 1.00 0.00 H new ATOM 0 HA ARG A 33 4.643 -15.673 -8.595 1.00 0.00 H new ATOM 0 HB2 ARG A 33 7.153 -15.937 -7.644 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.441 -17.112 -6.555 1.00 0.00 H new ATOM 0 HG2 ARG A 33 5.557 -18.235 -8.759 1.00 0.00 H new ATOM 0 HG3 ARG A 33 6.795 -17.273 -9.541 1.00 0.00 H new ATOM 0 HD2 ARG A 33 7.444 -19.165 -7.235 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.463 -19.680 -8.909 1.00 0.00 H new ATOM 0 HE ARG A 33 9.036 -17.570 -9.285 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.622 -19.072 -6.068 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.313 -18.885 -5.593 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.358 -17.708 -8.841 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.904 -18.094 -7.205 1.00 0.00 H new ATOM 509 N SER A 34 3.581 -16.511 -5.750 1.00 0.00 N ATOM 510 CA SER A 34 2.370 -17.003 -5.170 1.00 0.00 C ATOM 511 C SER A 34 1.181 -16.295 -5.724 1.00 0.00 C ATOM 512 O SER A 34 0.066 -16.809 -5.797 1.00 0.00 O ATOM 513 CB SER A 34 2.195 -17.033 -3.643 1.00 0.00 C ATOM 514 OG SER A 34 3.355 -17.615 -3.069 1.00 0.00 O ATOM 0 H SER A 34 4.163 -15.976 -5.105 1.00 0.00 H new ATOM 0 HA SER A 34 2.455 -18.052 -5.453 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.048 -16.024 -3.259 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.309 -17.609 -3.374 1.00 0.00 H new ATOM 0 HG SER A 34 3.260 -17.640 -2.094 1.00 0.00 H new ATOM 520 N LEU A 35 1.302 -14.976 -5.957 1.00 0.00 N ATOM 521 CA LEU A 35 0.253 -14.180 -6.513 1.00 0.00 C ATOM 522 C LEU A 35 -0.136 -14.496 -7.917 1.00 0.00 C ATOM 523 O LEU A 35 -1.310 -14.704 -8.218 1.00 0.00 O ATOM 524 CB LEU A 35 0.672 -12.701 -6.460 1.00 0.00 C ATOM 525 CG LEU A 35 0.042 -11.868 -5.331 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.278 -12.433 -3.920 1.00 0.00 C ATOM 527 CD2 LEU A 35 0.671 -10.467 -5.412 1.00 0.00 C ATOM 0 H LEU A 35 2.152 -14.449 -5.753 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.622 -14.406 -5.904 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.756 -12.653 -6.360 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.419 -12.237 -7.413 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.038 -11.870 -5.476 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.199 -11.786 -3.184 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -0.148 -13.434 -3.853 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.349 -12.480 -3.721 1.00 0.00 H new ATOM 0 HD21 LEU A 35 0.254 -9.835 -4.628 1.00 0.00 H new ATOM 0 HD22 LEU A 35 1.750 -10.545 -5.281 1.00 0.00 H new ATOM 0 HD23 LEU A 35 0.455 -10.027 -6.385 1.00 0.00 H new ATOM 539 N GLY A 36 0.866 -14.494 -8.814 1.00 0.00 N ATOM 540 CA GLY A 36 0.647 -15.030 -10.122 1.00 0.00 C ATOM 541 C GLY A 36 1.653 -14.596 -11.132 1.00 0.00 C ATOM 542 O GLY A 36 1.464 -14.792 -12.331 1.00 0.00 O ATOM 0 H GLY A 36 1.804 -14.132 -8.642 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.653 -16.118 -10.063 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.345 -14.735 -10.463 1.00 0.00 H new ATOM 546 N GLN A 37 2.838 -14.089 -10.747 1.00 0.00 N ATOM 547 CA GLN A 37 3.845 -13.788 -11.717 1.00 0.00 C ATOM 548 C GLN A 37 4.943 -14.787 -11.847 1.00 0.00 C ATOM 549 O GLN A 37 5.190 -15.578 -10.938 1.00 0.00 O ATOM 550 CB GLN A 37 4.455 -12.419 -11.370 1.00 0.00 C ATOM 551 CG GLN A 37 3.455 -11.277 -11.176 1.00 0.00 C ATOM 552 CD GLN A 37 2.736 -10.957 -12.478 1.00 0.00 C ATOM 553 OE1 GLN A 37 3.135 -11.259 -13.601 1.00 0.00 O ATOM 554 NE2 GLN A 37 1.557 -10.310 -12.275 1.00 0.00 N ATOM 0 H GLN A 37 3.097 -13.890 -9.781 1.00 0.00 H new ATOM 0 HA GLN A 37 3.338 -13.799 -12.682 1.00 0.00 H new ATOM 0 HB2 GLN A 37 5.041 -12.524 -10.457 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.149 -12.139 -12.163 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.727 -11.551 -10.412 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.976 -10.390 -10.816 1.00 0.00 H new ATOM 0 HE21 GLN A 37 1.260 -10.076 -11.328 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.970 -10.058 -13.070 1.00 0.00 H new ATOM 563 N ASN A 38 5.721 -14.790 -12.943 1.00 0.00 N ATOM 564 CA ASN A 38 6.969 -15.464 -13.131 1.00 0.00 C ATOM 565 C ASN A 38 8.132 -14.550 -12.951 1.00 0.00 C ATOM 566 O ASN A 38 8.615 -14.037 -13.959 1.00 0.00 O ATOM 567 CB ASN A 38 6.952 -16.103 -14.529 1.00 0.00 C ATOM 568 CG ASN A 38 8.128 -17.052 -14.711 1.00 0.00 C ATOM 569 OD1 ASN A 38 8.159 -18.139 -14.136 1.00 0.00 O ATOM 570 ND2 ASN A 38 9.111 -16.651 -15.561 1.00 0.00 N ATOM 0 H ASN A 38 5.449 -14.270 -13.777 1.00 0.00 H new ATOM 0 HA ASN A 38 7.088 -16.237 -12.372 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.017 -16.645 -14.673 1.00 0.00 H new ATOM 0 HB3 ASN A 38 6.989 -15.323 -15.289 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.910 -17.260 -15.740 1.00 0.00 H new ATOM 0 HD22 ASN A 38 9.049 -15.742 -16.019 1.00 0.00 H new ATOM 577 N PRO A 39 8.627 -14.123 -11.827 1.00 0.00 N ATOM 578 CA PRO A 39 9.657 -13.127 -11.771 1.00 0.00 C ATOM 579 C PRO A 39 11.031 -13.617 -12.072 1.00 0.00 C ATOM 580 O PRO A 39 11.382 -14.752 -11.757 1.00 0.00 O ATOM 581 CB PRO A 39 9.748 -12.628 -10.331 1.00 0.00 C ATOM 582 CG PRO A 39 9.174 -13.818 -9.547 1.00 0.00 C ATOM 583 CD PRO A 39 8.106 -14.388 -10.494 1.00 0.00 C ATOM 0 HA PRO A 39 9.376 -12.385 -12.519 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.774 -12.404 -10.040 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.167 -11.719 -10.176 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.943 -14.556 -9.318 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.742 -13.502 -8.597 1.00 0.00 H new ATOM 0 HD2 PRO A 39 7.958 -15.455 -10.330 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.141 -13.905 -10.341 1.00 0.00 H new ATOM 591 N THR A 40 11.895 -12.836 -12.747 1.00 0.00 N ATOM 592 CA THR A 40 13.267 -13.072 -13.072 1.00 0.00 C ATOM 593 C THR A 40 14.143 -12.254 -12.187 1.00 0.00 C ATOM 594 O THR A 40 13.626 -11.391 -11.479 1.00 0.00 O ATOM 595 CB THR A 40 13.512 -12.877 -14.539 1.00 0.00 C ATOM 596 OG1 THR A 40 14.740 -13.436 -14.982 1.00 0.00 O ATOM 597 CG2 THR A 40 13.519 -11.398 -14.961 1.00 0.00 C ATOM 0 H THR A 40 11.590 -11.931 -13.106 1.00 0.00 H new ATOM 0 HA THR A 40 13.524 -14.113 -12.879 1.00 0.00 H new ATOM 0 HB THR A 40 12.674 -13.397 -15.004 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.843 -13.279 -15.944 1.00 0.00 H new ATOM 0 HG21 THR A 40 13.701 -11.326 -16.033 1.00 0.00 H new ATOM 0 HG22 THR A 40 12.554 -10.948 -14.726 1.00 0.00 H new ATOM 0 HG23 THR A 40 14.306 -10.870 -14.423 1.00 0.00 H new ATOM 605 N GLU A 41 15.458 -12.537 -12.170 1.00 0.00 N ATOM 606 CA GLU A 41 16.435 -11.905 -11.339 1.00 0.00 C ATOM 607 C GLU A 41 16.639 -10.450 -11.587 1.00 0.00 C ATOM 608 O GLU A 41 16.634 -9.659 -10.645 1.00 0.00 O ATOM 609 CB GLU A 41 17.778 -12.652 -11.396 1.00 0.00 C ATOM 610 CG GLU A 41 17.698 -14.176 -11.278 1.00 0.00 C ATOM 611 CD GLU A 41 17.490 -14.690 -9.861 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.366 -14.647 -9.292 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.455 -15.175 -9.211 1.00 0.00 O ATOM 0 H GLU A 41 15.863 -13.252 -12.775 1.00 0.00 H new ATOM 0 HA GLU A 41 16.016 -11.967 -10.334 1.00 0.00 H new ATOM 0 HB2 GLU A 41 18.270 -12.405 -12.337 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.415 -12.277 -10.595 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.881 -14.534 -11.904 1.00 0.00 H new ATOM 0 HG3 GLU A 41 18.617 -14.607 -11.676 1.00 0.00 H new ATOM 620 N ALA A 42 16.711 -10.059 -12.871 1.00 0.00 N ATOM 621 CA ALA A 42 16.897 -8.728 -13.361 1.00 0.00 C ATOM 622 C ALA A 42 15.958 -7.677 -12.876 1.00 0.00 C ATOM 623 O ALA A 42 16.365 -6.578 -12.503 1.00 0.00 O ATOM 624 CB ALA A 42 16.889 -8.702 -14.899 1.00 0.00 C ATOM 0 H ALA A 42 16.632 -10.734 -13.632 1.00 0.00 H new ATOM 0 HA ALA A 42 17.867 -8.464 -12.940 1.00 0.00 H new ATOM 0 HB1 ALA A 42 17.032 -7.679 -15.246 1.00 0.00 H new ATOM 0 HB2 ALA A 42 17.695 -9.330 -15.278 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.934 -9.079 -15.264 1.00 0.00 H new ATOM 630 N GLU A 43 14.657 -8.013 -12.841 1.00 0.00 N ATOM 631 CA GLU A 43 13.651 -7.142 -12.317 1.00 0.00 C ATOM 632 C GLU A 43 13.667 -7.069 -10.829 1.00 0.00 C ATOM 633 O GLU A 43 13.425 -6.025 -10.227 1.00 0.00 O ATOM 634 CB GLU A 43 12.248 -7.681 -12.646 1.00 0.00 C ATOM 635 CG GLU A 43 11.091 -6.794 -12.182 1.00 0.00 C ATOM 636 CD GLU A 43 9.826 -7.051 -12.988 1.00 0.00 C ATOM 637 OE1 GLU A 43 9.037 -7.990 -12.697 1.00 0.00 O ATOM 638 OE2 GLU A 43 9.616 -6.375 -14.030 1.00 0.00 O ATOM 0 H GLU A 43 14.297 -8.904 -13.182 1.00 0.00 H new ATOM 0 HA GLU A 43 13.862 -6.170 -12.764 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.171 -7.818 -13.725 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.137 -8.665 -12.191 1.00 0.00 H new ATOM 0 HG2 GLU A 43 10.893 -6.977 -11.126 1.00 0.00 H new ATOM 0 HG3 GLU A 43 11.376 -5.746 -12.276 1.00 0.00 H new ATOM 645 N LEU A 44 13.842 -8.166 -10.070 1.00 0.00 N ATOM 646 CA LEU A 44 13.853 -8.231 -8.642 1.00 0.00 C ATOM 647 C LEU A 44 14.995 -7.443 -8.099 1.00 0.00 C ATOM 648 O LEU A 44 14.911 -6.689 -7.130 1.00 0.00 O ATOM 649 CB LEU A 44 14.019 -9.678 -8.148 1.00 0.00 C ATOM 650 CG LEU A 44 12.756 -10.555 -8.148 1.00 0.00 C ATOM 651 CD1 LEU A 44 13.232 -11.923 -7.633 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.526 -10.070 -7.361 1.00 0.00 C ATOM 0 H LEU A 44 13.988 -9.083 -10.493 1.00 0.00 H new ATOM 0 HA LEU A 44 12.900 -7.828 -8.298 1.00 0.00 H new ATOM 0 HB2 LEU A 44 14.772 -10.165 -8.768 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.413 -9.648 -7.132 1.00 0.00 H new ATOM 0 HG LEU A 44 12.358 -10.550 -9.163 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.389 -12.613 -7.601 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.998 -12.317 -8.301 1.00 0.00 H new ATOM 0 HD13 LEU A 44 13.647 -11.810 -6.631 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.721 -10.798 -7.460 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.788 -9.959 -6.309 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.197 -9.109 -7.756 1.00 0.00 H new ATOM 664 N GLN A 45 16.163 -7.547 -8.757 1.00 0.00 N ATOM 665 CA GLN A 45 17.255 -6.653 -8.526 1.00 0.00 C ATOM 666 C GLN A 45 16.911 -5.213 -8.691 1.00 0.00 C ATOM 667 O GLN A 45 17.386 -4.406 -7.894 1.00 0.00 O ATOM 668 CB GLN A 45 18.444 -7.016 -9.432 1.00 0.00 C ATOM 669 CG GLN A 45 19.790 -6.593 -8.842 1.00 0.00 C ATOM 670 CD GLN A 45 21.015 -7.189 -9.522 1.00 0.00 C ATOM 671 OE1 GLN A 45 21.103 -8.404 -9.687 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.927 -6.277 -9.953 1.00 0.00 N ATOM 0 H GLN A 45 16.353 -8.262 -9.460 1.00 0.00 H new ATOM 0 HA GLN A 45 17.525 -6.781 -7.478 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.450 -8.093 -9.602 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.313 -6.540 -10.404 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.862 -5.506 -8.887 1.00 0.00 H new ATOM 0 HG3 GLN A 45 19.809 -6.870 -7.788 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.778 -5.284 -9.775 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.760 -6.586 -10.455 1.00 0.00 H new ATOM 681 N ASP A 46 16.124 -4.792 -9.698 1.00 0.00 N ATOM 682 CA ASP A 46 15.671 -3.437 -9.734 1.00 0.00 C ATOM 683 C ASP A 46 14.825 -3.042 -8.572 1.00 0.00 C ATOM 684 O ASP A 46 14.971 -1.989 -7.953 1.00 0.00 O ATOM 685 CB ASP A 46 15.091 -3.211 -11.141 1.00 0.00 C ATOM 686 CG ASP A 46 15.023 -1.746 -11.548 1.00 0.00 C ATOM 687 OD1 ASP A 46 16.059 -1.029 -11.587 1.00 0.00 O ATOM 688 OD2 ASP A 46 13.887 -1.310 -11.873 1.00 0.00 O ATOM 0 H ASP A 46 15.807 -5.376 -10.472 1.00 0.00 H new ATOM 0 HA ASP A 46 16.492 -2.735 -9.590 1.00 0.00 H new ATOM 0 HB2 ASP A 46 15.699 -3.752 -11.866 1.00 0.00 H new ATOM 0 HB3 ASP A 46 14.089 -3.637 -11.184 1.00 0.00 H new ATOM 693 N MET A 47 13.874 -3.908 -8.180 1.00 0.00 N ATOM 694 CA MET A 47 12.979 -3.690 -7.087 1.00 0.00 C ATOM 695 C MET A 47 13.726 -3.561 -5.804 1.00 0.00 C ATOM 696 O MET A 47 13.597 -2.561 -5.100 1.00 0.00 O ATOM 697 CB MET A 47 11.909 -4.787 -6.947 1.00 0.00 C ATOM 698 CG MET A 47 10.900 -4.772 -8.097 1.00 0.00 C ATOM 699 SD MET A 47 10.007 -6.353 -8.014 1.00 0.00 S ATOM 700 CE MET A 47 8.680 -5.683 -9.056 1.00 0.00 C ATOM 0 H MET A 47 13.722 -4.802 -8.647 1.00 0.00 H new ATOM 0 HA MET A 47 12.462 -2.757 -7.311 1.00 0.00 H new ATOM 0 HB2 MET A 47 12.396 -5.762 -6.908 1.00 0.00 H new ATOM 0 HB3 MET A 47 11.381 -4.656 -6.003 1.00 0.00 H new ATOM 0 HG2 MET A 47 10.213 -3.932 -8.000 1.00 0.00 H new ATOM 0 HG3 MET A 47 11.406 -4.661 -9.056 1.00 0.00 H new ATOM 0 HE1 MET A 47 7.945 -6.463 -9.255 1.00 0.00 H new ATOM 0 HE2 MET A 47 8.198 -4.852 -8.541 1.00 0.00 H new ATOM 0 HE3 MET A 47 9.100 -5.331 -9.998 1.00 0.00 H new ATOM 710 N ILE A 48 14.698 -4.452 -5.538 1.00 0.00 N ATOM 711 CA ILE A 48 15.662 -4.472 -4.482 1.00 0.00 C ATOM 712 C ILE A 48 16.463 -3.217 -4.447 1.00 0.00 C ATOM 713 O ILE A 48 16.409 -2.482 -3.463 1.00 0.00 O ATOM 714 CB ILE A 48 16.350 -5.789 -4.278 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.374 -6.817 -3.680 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.650 -5.668 -3.465 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.796 -6.584 -2.284 1.00 0.00 C ATOM 0 H ILE A 48 14.819 -5.262 -6.146 1.00 0.00 H new ATOM 0 HA ILE A 48 15.132 -4.437 -3.530 1.00 0.00 H new ATOM 0 HB ILE A 48 16.661 -6.151 -5.258 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.535 -6.910 -4.369 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.883 -7.781 -3.666 1.00 0.00 H new ATOM 0 HG21 ILE A 48 18.101 -6.654 -3.351 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.345 -5.009 -3.986 1.00 0.00 H new ATOM 0 HG23 ILE A 48 17.427 -5.255 -2.481 1.00 0.00 H new ATOM 0 HD11 ILE A 48 14.129 -7.406 -2.024 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.608 -6.532 -1.558 1.00 0.00 H new ATOM 0 HD13 ILE A 48 14.238 -5.648 -2.273 1.00 0.00 H new ATOM 729 N ASN A 49 17.231 -2.926 -5.513 1.00 0.00 N ATOM 730 CA ASN A 49 17.978 -1.713 -5.641 1.00 0.00 C ATOM 731 C ASN A 49 17.403 -0.430 -5.148 1.00 0.00 C ATOM 732 O ASN A 49 17.955 0.158 -4.219 1.00 0.00 O ATOM 733 CB ASN A 49 18.556 -1.468 -7.045 1.00 0.00 C ATOM 734 CG ASN A 49 19.810 -2.315 -7.211 1.00 0.00 C ATOM 735 OD1 ASN A 49 19.887 -3.496 -6.878 1.00 0.00 O ATOM 736 ND2 ASN A 49 20.892 -1.624 -7.662 1.00 0.00 N ATOM 0 H ASN A 49 17.335 -3.554 -6.310 1.00 0.00 H new ATOM 0 HA ASN A 49 18.756 -1.965 -4.921 1.00 0.00 H new ATOM 0 HB2 ASN A 49 17.821 -1.728 -7.807 1.00 0.00 H new ATOM 0 HB3 ASN A 49 18.793 -0.412 -7.177 1.00 0.00 H new ATOM 0 HD21 ASN A 49 21.799 -2.085 -7.731 1.00 0.00 H new ATOM 0 HD22 ASN A 49 20.796 -0.645 -7.931 1.00 0.00 H new ATOM 743 N GLU A 50 16.167 -0.148 -5.599 1.00 0.00 N ATOM 744 CA GLU A 50 15.444 1.078 -5.462 1.00 0.00 C ATOM 745 C GLU A 50 15.076 1.398 -4.054 1.00 0.00 C ATOM 746 O GLU A 50 15.093 2.543 -3.608 1.00 0.00 O ATOM 747 CB GLU A 50 14.204 1.104 -6.372 1.00 0.00 C ATOM 748 CG GLU A 50 14.560 1.237 -7.854 1.00 0.00 C ATOM 749 CD GLU A 50 15.243 2.572 -8.115 1.00 0.00 C ATOM 750 OE1 GLU A 50 14.832 3.615 -7.540 1.00 0.00 O ATOM 751 OE2 GLU A 50 16.233 2.525 -8.892 1.00 0.00 O ATOM 0 H GLU A 50 15.625 -0.847 -6.107 1.00 0.00 H new ATOM 0 HA GLU A 50 16.130 1.862 -5.785 1.00 0.00 H new ATOM 0 HB2 GLU A 50 13.629 0.190 -6.222 1.00 0.00 H new ATOM 0 HB3 GLU A 50 13.562 1.936 -6.081 1.00 0.00 H new ATOM 0 HG2 GLU A 50 15.217 0.420 -8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 50 13.658 1.158 -8.460 1.00 0.00 H new ATOM 758 N VAL A 51 14.828 0.386 -3.204 1.00 0.00 N ATOM 759 CA VAL A 51 14.445 0.623 -1.846 1.00 0.00 C ATOM 760 C VAL A 51 15.591 0.524 -0.899 1.00 0.00 C ATOM 761 O VAL A 51 15.589 1.197 0.130 1.00 0.00 O ATOM 762 CB VAL A 51 13.425 -0.385 -1.404 1.00 0.00 C ATOM 763 CG1 VAL A 51 12.122 -0.262 -2.211 1.00 0.00 C ATOM 764 CG2 VAL A 51 13.871 -1.853 -1.512 1.00 0.00 C ATOM 0 H VAL A 51 14.893 -0.600 -3.458 1.00 0.00 H new ATOM 0 HA VAL A 51 14.045 1.637 -1.825 1.00 0.00 H new ATOM 0 HB VAL A 51 13.280 -0.145 -0.351 1.00 0.00 H new ATOM 0 HG11 VAL A 51 11.407 -1.008 -1.863 1.00 0.00 H new ATOM 0 HG12 VAL A 51 11.702 0.735 -2.075 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.332 -0.426 -3.268 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.066 -2.504 -1.170 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.109 -2.085 -2.550 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.754 -2.011 -0.893 1.00 0.00 H new ATOM 774 N ASP A 52 16.636 -0.249 -1.246 1.00 0.00 N ATOM 775 CA ASP A 52 17.897 -0.356 -0.580 1.00 0.00 C ATOM 776 C ASP A 52 18.659 0.924 -0.549 1.00 0.00 C ATOM 777 O ASP A 52 19.081 1.481 -1.562 1.00 0.00 O ATOM 778 CB ASP A 52 18.679 -1.507 -1.235 1.00 0.00 C ATOM 779 CG ASP A 52 19.853 -2.037 -0.425 1.00 0.00 C ATOM 780 OD1 ASP A 52 19.528 -2.386 0.742 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.019 -2.189 -0.878 1.00 0.00 O ATOM 0 H ASP A 52 16.592 -0.853 -2.067 1.00 0.00 H new ATOM 0 HA ASP A 52 17.730 -0.580 0.473 1.00 0.00 H new ATOM 0 HB2 ASP A 52 17.990 -2.330 -1.427 1.00 0.00 H new ATOM 0 HB3 ASP A 52 19.049 -1.169 -2.203 1.00 0.00 H new ATOM 786 N ALA A 53 18.839 1.449 0.676 1.00 0.00 N ATOM 787 CA ALA A 53 19.358 2.754 0.946 1.00 0.00 C ATOM 788 C ALA A 53 20.758 2.624 1.438 1.00 0.00 C ATOM 789 O ALA A 53 21.665 3.426 1.219 1.00 0.00 O ATOM 790 CB ALA A 53 18.450 3.314 2.054 1.00 0.00 C ATOM 0 H ALA A 53 18.609 0.933 1.526 1.00 0.00 H new ATOM 0 HA ALA A 53 19.372 3.401 0.069 1.00 0.00 H new ATOM 0 HB1 ALA A 53 18.780 4.318 2.322 1.00 0.00 H new ATOM 0 HB2 ALA A 53 17.421 3.354 1.696 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.504 2.668 2.930 1.00 0.00 H new ATOM 796 N ASP A 54 20.996 1.526 2.176 1.00 0.00 N ATOM 797 CA ASP A 54 22.246 1.008 2.640 1.00 0.00 C ATOM 798 C ASP A 54 23.029 0.492 1.482 1.00 0.00 C ATOM 799 O ASP A 54 23.723 1.139 0.698 1.00 0.00 O ATOM 800 CB ASP A 54 22.150 0.210 3.951 1.00 0.00 C ATOM 801 CG ASP A 54 21.097 -0.889 3.927 1.00 0.00 C ATOM 802 OD1 ASP A 54 21.255 -1.863 3.143 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.041 -0.797 4.607 1.00 0.00 O ATOM 0 H ASP A 54 20.222 0.936 2.481 1.00 0.00 H new ATOM 0 HA ASP A 54 22.890 1.796 3.030 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.121 -0.235 4.166 1.00 0.00 H new ATOM 0 HB3 ASP A 54 21.926 0.897 4.768 1.00 0.00 H new ATOM 808 N GLY A 55 23.040 -0.851 1.405 1.00 0.00 N ATOM 809 CA GLY A 55 23.821 -1.548 0.431 1.00 0.00 C ATOM 810 C GLY A 55 23.889 -3.020 0.655 1.00 0.00 C ATOM 811 O GLY A 55 24.679 -3.671 -0.027 1.00 0.00 O ATOM 0 H GLY A 55 22.503 -1.459 2.024 1.00 0.00 H new ATOM 0 HA2 GLY A 55 23.404 -1.359 -0.558 1.00 0.00 H new ATOM 0 HA3 GLY A 55 24.833 -1.143 0.433 1.00 0.00 H new ATOM 815 N ASN A 56 23.079 -3.624 1.542 1.00 0.00 N ATOM 816 CA ASN A 56 23.191 -4.989 1.954 1.00 0.00 C ATOM 817 C ASN A 56 22.591 -5.891 0.931 1.00 0.00 C ATOM 818 O ASN A 56 23.058 -6.991 0.641 1.00 0.00 O ATOM 819 CB ASN A 56 22.727 -5.228 3.401 1.00 0.00 C ATOM 820 CG ASN A 56 21.269 -4.878 3.666 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.504 -4.507 2.777 1.00 0.00 O ATOM 822 ND2 ASN A 56 20.800 -5.095 4.924 1.00 0.00 N ATOM 0 H ASN A 56 22.307 -3.135 1.995 1.00 0.00 H new ATOM 0 HA ASN A 56 24.248 -5.251 2.000 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.886 -6.277 3.651 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.355 -4.642 4.071 1.00 0.00 H new ATOM 0 HD21 ASN A 56 19.812 -4.950 5.132 1.00 0.00 H new ATOM 0 HD22 ASN A 56 21.436 -5.403 5.659 1.00 0.00 H new ATOM 829 N GLY A 57 21.570 -5.357 0.237 1.00 0.00 N ATOM 830 CA GLY A 57 20.742 -5.984 -0.746 1.00 0.00 C ATOM 831 C GLY A 57 19.531 -6.681 -0.227 1.00 0.00 C ATOM 832 O GLY A 57 18.869 -7.390 -0.983 1.00 0.00 O ATOM 0 H GLY A 57 21.299 -4.384 0.382 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.423 -5.226 -1.461 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.346 -6.706 -1.295 1.00 0.00 H new ATOM 836 N THR A 58 19.213 -6.472 1.063 1.00 0.00 N ATOM 837 CA THR A 58 17.911 -6.780 1.568 1.00 0.00 C ATOM 838 C THR A 58 17.140 -5.539 1.860 1.00 0.00 C ATOM 839 O THR A 58 17.707 -4.500 2.196 1.00 0.00 O ATOM 840 CB THR A 58 17.892 -7.559 2.849 1.00 0.00 C ATOM 841 OG1 THR A 58 18.700 -7.081 3.914 1.00 0.00 O ATOM 842 CG2 THR A 58 18.451 -8.964 2.570 1.00 0.00 C ATOM 0 H THR A 58 19.857 -6.090 1.756 1.00 0.00 H new ATOM 0 HA THR A 58 17.477 -7.384 0.771 1.00 0.00 H new ATOM 0 HB THR A 58 16.850 -7.496 3.164 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.120 -7.839 4.372 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.446 -9.547 3.491 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.832 -9.460 1.823 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.472 -8.882 2.199 1.00 0.00 H new ATOM 850 N ILE A 59 15.802 -5.640 1.773 1.00 0.00 N ATOM 851 CA ILE A 59 14.951 -4.581 2.220 1.00 0.00 C ATOM 852 C ILE A 59 14.879 -4.712 3.702 1.00 0.00 C ATOM 853 O ILE A 59 14.438 -5.755 4.182 1.00 0.00 O ATOM 854 CB ILE A 59 13.652 -4.440 1.484 1.00 0.00 C ATOM 855 CG1 ILE A 59 12.610 -3.650 2.294 1.00 0.00 C ATOM 856 CG2 ILE A 59 12.945 -5.727 1.025 1.00 0.00 C ATOM 857 CD1 ILE A 59 11.678 -2.816 1.416 1.00 0.00 C ATOM 0 H ILE A 59 15.311 -6.450 1.395 1.00 0.00 H new ATOM 0 HA ILE A 59 15.374 -3.609 1.966 1.00 0.00 H new ATOM 0 HB ILE A 59 13.990 -3.920 0.587 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.016 -4.345 2.887 1.00 0.00 H new ATOM 0 HG13 ILE A 59 13.125 -2.993 2.995 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.021 -5.470 0.508 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.597 -6.279 0.349 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.715 -6.345 1.893 1.00 0.00 H new ATOM 0 HD11 ILE A 59 10.966 -2.282 2.046 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.264 -2.098 0.842 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.138 -3.472 0.733 1.00 0.00 H new ATOM 869 N ASP A 60 15.337 -3.694 4.453 1.00 0.00 N ATOM 870 CA ASP A 60 15.292 -3.733 5.881 1.00 0.00 C ATOM 871 C ASP A 60 14.076 -2.998 6.329 1.00 0.00 C ATOM 872 O ASP A 60 13.272 -2.417 5.601 1.00 0.00 O ATOM 873 CB ASP A 60 16.516 -2.941 6.371 1.00 0.00 C ATOM 874 CG ASP A 60 17.774 -3.710 5.993 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.233 -4.581 6.779 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.404 -3.379 4.953 1.00 0.00 O ATOM 0 H ASP A 60 15.740 -2.840 4.068 1.00 0.00 H new ATOM 0 HA ASP A 60 15.281 -4.756 6.256 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.530 -1.948 5.921 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.468 -2.801 7.451 1.00 0.00 H new ATOM 881 N PHE A 61 13.887 -2.944 7.659 1.00 0.00 N ATOM 882 CA PHE A 61 12.793 -2.275 8.292 1.00 0.00 C ATOM 883 C PHE A 61 12.918 -0.800 8.119 1.00 0.00 C ATOM 884 O PHE A 61 11.861 -0.309 7.725 1.00 0.00 O ATOM 885 CB PHE A 61 12.569 -2.635 9.771 1.00 0.00 C ATOM 886 CG PHE A 61 11.608 -3.745 10.026 1.00 0.00 C ATOM 887 CD1 PHE A 61 12.139 -5.009 10.126 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.303 -3.516 10.395 1.00 0.00 C ATOM 889 CE1 PHE A 61 11.336 -6.090 10.409 1.00 0.00 C ATOM 890 CE2 PHE A 61 9.485 -4.591 10.652 1.00 0.00 C ATOM 891 CZ PHE A 61 10.030 -5.849 10.761 1.00 0.00 C ATOM 0 H PHE A 61 14.524 -3.386 8.322 1.00 0.00 H new ATOM 0 HA PHE A 61 11.902 -2.640 7.782 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.530 -2.902 10.211 1.00 0.00 H new ATOM 0 HB3 PHE A 61 12.216 -1.746 10.293 1.00 0.00 H new ATOM 0 HD1 PHE A 61 13.199 -5.155 9.981 1.00 0.00 H new ATOM 0 HD2 PHE A 61 9.927 -2.507 10.482 1.00 0.00 H new ATOM 0 HE1 PHE A 61 11.721 -7.098 10.356 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.421 -4.448 10.768 1.00 0.00 H new ATOM 0 HZ PHE A 61 9.421 -6.661 11.130 1.00 0.00 H new ATOM 901 N PRO A 62 13.898 0.020 8.353 1.00 0.00 N ATOM 902 CA PRO A 62 13.794 1.425 8.083 1.00 0.00 C ATOM 903 C PRO A 62 13.338 1.765 6.706 1.00 0.00 C ATOM 904 O PRO A 62 12.710 2.763 6.355 1.00 0.00 O ATOM 905 CB PRO A 62 15.140 1.973 8.552 1.00 0.00 C ATOM 906 CG PRO A 62 15.462 1.094 9.771 1.00 0.00 C ATOM 907 CD PRO A 62 14.951 -0.280 9.312 1.00 0.00 C ATOM 0 HA PRO A 62 12.983 1.916 8.620 1.00 0.00 H new ATOM 0 HB2 PRO A 62 15.903 1.887 7.779 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.076 3.028 8.820 1.00 0.00 H new ATOM 0 HG2 PRO A 62 16.529 1.080 9.994 1.00 0.00 H new ATOM 0 HG3 PRO A 62 14.953 1.440 10.670 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.748 -0.867 8.855 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.569 -0.861 10.151 1.00 0.00 H new ATOM 915 N GLU A 63 13.695 0.860 5.777 1.00 0.00 N ATOM 916 CA GLU A 63 13.524 0.922 4.359 1.00 0.00 C ATOM 917 C GLU A 63 12.098 0.741 3.963 1.00 0.00 C ATOM 918 O GLU A 63 11.515 1.599 3.303 1.00 0.00 O ATOM 919 CB GLU A 63 14.513 -0.048 3.691 1.00 0.00 C ATOM 920 CG GLU A 63 15.979 0.353 3.866 1.00 0.00 C ATOM 921 CD GLU A 63 16.957 -0.516 3.090 1.00 0.00 C ATOM 922 OE1 GLU A 63 16.684 -1.716 2.820 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.088 -0.028 2.825 1.00 0.00 O ATOM 0 H GLU A 63 14.153 -0.008 6.053 1.00 0.00 H new ATOM 0 HA GLU A 63 13.767 1.920 3.993 1.00 0.00 H new ATOM 0 HB2 GLU A 63 14.366 -1.045 4.105 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.286 -0.108 2.627 1.00 0.00 H new ATOM 0 HG2 GLU A 63 16.101 1.389 3.551 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.232 0.310 4.925 1.00 0.00 H new ATOM 930 N PHE A 64 11.518 -0.417 4.327 1.00 0.00 N ATOM 931 CA PHE A 64 10.112 -0.668 4.398 1.00 0.00 C ATOM 932 C PHE A 64 9.234 0.413 4.929 1.00 0.00 C ATOM 933 O PHE A 64 8.172 0.788 4.434 1.00 0.00 O ATOM 934 CB PHE A 64 9.882 -1.929 5.247 1.00 0.00 C ATOM 935 CG PHE A 64 8.710 -2.706 4.754 1.00 0.00 C ATOM 936 CD1 PHE A 64 7.418 -2.288 4.971 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.930 -3.944 4.198 1.00 0.00 C ATOM 938 CE1 PHE A 64 6.384 -3.159 4.720 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.883 -4.736 3.790 1.00 0.00 C ATOM 940 CZ PHE A 64 6.591 -4.331 4.032 1.00 0.00 C ATOM 0 H PHE A 64 12.071 -1.233 4.589 1.00 0.00 H new ATOM 0 HA PHE A 64 9.815 -0.766 3.354 1.00 0.00 H new ATOM 0 HB2 PHE A 64 10.774 -2.555 5.221 1.00 0.00 H new ATOM 0 HB3 PHE A 64 9.722 -1.646 6.287 1.00 0.00 H new ATOM 0 HD1 PHE A 64 7.218 -1.290 5.333 1.00 0.00 H new ATOM 0 HD2 PHE A 64 9.943 -4.300 4.080 1.00 0.00 H new ATOM 0 HE1 PHE A 64 5.391 -2.918 5.070 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.074 -5.670 3.283 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.755 -4.922 3.688 1.00 0.00 H new ATOM 950 N LEU A 65 9.738 1.017 6.020 1.00 0.00 N ATOM 951 CA LEU A 65 9.123 2.153 6.633 1.00 0.00 C ATOM 952 C LEU A 65 9.256 3.395 5.822 1.00 0.00 C ATOM 953 O LEU A 65 8.278 4.127 5.678 1.00 0.00 O ATOM 954 CB LEU A 65 9.760 2.419 8.008 1.00 0.00 C ATOM 955 CG LEU A 65 9.191 1.656 9.216 1.00 0.00 C ATOM 956 CD1 LEU A 65 10.172 1.548 10.396 1.00 0.00 C ATOM 957 CD2 LEU A 65 7.876 2.298 9.690 1.00 0.00 C ATOM 0 H LEU A 65 10.591 0.709 6.486 1.00 0.00 H new ATOM 0 HA LEU A 65 8.064 1.912 6.723 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.823 2.189 7.936 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.678 3.486 8.216 1.00 0.00 H new ATOM 0 HG LEU A 65 9.007 0.640 8.867 1.00 0.00 H new ATOM 0 HD11 LEU A 65 9.702 0.998 11.211 1.00 0.00 H new ATOM 0 HD12 LEU A 65 11.071 1.023 10.075 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.439 2.547 10.740 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.488 1.744 10.545 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.060 3.332 9.980 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.146 2.273 8.881 1.00 0.00 H new ATOM 969 N THR A 66 10.389 3.792 5.215 1.00 0.00 N ATOM 970 CA THR A 66 10.416 4.939 4.361 1.00 0.00 C ATOM 971 C THR A 66 9.519 4.820 3.176 1.00 0.00 C ATOM 972 O THR A 66 8.660 5.666 2.935 1.00 0.00 O ATOM 973 CB THR A 66 11.805 5.048 3.807 1.00 0.00 C ATOM 974 OG1 THR A 66 12.702 5.381 4.856 1.00 0.00 O ATOM 975 CG2 THR A 66 12.004 6.208 2.817 1.00 0.00 C ATOM 0 H THR A 66 11.287 3.318 5.316 1.00 0.00 H new ATOM 0 HA THR A 66 10.094 5.792 4.959 1.00 0.00 H new ATOM 0 HB THR A 66 11.978 4.088 3.320 1.00 0.00 H new ATOM 0 HG1 THR A 66 12.800 4.614 5.459 1.00 0.00 H new ATOM 0 HG21 THR A 66 13.036 6.213 2.466 1.00 0.00 H new ATOM 0 HG22 THR A 66 11.332 6.081 1.968 1.00 0.00 H new ATOM 0 HG23 THR A 66 11.785 7.153 3.315 1.00 0.00 H new ATOM 983 N MET A 67 9.562 3.638 2.536 1.00 0.00 N ATOM 984 CA MET A 67 8.765 3.241 1.417 1.00 0.00 C ATOM 985 C MET A 67 7.329 3.608 1.573 1.00 0.00 C ATOM 986 O MET A 67 6.712 4.146 0.655 1.00 0.00 O ATOM 987 CB MET A 67 8.855 1.713 1.267 1.00 0.00 C ATOM 988 CG MET A 67 8.240 1.263 -0.059 1.00 0.00 C ATOM 989 SD MET A 67 8.655 -0.473 -0.407 1.00 0.00 S ATOM 990 CE MET A 67 7.881 -1.397 0.951 1.00 0.00 C ATOM 0 H MET A 67 10.206 2.902 2.825 1.00 0.00 H new ATOM 0 HA MET A 67 9.151 3.762 0.541 1.00 0.00 H new ATOM 0 HB2 MET A 67 9.898 1.399 1.315 1.00 0.00 H new ATOM 0 HB3 MET A 67 8.338 1.230 2.096 1.00 0.00 H new ATOM 0 HG2 MET A 67 7.157 1.382 -0.022 1.00 0.00 H new ATOM 0 HG3 MET A 67 8.603 1.898 -0.867 1.00 0.00 H new ATOM 0 HE1 MET A 67 8.250 -2.423 0.950 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.129 -0.923 1.901 1.00 0.00 H new ATOM 0 HE3 MET A 67 6.799 -1.400 0.819 1.00 0.00 H new ATOM 1000 N MET A 68 6.672 3.322 2.711 1.00 0.00 N ATOM 1001 CA MET A 68 5.256 3.467 2.843 1.00 0.00 C ATOM 1002 C MET A 68 4.806 4.776 3.394 1.00 0.00 C ATOM 1003 O MET A 68 3.626 5.119 3.337 1.00 0.00 O ATOM 1004 CB MET A 68 4.750 2.359 3.782 1.00 0.00 C ATOM 1005 CG MET A 68 5.128 0.947 3.330 1.00 0.00 C ATOM 1006 SD MET A 68 4.610 0.424 1.668 1.00 0.00 S ATOM 1007 CE MET A 68 2.805 0.583 1.793 1.00 0.00 C ATOM 0 H MET A 68 7.133 2.984 3.556 1.00 0.00 H new ATOM 0 HA MET A 68 4.848 3.403 1.834 1.00 0.00 H new ATOM 0 HB2 MET A 68 5.151 2.530 4.781 1.00 0.00 H new ATOM 0 HB3 MET A 68 3.665 2.428 3.858 1.00 0.00 H new ATOM 0 HG2 MET A 68 6.213 0.856 3.387 1.00 0.00 H new ATOM 0 HG3 MET A 68 4.710 0.242 4.049 1.00 0.00 H new ATOM 0 HE1 MET A 68 2.333 -0.329 1.426 1.00 0.00 H new ATOM 0 HE2 MET A 68 2.525 0.743 2.834 1.00 0.00 H new ATOM 0 HE3 MET A 68 2.472 1.430 1.194 1.00 0.00 H new ATOM 1017 N ALA A 69 5.758 5.545 3.953 1.00 0.00 N ATOM 1018 CA ALA A 69 5.512 6.703 4.755 1.00 0.00 C ATOM 1019 C ALA A 69 5.733 7.937 3.950 1.00 0.00 C ATOM 1020 O ALA A 69 4.964 8.885 4.099 1.00 0.00 O ATOM 1021 CB ALA A 69 6.311 6.607 6.066 1.00 0.00 C ATOM 0 H ALA A 69 6.752 5.348 3.839 1.00 0.00 H new ATOM 0 HA ALA A 69 4.468 6.758 5.064 1.00 0.00 H new ATOM 0 HB1 ALA A 69 6.120 7.491 6.674 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.004 5.717 6.615 1.00 0.00 H new ATOM 0 HB3 ALA A 69 7.375 6.545 5.840 1.00 0.00 H new ATOM 1027 N ARG A 70 6.680 7.981 2.995 1.00 0.00 N ATOM 1028 CA ARG A 70 7.054 9.043 2.113 1.00 0.00 C ATOM 1029 C ARG A 70 6.038 9.036 1.024 1.00 0.00 C ATOM 1030 O ARG A 70 5.667 7.997 0.481 1.00 0.00 O ATOM 1031 CB ARG A 70 8.410 8.875 1.407 1.00 0.00 C ATOM 1032 CG ARG A 70 9.549 9.098 2.404 1.00 0.00 C ATOM 1033 CD ARG A 70 10.787 9.327 1.535 1.00 0.00 C ATOM 1034 NE ARG A 70 11.895 9.640 2.481 1.00 0.00 N ATOM 1035 CZ ARG A 70 13.189 9.779 2.068 1.00 0.00 C ATOM 1036 NH1 ARG A 70 13.626 9.376 0.839 1.00 0.00 N ATOM 1037 NH2 ARG A 70 14.108 10.274 2.947 1.00 0.00 N ATOM 0 H ARG A 70 7.258 7.158 2.823 1.00 0.00 H new ATOM 0 HA ARG A 70 7.119 9.947 2.718 1.00 0.00 H new ATOM 0 HB2 ARG A 70 8.484 7.877 0.975 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.492 9.585 0.584 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.351 9.957 3.045 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.678 8.235 3.057 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.018 8.442 0.942 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.627 10.147 0.835 1.00 0.00 H new ATOM 0 HE ARG A 70 11.679 9.754 3.471 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.974 8.948 0.181 1.00 0.00 H new ATOM 0 HH12 ARG A 70 14.604 9.503 0.579 1.00 0.00 H new ATOM 0 HH21 ARG A 70 13.823 10.532 3.892 1.00 0.00 H new ATOM 0 HH22 ARG A 70 15.080 10.386 2.659 1.00 0.00 H new ATOM 1051 N LYS A 71 5.708 10.215 0.466 1.00 0.00 N ATOM 1052 CA LYS A 71 4.946 10.465 -0.718 1.00 0.00 C ATOM 1053 C LYS A 71 5.498 11.475 -1.664 1.00 0.00 C ATOM 1054 O LYS A 71 6.244 12.383 -1.302 1.00 0.00 O ATOM 1055 CB LYS A 71 3.482 10.815 -0.399 1.00 0.00 C ATOM 1056 CG LYS A 71 3.259 12.104 0.394 1.00 0.00 C ATOM 1057 CD LYS A 71 1.811 12.593 0.304 1.00 0.00 C ATOM 1058 CE LYS A 71 1.382 13.654 1.320 1.00 0.00 C ATOM 1059 NZ LYS A 71 -0.010 14.086 1.064 1.00 0.00 N ATOM 0 H LYS A 71 6.011 11.089 0.896 1.00 0.00 H new ATOM 0 HA LYS A 71 5.009 9.511 -1.241 1.00 0.00 H new ATOM 0 HB2 LYS A 71 2.934 10.890 -1.338 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.045 9.988 0.160 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.520 11.936 1.439 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.927 12.880 0.019 1.00 0.00 H new ATOM 0 HD2 LYS A 71 1.648 12.994 -0.696 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.153 11.731 0.413 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.464 13.253 2.330 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.051 14.512 1.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.284 14.806 1.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -0.078 14.488 0.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -0.647 13.268 1.142 1.00 0.00 H new ATOM 1073 N MET A 72 5.128 11.365 -2.953 1.00 0.00 N ATOM 1074 CA MET A 72 5.534 12.252 -3.998 1.00 0.00 C ATOM 1075 C MET A 72 4.365 13.085 -4.396 1.00 0.00 C ATOM 1076 O MET A 72 3.442 13.266 -3.603 1.00 0.00 O ATOM 1077 CB MET A 72 6.248 11.554 -5.168 1.00 0.00 C ATOM 1078 CG MET A 72 7.514 10.748 -4.871 1.00 0.00 C ATOM 1079 SD MET A 72 8.385 10.159 -6.355 1.00 0.00 S ATOM 1080 CE MET A 72 9.634 9.202 -5.448 1.00 0.00 C ATOM 0 H MET A 72 4.515 10.619 -3.282 1.00 0.00 H new ATOM 0 HA MET A 72 6.311 12.914 -3.616 1.00 0.00 H new ATOM 0 HB2 MET A 72 5.531 10.884 -5.642 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.505 12.317 -5.903 1.00 0.00 H new ATOM 0 HG2 MET A 72 8.195 11.364 -4.284 1.00 0.00 H new ATOM 0 HG3 MET A 72 7.249 9.890 -4.254 1.00 0.00 H new ATOM 0 HE1 MET A 72 10.313 8.726 -6.156 1.00 0.00 H new ATOM 0 HE2 MET A 72 10.199 9.867 -4.795 1.00 0.00 H new ATOM 0 HE3 MET A 72 9.141 8.437 -4.848 1.00 0.00 H new ATOM 1090 N LYS A 73 4.342 13.609 -5.635 1.00 0.00 N ATOM 1091 CA LYS A 73 3.309 14.410 -6.216 1.00 0.00 C ATOM 1092 C LYS A 73 2.148 13.585 -6.652 1.00 0.00 C ATOM 1093 O LYS A 73 2.184 12.357 -6.592 1.00 0.00 O ATOM 1094 CB LYS A 73 3.748 15.289 -7.399 1.00 0.00 C ATOM 1095 CG LYS A 73 4.530 14.557 -8.491 1.00 0.00 C ATOM 1096 CD LYS A 73 4.639 15.515 -9.679 1.00 0.00 C ATOM 1097 CE LYS A 73 5.458 14.926 -10.829 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.887 14.650 -10.560 1.00 0.00 N ATOM 0 H LYS A 73 5.114 13.458 -6.285 1.00 0.00 H new ATOM 0 HA LYS A 73 3.027 15.081 -5.405 1.00 0.00 H new ATOM 0 HB2 LYS A 73 2.862 15.739 -7.847 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.362 16.105 -7.018 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.519 14.273 -8.133 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.020 13.639 -8.781 1.00 0.00 H new ATOM 0 HD2 LYS A 73 3.639 15.761 -10.037 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.098 16.447 -9.350 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.985 13.994 -11.140 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.398 15.612 -11.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.331 14.255 -11.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.368 15.534 -10.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.968 13.967 -9.780 1.00 0.00 H new ATOM 1112 N ASP A 74 1.016 14.212 -7.018 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.214 13.543 -7.310 1.00 0.00 C ATOM 1114 C ASP A 74 -0.335 12.595 -8.453 1.00 0.00 C ATOM 1115 O ASP A 74 -1.243 11.765 -8.455 1.00 0.00 O ATOM 1116 CB ASP A 74 -1.418 14.496 -7.216 1.00 0.00 C ATOM 1117 CG ASP A 74 -1.535 15.027 -5.794 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -2.044 14.397 -4.830 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -1.154 16.219 -5.643 1.00 0.00 O ATOM 0 H ASP A 74 0.955 15.226 -7.114 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.208 12.815 -6.499 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.296 15.323 -7.916 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.332 13.973 -7.497 1.00 0.00 H new ATOM 1124 N THR A 75 0.700 12.508 -9.307 1.00 0.00 N ATOM 1125 CA THR A 75 0.732 11.498 -10.319 1.00 0.00 C ATOM 1126 C THR A 75 1.088 10.132 -9.842 1.00 0.00 C ATOM 1127 O THR A 75 0.461 9.140 -10.212 1.00 0.00 O ATOM 1128 CB THR A 75 1.780 11.873 -11.325 1.00 0.00 C ATOM 1129 OG1 THR A 75 3.064 12.197 -10.813 1.00 0.00 O ATOM 1130 CG2 THR A 75 1.313 13.163 -12.020 1.00 0.00 C ATOM 0 H THR A 75 1.508 13.131 -9.298 1.00 0.00 H new ATOM 0 HA THR A 75 -0.283 11.454 -10.715 1.00 0.00 H new ATOM 0 HB THR A 75 1.886 10.988 -11.952 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.703 12.267 -11.553 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.053 13.466 -12.760 1.00 0.00 H new ATOM 0 HG22 THR A 75 0.358 12.985 -12.514 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.196 13.954 -11.279 1.00 0.00 H new ATOM 1138 N ASP A 76 2.111 10.069 -8.971 1.00 0.00 N ATOM 1139 CA ASP A 76 2.723 8.895 -8.432 1.00 0.00 C ATOM 1140 C ASP A 76 1.819 8.105 -7.549 1.00 0.00 C ATOM 1141 O ASP A 76 1.617 6.899 -7.690 1.00 0.00 O ATOM 1142 CB ASP A 76 3.917 9.250 -7.529 1.00 0.00 C ATOM 1143 CG ASP A 76 4.554 8.046 -6.850 1.00 0.00 C ATOM 1144 OD1 ASP A 76 5.009 7.094 -7.539 1.00 0.00 O ATOM 1145 OD2 ASP A 76 4.555 8.017 -5.590 1.00 0.00 O ATOM 0 H ASP A 76 2.548 10.918 -8.613 1.00 0.00 H new ATOM 0 HA ASP A 76 3.007 8.321 -9.314 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.673 9.760 -8.126 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.586 9.953 -6.765 1.00 0.00 H new ATOM 1150 N SER A 77 1.107 8.848 -6.684 1.00 0.00 N ATOM 1151 CA SER A 77 0.182 8.289 -5.748 1.00 0.00 C ATOM 1152 C SER A 77 -0.978 7.633 -6.414 1.00 0.00 C ATOM 1153 O SER A 77 -1.709 6.841 -5.821 1.00 0.00 O ATOM 1154 CB SER A 77 -0.336 9.272 -4.684 1.00 0.00 C ATOM 1155 OG SER A 77 -0.816 10.449 -5.317 1.00 0.00 O ATOM 0 H SER A 77 1.176 9.864 -6.634 1.00 0.00 H new ATOM 0 HA SER A 77 0.777 7.539 -5.227 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.133 8.808 -4.103 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.463 9.522 -3.986 1.00 0.00 H new ATOM 0 HG SER A 77 -1.147 11.074 -4.638 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.294 7.956 -7.681 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.387 7.356 -8.382 1.00 0.00 C ATOM 1163 C GLU A 78 -2.080 6.008 -8.938 1.00 0.00 C ATOM 1164 O GLU A 78 -2.843 5.048 -8.837 1.00 0.00 O ATOM 1165 CB GLU A 78 -2.889 8.329 -9.462 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.380 8.279 -9.803 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.568 9.465 -10.738 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.097 9.456 -11.907 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -5.125 10.491 -10.264 1.00 0.00 O ATOM 0 H GLU A 78 -0.781 8.647 -8.229 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.182 7.174 -7.659 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.648 9.343 -9.143 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.326 8.140 -10.376 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.650 7.340 -10.286 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.000 8.369 -8.911 1.00 0.00 H new ATOM 1176 N GLU A 79 -0.871 5.916 -9.520 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.341 4.772 -10.195 1.00 0.00 C ATOM 1178 C GLU A 79 -0.078 3.654 -9.246 1.00 0.00 C ATOM 1179 O GLU A 79 -0.409 2.501 -9.514 1.00 0.00 O ATOM 1180 CB GLU A 79 0.863 5.083 -11.100 1.00 0.00 C ATOM 1181 CG GLU A 79 0.679 6.104 -12.224 1.00 0.00 C ATOM 1182 CD GLU A 79 -0.451 5.776 -13.190 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -0.337 4.803 -13.983 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -1.476 6.505 -13.261 1.00 0.00 O ATOM 0 H GLU A 79 -0.217 6.699 -9.518 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.119 4.439 -10.883 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.676 5.432 -10.464 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.191 4.147 -11.551 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.491 7.083 -11.783 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.610 6.181 -12.785 1.00 0.00 H new ATOM 1191 N GLU A 80 0.508 4.009 -8.088 1.00 0.00 N ATOM 1192 CA GLU A 80 0.687 3.172 -6.943 1.00 0.00 C ATOM 1193 C GLU A 80 -0.469 2.327 -6.529 1.00 0.00 C ATOM 1194 O GLU A 80 -0.362 1.117 -6.337 1.00 0.00 O ATOM 1195 CB GLU A 80 1.207 4.034 -5.780 1.00 0.00 C ATOM 1196 CG GLU A 80 1.749 3.208 -4.612 1.00 0.00 C ATOM 1197 CD GLU A 80 1.760 4.017 -3.323 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.618 4.219 -2.830 1.00 0.00 O ATOM 1199 OE2 GLU A 80 2.841 4.502 -2.895 1.00 0.00 O ATOM 0 H GLU A 80 0.882 4.947 -7.943 1.00 0.00 H new ATOM 0 HA GLU A 80 1.417 2.421 -7.245 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.995 4.692 -6.148 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.400 4.673 -5.421 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.137 2.316 -4.479 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.760 2.870 -4.841 1.00 0.00 H new ATOM 1206 N ILE A 81 -1.620 2.994 -6.333 1.00 0.00 N ATOM 1207 CA ILE A 81 -2.934 2.446 -6.193 1.00 0.00 C ATOM 1208 C ILE A 81 -3.488 1.606 -7.291 1.00 0.00 C ATOM 1209 O ILE A 81 -4.007 0.508 -7.094 1.00 0.00 O ATOM 1210 CB ILE A 81 -3.955 3.435 -5.713 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.657 4.245 -4.440 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.342 2.804 -5.504 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -3.197 3.443 -3.224 1.00 0.00 C ATOM 0 H ILE A 81 -1.630 4.012 -6.267 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.730 1.718 -5.408 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.919 4.137 -6.546 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.889 4.982 -4.675 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.556 4.797 -4.166 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.040 3.566 -5.157 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.698 2.388 -6.446 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.272 2.010 -4.761 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -3.018 4.120 -2.389 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.969 2.724 -2.949 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.276 2.912 -3.465 1.00 0.00 H new ATOM 1225 N ARG A 82 -3.368 2.143 -8.519 1.00 0.00 N ATOM 1226 CA ARG A 82 -3.763 1.451 -9.706 1.00 0.00 C ATOM 1227 C ARG A 82 -3.067 0.138 -9.805 1.00 0.00 C ATOM 1228 O ARG A 82 -3.767 -0.825 -10.113 1.00 0.00 O ATOM 1229 CB ARG A 82 -3.572 2.247 -11.009 1.00 0.00 C ATOM 1230 CG ARG A 82 -4.521 3.426 -11.235 1.00 0.00 C ATOM 1231 CD ARG A 82 -4.169 4.221 -12.494 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.388 5.062 -12.659 1.00 0.00 N ATOM 1233 CZ ARG A 82 -5.367 6.412 -12.854 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -4.174 7.070 -12.940 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -6.538 7.108 -12.776 1.00 0.00 N ATOM 0 H ARG A 82 -2.990 3.075 -8.690 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.838 1.303 -9.603 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -2.549 2.623 -11.032 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -3.677 1.559 -11.848 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.543 3.057 -11.315 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.488 4.087 -10.369 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -3.270 4.822 -12.362 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.997 3.574 -13.354 1.00 0.00 H new ATOM 0 HE ARG A 82 -6.296 4.599 -12.624 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.299 6.552 -12.858 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -4.158 8.079 -13.086 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -7.410 6.618 -12.575 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.542 8.118 -12.919 1.00 0.00 H new ATOM 1249 N GLU A 83 -1.744 0.030 -9.584 1.00 0.00 N ATOM 1250 CA GLU A 83 -1.050 -1.217 -9.503 1.00 0.00 C ATOM 1251 C GLU A 83 -1.407 -2.170 -8.414 1.00 0.00 C ATOM 1252 O GLU A 83 -1.535 -3.378 -8.607 1.00 0.00 O ATOM 1253 CB GLU A 83 0.464 -0.951 -9.554 1.00 0.00 C ATOM 1254 CG GLU A 83 1.059 -0.759 -10.951 1.00 0.00 C ATOM 1255 CD GLU A 83 0.789 -1.957 -11.849 1.00 0.00 C ATOM 1256 OE1 GLU A 83 1.230 -3.092 -11.523 1.00 0.00 O ATOM 1257 OE2 GLU A 83 0.131 -1.774 -12.908 1.00 0.00 O ATOM 0 H GLU A 83 -1.137 0.840 -9.457 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.403 -1.769 -10.374 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.678 -0.060 -8.963 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.977 -1.784 -9.072 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.638 0.138 -11.405 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.134 -0.601 -10.870 1.00 0.00 H new ATOM 1264 N ALA A 84 -1.664 -1.678 -7.188 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.175 -2.426 -6.082 1.00 0.00 C ATOM 1266 C ALA A 84 -3.484 -3.088 -6.343 1.00 0.00 C ATOM 1267 O ALA A 84 -3.762 -4.246 -6.036 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.255 -1.432 -4.911 1.00 0.00 C ATOM 0 H ALA A 84 -1.505 -0.698 -6.956 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.513 -3.264 -5.865 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.640 -1.941 -4.027 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.261 -1.039 -4.699 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.921 -0.611 -5.176 1.00 0.00 H new ATOM 1274 N PHE A 85 -4.388 -2.333 -6.994 1.00 0.00 N ATOM 1275 CA PHE A 85 -5.731 -2.718 -7.298 1.00 0.00 C ATOM 1276 C PHE A 85 -5.734 -3.778 -8.344 1.00 0.00 C ATOM 1277 O PHE A 85 -6.469 -4.762 -8.269 1.00 0.00 O ATOM 1278 CB PHE A 85 -6.477 -1.466 -7.791 1.00 0.00 C ATOM 1279 CG PHE A 85 -7.929 -1.620 -7.494 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -8.791 -2.238 -8.369 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -8.417 -1.103 -6.317 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.114 -2.383 -8.025 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -9.731 -1.301 -5.966 1.00 0.00 C ATOM 1284 CZ PHE A 85 -10.621 -1.824 -6.875 1.00 0.00 C ATOM 0 H PHE A 85 -4.166 -1.395 -7.328 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.224 -3.123 -6.414 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.084 -0.576 -7.300 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.323 -1.333 -8.862 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.432 -2.606 -9.319 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -7.765 -0.539 -5.666 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -10.769 -2.948 -8.671 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -10.066 -1.045 -4.972 1.00 0.00 H new ATOM 0 HZ PHE A 85 -11.685 -1.797 -6.691 1.00 0.00 H new ATOM 1294 N ARG A 86 -4.842 -3.640 -9.341 1.00 0.00 N ATOM 1295 CA ARG A 86 -4.532 -4.602 -10.352 1.00 0.00 C ATOM 1296 C ARG A 86 -4.011 -5.906 -9.853 1.00 0.00 C ATOM 1297 O ARG A 86 -4.234 -6.904 -10.537 1.00 0.00 O ATOM 1298 CB ARG A 86 -3.545 -4.011 -11.373 1.00 0.00 C ATOM 1299 CG ARG A 86 -3.490 -4.615 -12.777 1.00 0.00 C ATOM 1300 CD ARG A 86 -2.529 -3.954 -13.766 1.00 0.00 C ATOM 1301 NE ARG A 86 -1.131 -4.120 -13.277 1.00 0.00 N ATOM 1302 CZ ARG A 86 -0.421 -5.273 -13.447 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -0.982 -6.385 -14.005 1.00 0.00 N ATOM 1304 NH2 ARG A 86 0.865 -5.345 -12.994 1.00 0.00 N ATOM 0 H ARG A 86 -4.294 -2.786 -9.447 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.490 -4.827 -10.820 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.774 -2.951 -11.478 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.545 -4.080 -10.944 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.216 -5.666 -12.686 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.493 -4.582 -13.202 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.638 -4.404 -14.753 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.767 -2.895 -13.870 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.686 -3.339 -12.795 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.956 -6.368 -14.307 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.427 -7.233 -14.120 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.289 -4.540 -12.532 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.402 -6.203 -13.117 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.524 -5.975 -8.602 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.209 -7.223 -7.979 1.00 0.00 C ATOM 1320 C VAL A 87 -4.489 -7.916 -7.658 1.00 0.00 C ATOM 1321 O VAL A 87 -4.597 -9.091 -8.008 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.370 -7.115 -6.740 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.208 -8.564 -6.252 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -0.961 -6.586 -7.057 1.00 0.00 C ATOM 0 H VAL A 87 -3.347 -5.158 -8.017 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.601 -7.785 -8.688 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.835 -6.440 -6.021 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.604 -8.577 -5.345 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.189 -8.989 -6.041 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.716 -9.155 -7.024 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.381 -6.521 -6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.465 -7.265 -7.751 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.037 -5.597 -7.509 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.468 -7.193 -7.087 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.726 -7.764 -6.717 1.00 0.00 C ATOM 1336 C PHE A 88 -7.629 -8.054 -7.866 1.00 0.00 C ATOM 1337 O PHE A 88 -8.039 -9.193 -8.083 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.462 -6.958 -5.633 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.020 -7.243 -4.239 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.625 -8.321 -3.635 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.123 -6.480 -3.530 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.365 -8.530 -2.301 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.882 -6.715 -2.197 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.503 -7.760 -1.555 1.00 0.00 C ATOM 0 H PHE A 88 -5.386 -6.198 -6.879 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.455 -8.728 -6.287 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.325 -5.895 -5.833 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.530 -7.162 -5.710 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.280 -8.978 -4.188 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -5.597 -5.680 -4.030 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -7.868 -9.349 -1.809 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.202 -6.076 -1.652 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.322 -7.967 -0.511 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.035 -7.008 -8.608 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.142 -6.922 -9.509 1.00 0.00 C ATOM 1356 C ASP A 89 -8.854 -7.502 -10.851 1.00 0.00 C ATOM 1357 O ASP A 89 -8.229 -6.890 -11.716 1.00 0.00 O ATOM 1358 CB ASP A 89 -9.637 -5.467 -9.550 1.00 0.00 C ATOM 1359 CG ASP A 89 -10.924 -5.262 -10.335 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.631 -6.252 -10.662 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.215 -4.104 -10.738 1.00 0.00 O ATOM 0 H ASP A 89 -7.527 -6.124 -8.569 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.953 -7.547 -9.135 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.790 -5.119 -8.528 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.857 -4.843 -9.986 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.478 -8.650 -11.170 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.196 -9.567 -12.231 1.00 0.00 C ATOM 1368 C LYS A 90 -9.725 -9.054 -13.525 1.00 0.00 C ATOM 1369 O LYS A 90 -8.891 -8.911 -14.418 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.853 -10.899 -11.830 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.699 -12.065 -12.808 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.270 -12.577 -12.996 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.634 -12.950 -11.655 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.361 -13.645 -11.946 1.00 0.00 N ATOM 0 H LYS A 90 -10.273 -8.970 -10.617 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.124 -9.698 -12.377 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.441 -11.205 -10.868 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.918 -10.721 -11.678 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.321 -12.891 -12.463 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.088 -11.757 -13.779 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.276 -13.447 -13.653 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.668 -11.812 -13.486 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.456 -12.058 -11.054 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.300 -13.594 -11.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.900 -13.914 -11.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.552 -14.499 -12.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.734 -13.011 -12.482 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.029 -8.728 -13.575 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.706 -8.252 -14.741 1.00 0.00 C ATOM 1390 C ASP A 91 -11.517 -6.783 -14.902 1.00 0.00 C ATOM 1391 O ASP A 91 -11.559 -6.248 -16.009 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.188 -8.662 -14.734 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.796 -8.639 -13.339 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.347 -7.894 -12.427 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.763 -9.417 -13.125 1.00 0.00 O ATOM 0 H ASP A 91 -11.641 -8.800 -12.762 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.260 -8.726 -15.615 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.750 -7.990 -15.382 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.286 -9.664 -15.152 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.020 -6.062 -13.881 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.648 -4.692 -14.055 1.00 0.00 C ATOM 1402 C GLY A 92 -11.815 -3.765 -14.033 1.00 0.00 C ATOM 1403 O GLY A 92 -11.782 -2.706 -14.656 1.00 0.00 O ATOM 0 H GLY A 92 -10.876 -6.426 -12.939 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.950 -4.408 -13.267 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.121 -4.582 -15.003 1.00 0.00 H new ATOM 1407 N ASN A 93 -12.908 -4.118 -13.333 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.147 -3.406 -13.282 1.00 0.00 C ATOM 1409 C ASN A 93 -14.096 -2.313 -12.271 1.00 0.00 C ATOM 1410 O ASN A 93 -15.042 -1.527 -12.287 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.391 -4.308 -13.200 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.530 -5.179 -11.960 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -14.743 -5.219 -11.016 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -16.721 -5.835 -12.006 1.00 0.00 N ATOM 0 H ASN A 93 -12.926 -4.963 -12.762 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.275 -2.919 -14.249 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.275 -3.674 -13.270 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.396 -4.959 -14.074 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.016 -6.412 -11.218 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.319 -5.750 -12.828 1.00 0.00 H new ATOM 1421 N GLY A 94 -13.166 -2.383 -11.302 1.00 0.00 N ATOM 1422 CA GLY A 94 -13.061 -1.290 -10.386 1.00 0.00 C ATOM 1423 C GLY A 94 -13.656 -1.668 -9.073 1.00 0.00 C ATOM 1424 O GLY A 94 -13.887 -0.789 -8.244 1.00 0.00 O ATOM 0 H GLY A 94 -12.516 -3.155 -11.155 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.015 -1.014 -10.255 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -13.573 -0.416 -10.789 1.00 0.00 H new ATOM 1428 N TYR A 95 -13.822 -2.985 -8.858 1.00 0.00 N ATOM 1429 CA TYR A 95 -14.460 -3.485 -7.680 1.00 0.00 C ATOM 1430 C TYR A 95 -13.871 -4.815 -7.356 1.00 0.00 C ATOM 1431 O TYR A 95 -13.711 -5.701 -8.194 1.00 0.00 O ATOM 1432 CB TYR A 95 -15.945 -3.797 -7.932 1.00 0.00 C ATOM 1433 CG TYR A 95 -16.683 -2.620 -8.472 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -16.889 -1.545 -7.639 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -17.170 -2.581 -9.757 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -17.510 -0.397 -8.072 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -17.670 -1.400 -10.253 1.00 0.00 C ATOM 1438 CZ TYR A 95 -17.780 -0.314 -9.418 1.00 0.00 C ATOM 1439 OH TYR A 95 -18.185 0.887 -10.038 1.00 0.00 O ATOM 0 H TYR A 95 -13.512 -3.709 -9.506 1.00 0.00 H new ATOM 0 HA TYR A 95 -14.335 -2.732 -6.902 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.026 -4.628 -8.633 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -16.410 -4.119 -7.000 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -16.553 -1.604 -6.614 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.160 -3.469 -10.371 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -17.772 0.398 -7.390 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -17.973 -1.327 -11.287 1.00 0.00 H new ATOM 0 HH TYR A 95 -18.324 0.730 -10.995 1.00 0.00 H new ATOM 1449 N ILE A 96 -13.619 -5.051 -6.056 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.009 -6.241 -5.551 1.00 0.00 C ATOM 1451 C ILE A 96 -14.085 -7.019 -4.874 1.00 0.00 C ATOM 1452 O ILE A 96 -14.687 -6.681 -3.856 1.00 0.00 O ATOM 1453 CB ILE A 96 -11.918 -6.015 -4.548 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -10.937 -4.967 -5.100 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.174 -7.352 -4.385 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.022 -4.268 -4.095 1.00 0.00 C ATOM 0 H ILE A 96 -13.852 -4.381 -5.323 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.546 -6.748 -6.398 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.323 -5.667 -3.598 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.309 -5.453 -5.847 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.516 -4.202 -5.618 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.368 -7.234 -3.661 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.869 -8.115 -4.033 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -10.757 -7.656 -5.345 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.384 -3.556 -4.618 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.627 -3.740 -3.358 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.402 -5.009 -3.591 1.00 0.00 H new ATOM 1468 N SER A 97 -14.374 -8.169 -5.510 1.00 0.00 N ATOM 1469 CA SER A 97 -15.297 -9.194 -5.134 1.00 0.00 C ATOM 1470 C SER A 97 -14.801 -10.038 -4.012 1.00 0.00 C ATOM 1471 O SER A 97 -13.689 -9.860 -3.517 1.00 0.00 O ATOM 1472 CB SER A 97 -15.934 -10.038 -6.250 1.00 0.00 C ATOM 1473 OG SER A 97 -17.123 -10.709 -5.856 1.00 0.00 O ATOM 0 H SER A 97 -13.906 -8.403 -6.386 1.00 0.00 H new ATOM 0 HA SER A 97 -16.140 -8.599 -4.783 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.157 -9.392 -7.099 1.00 0.00 H new ATOM 0 HB3 SER A 97 -15.209 -10.776 -6.593 1.00 0.00 H new ATOM 0 HG SER A 97 -17.474 -11.224 -6.612 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.594 -11.048 -3.613 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.519 -11.807 -2.403 1.00 0.00 C ATOM 1481 C ALA A 98 -14.463 -12.837 -2.615 1.00 0.00 C ATOM 1482 O ALA A 98 -13.497 -12.968 -1.866 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.921 -12.395 -2.171 1.00 0.00 C ATOM 0 H ALA A 98 -16.366 -11.363 -4.200 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.249 -11.233 -1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.920 -12.987 -1.256 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.645 -11.585 -2.079 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.193 -13.031 -3.014 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.606 -13.633 -3.690 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.738 -14.716 -4.036 1.00 0.00 C ATOM 1491 C ALA A 99 -12.433 -14.179 -4.513 1.00 0.00 C ATOM 1492 O ALA A 99 -11.342 -14.633 -4.171 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.329 -15.613 -5.136 1.00 0.00 C ATOM 0 H ALA A 99 -15.370 -13.514 -4.355 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.608 -15.320 -3.138 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.631 -16.419 -5.362 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.273 -16.036 -4.793 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.502 -15.021 -6.035 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.522 -13.056 -5.247 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.446 -12.263 -5.754 1.00 0.00 C ATOM 1501 C GLU A 100 -10.458 -11.850 -4.718 1.00 0.00 C ATOM 1502 O GLU A 100 -9.239 -12.014 -4.738 1.00 0.00 O ATOM 1503 CB GLU A 100 -12.101 -10.986 -6.308 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.206 -10.219 -7.283 1.00 0.00 C ATOM 1505 CD GLU A 100 -11.981 -9.236 -8.149 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -12.984 -8.592 -7.741 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -11.729 -9.118 -9.378 1.00 0.00 O ATOM 0 H GLU A 100 -13.429 -12.670 -5.508 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.897 -12.852 -6.489 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -13.030 -11.252 -6.812 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -12.365 -10.332 -5.477 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.444 -9.678 -6.721 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -10.685 -10.929 -7.925 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.031 -11.272 -3.647 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.338 -10.868 -2.464 1.00 0.00 C ATOM 1516 C LEU A 101 -9.622 -11.955 -1.739 1.00 0.00 C ATOM 1517 O LEU A 101 -8.425 -11.804 -1.501 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.183 -10.167 -1.386 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.435 -9.492 -0.224 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.421 -7.954 -0.225 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -10.966 -9.933 1.151 1.00 0.00 C ATOM 0 H LEU A 101 -12.031 -11.077 -3.605 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.639 -10.165 -2.918 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.794 -9.410 -1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.867 -10.903 -0.963 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.414 -9.833 -0.395 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.865 -7.595 0.641 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.944 -7.595 -1.137 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.444 -7.581 -0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -10.405 -9.428 1.937 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.021 -9.673 1.234 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -10.849 -11.011 1.257 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.307 -13.070 -1.427 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.888 -14.289 -0.808 1.00 0.00 C ATOM 1535 C ARG A 102 -8.719 -14.990 -1.408 1.00 0.00 C ATOM 1536 O ARG A 102 -7.764 -15.379 -0.737 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.119 -15.182 -0.580 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.839 -16.547 0.051 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.108 -17.391 -0.079 1.00 0.00 C ATOM 1540 NE ARG A 102 -12.004 -18.304 1.094 1.00 0.00 N ATOM 1541 CZ ARG A 102 -13.183 -18.878 1.472 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -14.324 -18.851 0.723 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -13.209 -19.664 2.588 1.00 0.00 N ATOM 0 H ARG A 102 -11.303 -13.116 -1.644 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.456 -14.011 0.153 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.822 -14.645 0.057 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.613 -15.340 -1.539 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.003 -17.035 -0.450 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.561 -16.434 1.099 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -13.009 -16.779 -0.039 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.137 -17.940 -1.020 1.00 0.00 H new ATOM 0 HE ARG A 102 -11.123 -18.485 1.575 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.329 -18.380 -0.182 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -15.171 -19.302 1.068 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -12.355 -19.815 3.126 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -14.082 -20.100 2.884 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.746 -15.163 -2.741 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.716 -15.614 -3.625 1.00 0.00 C ATOM 1559 C HIS A 103 -6.454 -14.860 -3.382 1.00 0.00 C ATOM 1560 O HIS A 103 -5.485 -15.504 -2.982 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.019 -15.530 -5.130 1.00 0.00 C ATOM 1562 CG HIS A 103 -9.063 -16.512 -5.572 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -9.814 -16.382 -6.722 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -9.478 -17.652 -4.958 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -10.605 -17.488 -6.761 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -10.423 -18.294 -5.732 1.00 0.00 N ATOM 0 H HIS A 103 -9.600 -14.960 -3.261 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.631 -16.674 -3.386 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.351 -14.521 -5.373 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.101 -15.707 -5.691 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -9.120 -18.004 -4.002 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -11.311 -17.686 -7.554 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -10.878 -19.189 -5.550 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.453 -13.523 -3.526 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.394 -12.654 -3.117 1.00 0.00 C ATOM 1576 C VAL A 104 -4.951 -12.806 -1.702 1.00 0.00 C ATOM 1577 O VAL A 104 -3.794 -13.036 -1.357 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.668 -11.235 -3.520 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.473 -10.370 -3.087 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -5.712 -11.230 -5.057 1.00 0.00 C ATOM 0 H VAL A 104 -7.233 -13.022 -3.951 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.515 -12.985 -3.671 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.589 -10.859 -3.075 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.652 -9.333 -3.371 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.350 -10.434 -2.006 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.568 -10.729 -3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.909 -10.219 -5.412 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.754 -11.572 -5.450 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.504 -11.896 -5.400 1.00 0.00 H new ATOM 1590 N MET A 105 -5.914 -12.920 -0.770 1.00 0.00 N ATOM 1591 CA MET A 105 -5.608 -13.200 0.599 1.00 0.00 C ATOM 1592 C MET A 105 -4.840 -14.448 0.869 1.00 0.00 C ATOM 1593 O MET A 105 -3.793 -14.419 1.514 1.00 0.00 O ATOM 1594 CB MET A 105 -6.873 -13.215 1.474 1.00 0.00 C ATOM 1595 CG MET A 105 -7.442 -11.809 1.671 1.00 0.00 C ATOM 1596 SD MET A 105 -6.335 -10.789 2.690 1.00 0.00 S ATOM 1597 CE MET A 105 -7.614 -9.563 3.091 1.00 0.00 C ATOM 0 H MET A 105 -6.910 -12.818 -0.966 1.00 0.00 H new ATOM 0 HA MET A 105 -4.947 -12.374 0.862 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.628 -13.851 1.012 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.639 -13.652 2.445 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.588 -11.334 0.701 1.00 0.00 H new ATOM 0 HG3 MET A 105 -8.421 -11.873 2.146 1.00 0.00 H new ATOM 0 HE1 MET A 105 -7.442 -9.172 4.094 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.573 -8.745 2.371 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.596 -10.034 3.049 1.00 0.00 H new ATOM 1607 N THR A 106 -5.246 -15.610 0.326 1.00 0.00 N ATOM 1608 CA THR A 106 -4.519 -16.835 0.455 1.00 0.00 C ATOM 1609 C THR A 106 -3.086 -16.846 0.048 1.00 0.00 C ATOM 1610 O THR A 106 -2.191 -17.492 0.590 1.00 0.00 O ATOM 1611 CB THR A 106 -5.073 -18.087 -0.158 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.487 -18.160 -0.051 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.571 -19.445 0.362 1.00 0.00 C ATOM 0 H THR A 106 -6.104 -15.700 -0.218 1.00 0.00 H new ATOM 0 HA THR A 106 -4.637 -16.855 1.538 1.00 0.00 H new ATOM 0 HB THR A 106 -4.701 -17.964 -1.175 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.804 -18.990 -0.465 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.067 -20.249 -0.182 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.494 -19.516 0.212 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.796 -19.533 1.425 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.812 -16.075 -1.020 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.558 -16.089 -1.706 1.00 0.00 C ATOM 1623 C ASN A 107 -0.579 -15.158 -1.077 1.00 0.00 C ATOM 1624 O ASN A 107 0.633 -15.343 -1.178 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.664 -15.595 -3.159 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.568 -16.486 -3.999 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.831 -17.657 -3.729 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.088 -15.925 -5.123 1.00 0.00 N ATOM 0 H ASN A 107 -3.485 -15.421 -1.419 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.243 -17.131 -1.660 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.050 -14.576 -3.168 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.670 -15.564 -3.605 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.691 -16.474 -5.735 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.875 -14.955 -5.354 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.075 -14.080 -0.444 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.268 -13.205 0.349 1.00 0.00 C ATOM 1637 C LEU A 108 0.202 -13.925 1.566 1.00 0.00 C ATOM 1638 O LEU A 108 1.344 -13.751 1.987 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.008 -11.985 0.923 1.00 0.00 C ATOM 1640 CG LEU A 108 -1.122 -10.884 -0.145 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -1.913 -9.757 0.541 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.183 -10.265 -0.672 1.00 0.00 C ATOM 0 H LEU A 108 -2.058 -13.810 -0.484 1.00 0.00 H new ATOM 0 HA LEU A 108 0.517 -12.881 -0.334 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.002 -12.279 1.261 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.475 -11.604 1.794 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.572 -11.346 -1.024 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.041 -8.927 -0.154 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -2.891 -10.131 0.843 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.368 -9.413 1.420 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.050 -9.505 -1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.728 -9.808 0.154 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.797 -11.043 -1.126 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.705 -14.652 2.244 1.00 0.00 N ATOM 1655 CA GLY A 109 -0.352 -15.558 3.293 1.00 0.00 C ATOM 1656 C GLY A 109 -1.443 -15.717 4.295 1.00 0.00 C ATOM 1657 O GLY A 109 -1.166 -16.218 5.384 1.00 0.00 O ATOM 0 H GLY A 109 -1.707 -14.609 2.059 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.111 -16.531 2.864 1.00 0.00 H new ATOM 0 HA3 GLY A 109 0.548 -15.199 3.793 1.00 0.00 H new ATOM 1661 N GLU A 110 -2.677 -15.305 3.953 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.705 -15.329 4.947 1.00 0.00 C ATOM 1663 C GLU A 110 -4.845 -16.187 4.518 1.00 0.00 C ATOM 1664 O GLU A 110 -5.399 -15.881 3.463 1.00 0.00 O ATOM 1665 CB GLU A 110 -4.240 -13.966 5.416 1.00 0.00 C ATOM 1666 CG GLU A 110 -5.127 -13.994 6.662 1.00 0.00 C ATOM 1667 CD GLU A 110 -4.280 -14.114 7.921 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.903 -15.243 8.335 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.885 -13.126 8.595 1.00 0.00 O ATOM 0 H GLU A 110 -2.956 -14.969 3.031 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.199 -15.749 5.816 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.391 -13.311 5.612 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.806 -13.518 4.599 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.728 -13.086 6.707 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.820 -14.833 6.602 1.00 0.00 H new ATOM 1676 N LYS A 111 -5.304 -17.178 5.303 1.00 0.00 N ATOM 1677 CA LYS A 111 -6.438 -18.033 5.136 1.00 0.00 C ATOM 1678 C LYS A 111 -7.617 -17.339 5.727 1.00 0.00 C ATOM 1679 O LYS A 111 -7.810 -17.388 6.941 1.00 0.00 O ATOM 1680 CB LYS A 111 -6.267 -19.396 5.826 1.00 0.00 C ATOM 1681 CG LYS A 111 -7.344 -20.447 5.549 1.00 0.00 C ATOM 1682 CD LYS A 111 -7.143 -21.864 6.091 1.00 0.00 C ATOM 1683 CE LYS A 111 -7.969 -22.955 5.407 1.00 0.00 C ATOM 1684 NZ LYS A 111 -9.409 -22.743 5.677 1.00 0.00 N ATOM 0 H LYS A 111 -4.812 -17.405 6.167 1.00 0.00 H new ATOM 0 HA LYS A 111 -6.563 -18.229 4.071 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.304 -19.810 5.528 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -6.223 -19.229 6.902 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -8.285 -20.070 5.950 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -7.464 -20.520 4.468 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -6.088 -22.122 6.002 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.382 -21.865 7.154 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.786 -22.941 4.333 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -7.663 -23.936 5.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -9.963 -23.488 5.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -9.579 -22.778 6.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -9.698 -21.814 5.309 1.00 0.00 H new ATOM 1698 N LEU A 112 -8.460 -16.706 4.892 1.00 0.00 N ATOM 1699 CA LEU A 112 -9.727 -16.300 5.415 1.00 0.00 C ATOM 1700 C LEU A 112 -10.778 -17.339 5.230 1.00 0.00 C ATOM 1701 O LEU A 112 -11.068 -17.842 4.145 1.00 0.00 O ATOM 1702 CB LEU A 112 -10.129 -14.970 4.757 1.00 0.00 C ATOM 1703 CG LEU A 112 -9.165 -13.774 4.831 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.974 -12.579 4.299 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.673 -13.426 6.246 1.00 0.00 C ATOM 0 H LEU A 112 -8.282 -16.485 3.912 1.00 0.00 H new ATOM 0 HA LEU A 112 -9.632 -16.163 6.492 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -10.322 -15.171 3.703 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.074 -14.657 5.201 1.00 0.00 H new ATOM 0 HG LEU A 112 -8.267 -14.017 4.264 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.355 -11.682 4.319 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.289 -12.780 3.275 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.853 -12.427 4.925 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.999 -12.571 6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.526 -13.180 6.878 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.144 -14.281 6.668 1.00 0.00 H new ATOM 1717 N THR A 113 -11.444 -17.771 6.316 1.00 0.00 N ATOM 1718 CA THR A 113 -12.644 -18.547 6.253 1.00 0.00 C ATOM 1719 C THR A 113 -13.784 -17.672 5.859 1.00 0.00 C ATOM 1720 O THR A 113 -13.673 -16.449 5.913 1.00 0.00 O ATOM 1721 CB THR A 113 -13.008 -19.211 7.547 1.00 0.00 C ATOM 1722 OG1 THR A 113 -13.335 -18.287 8.574 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.863 -20.113 8.040 1.00 0.00 C ATOM 0 H THR A 113 -11.138 -17.574 7.269 1.00 0.00 H new ATOM 0 HA THR A 113 -12.451 -19.330 5.520 1.00 0.00 H new ATOM 0 HB THR A 113 -13.896 -19.807 7.335 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.512 -17.956 8.990 1.00 0.00 H new ATOM 0 HG21 THR A 113 -12.150 -20.584 8.980 1.00 0.00 H new ATOM 0 HG22 THR A 113 -11.660 -20.883 7.296 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.967 -19.512 8.194 1.00 0.00 H new ATOM 1731 N ASP A 114 -14.934 -18.220 5.428 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.969 -17.416 4.857 1.00 0.00 C ATOM 1733 C ASP A 114 -16.588 -16.401 5.756 1.00 0.00 C ATOM 1734 O ASP A 114 -17.007 -15.331 5.316 1.00 0.00 O ATOM 1735 CB ASP A 114 -17.137 -18.203 4.239 1.00 0.00 C ATOM 1736 CG ASP A 114 -16.553 -19.192 3.241 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.864 -20.165 3.652 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.583 -18.882 2.020 1.00 0.00 O ATOM 0 H ASP A 114 -15.147 -19.216 5.475 1.00 0.00 H new ATOM 0 HA ASP A 114 -15.389 -16.911 4.085 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -17.697 -18.727 5.013 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.834 -17.527 3.744 1.00 0.00 H new ATOM 1743 N GLU A 115 -16.430 -16.705 7.057 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.698 -15.834 8.159 1.00 0.00 C ATOM 1745 C GLU A 115 -15.936 -14.564 8.324 1.00 0.00 C ATOM 1746 O GLU A 115 -16.504 -13.476 8.409 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.738 -16.582 9.502 1.00 0.00 C ATOM 1748 CG GLU A 115 -17.323 -17.993 9.422 1.00 0.00 C ATOM 1749 CD GLU A 115 -18.711 -18.108 8.808 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -19.634 -17.449 9.356 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -18.890 -18.892 7.838 1.00 0.00 O ATOM 0 H GLU A 115 -16.093 -17.620 7.358 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.680 -15.479 7.847 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.725 -16.644 9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -17.324 -15.998 10.212 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.640 -18.616 8.845 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.358 -18.408 10.429 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.617 -14.749 8.139 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.630 -13.716 8.077 1.00 0.00 C ATOM 1760 C GLU A 116 -13.761 -12.871 6.857 1.00 0.00 C ATOM 1761 O GLU A 116 -13.840 -11.650 6.988 1.00 0.00 O ATOM 1762 CB GLU A 116 -12.212 -14.277 8.269 1.00 0.00 C ATOM 1763 CG GLU A 116 -12.151 -15.152 9.523 1.00 0.00 C ATOM 1764 CD GLU A 116 -10.859 -15.956 9.555 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.743 -15.438 9.824 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -10.987 -17.175 9.264 1.00 0.00 O ATOM 0 H GLU A 116 -14.215 -15.680 8.026 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.816 -13.045 8.916 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.924 -14.862 7.395 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.498 -13.458 8.354 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.218 -14.526 10.413 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -13.006 -15.827 9.543 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.859 -13.488 5.667 1.00 0.00 N ATOM 1774 CA VAL A 117 -14.129 -12.907 4.388 1.00 0.00 C ATOM 1775 C VAL A 117 -15.189 -11.860 4.390 1.00 0.00 C ATOM 1776 O VAL A 117 -14.921 -10.664 4.285 1.00 0.00 O ATOM 1777 CB VAL A 117 -14.320 -13.921 3.299 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.452 -13.195 1.950 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -13.101 -14.847 3.149 1.00 0.00 C ATOM 0 H VAL A 117 -13.736 -14.498 5.596 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.211 -12.371 4.148 1.00 0.00 H new ATOM 0 HB VAL A 117 -15.205 -14.500 3.563 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.591 -13.927 1.155 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.311 -12.525 1.980 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.548 -12.618 1.758 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.285 -15.564 2.349 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.220 -14.252 2.908 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.933 -15.382 4.084 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.417 -12.327 4.677 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.515 -11.430 4.865 1.00 0.00 C ATOM 1791 C ASP A 118 -17.395 -10.308 5.839 1.00 0.00 C ATOM 1792 O ASP A 118 -17.620 -9.143 5.517 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.733 -12.322 5.159 1.00 0.00 C ATOM 1794 CG ASP A 118 -20.032 -11.531 5.222 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.357 -10.840 4.220 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.735 -11.606 6.265 1.00 0.00 O ATOM 0 H ASP A 118 -16.649 -13.315 4.778 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.587 -10.846 3.948 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.814 -13.087 4.387 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.580 -12.840 6.106 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.958 -10.599 7.077 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.797 -9.638 8.124 1.00 0.00 C ATOM 1803 C GLU A 119 -15.936 -8.452 7.855 1.00 0.00 C ATOM 1804 O GLU A 119 -16.290 -7.313 8.155 1.00 0.00 O ATOM 1805 CB GLU A 119 -16.349 -10.328 9.423 1.00 0.00 C ATOM 1806 CG GLU A 119 -16.258 -9.403 10.639 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.929 -10.317 11.810 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -16.822 -11.079 12.268 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.727 -10.306 12.187 1.00 0.00 O ATOM 0 H GLU A 119 -16.706 -11.546 7.361 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.795 -9.210 8.213 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -17.046 -11.135 9.649 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -15.374 -10.786 9.258 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -15.486 -8.646 10.501 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -17.197 -8.875 10.803 1.00 0.00 H new ATOM 1816 N MET A 120 -14.775 -8.744 7.243 1.00 0.00 N ATOM 1817 CA MET A 120 -13.706 -7.879 6.850 1.00 0.00 C ATOM 1818 C MET A 120 -14.121 -6.985 5.732 1.00 0.00 C ATOM 1819 O MET A 120 -13.934 -5.773 5.823 1.00 0.00 O ATOM 1820 CB MET A 120 -12.537 -8.767 6.391 1.00 0.00 C ATOM 1821 CG MET A 120 -11.718 -9.307 7.566 1.00 0.00 C ATOM 1822 SD MET A 120 -10.239 -10.282 7.158 1.00 0.00 S ATOM 1823 CE MET A 120 -9.175 -8.866 6.754 1.00 0.00 C ATOM 0 H MET A 120 -14.563 -9.710 6.994 1.00 0.00 H new ATOM 0 HA MET A 120 -13.417 -7.247 7.690 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.926 -9.602 5.808 1.00 0.00 H new ATOM 0 HB3 MET A 120 -11.886 -8.194 5.731 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.408 -8.462 8.181 1.00 0.00 H new ATOM 0 HG3 MET A 120 -12.373 -9.925 8.180 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.159 -9.215 6.570 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.555 -8.368 5.862 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.172 -8.164 7.588 1.00 0.00 H new ATOM 1833 N ILE A 121 -14.753 -7.490 4.658 1.00 0.00 N ATOM 1834 CA ILE A 121 -15.368 -6.710 3.629 1.00 0.00 C ATOM 1835 C ILE A 121 -16.475 -5.889 4.196 1.00 0.00 C ATOM 1836 O ILE A 121 -16.679 -4.779 3.709 1.00 0.00 O ATOM 1837 CB ILE A 121 -15.883 -7.544 2.494 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -14.821 -8.436 1.828 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -16.570 -6.654 1.444 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.398 -9.443 0.834 1.00 0.00 C ATOM 0 H ILE A 121 -14.839 -8.494 4.499 1.00 0.00 H new ATOM 0 HA ILE A 121 -14.593 -6.060 3.224 1.00 0.00 H new ATOM 0 HB ILE A 121 -16.607 -8.228 2.936 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.099 -7.803 1.312 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -14.275 -8.975 2.602 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -16.938 -7.274 0.627 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -17.405 -6.127 1.905 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -15.854 -5.930 1.056 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.590 -10.035 0.406 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.098 -10.102 1.348 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.919 -8.911 0.038 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.156 -6.347 5.261 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.321 -5.665 5.734 1.00 0.00 C ATOM 1854 C ARG A 122 -17.992 -4.385 6.423 1.00 0.00 C ATOM 1855 O ARG A 122 -18.548 -3.308 6.215 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.016 -6.502 6.821 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.346 -5.999 7.385 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.799 -6.672 8.683 1.00 0.00 C ATOM 1859 NE ARG A 122 -20.851 -8.133 8.396 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.484 -9.080 9.308 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -20.156 -8.804 10.604 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.334 -10.372 8.896 1.00 0.00 N ATOM 0 H ARG A 122 -16.904 -7.181 5.791 1.00 0.00 H new ATOM 0 HA ARG A 122 -18.936 -5.494 4.850 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.183 -7.500 6.416 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.321 -6.608 7.654 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.266 -4.926 7.559 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.120 -6.142 6.631 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.104 -6.459 9.495 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.776 -6.301 8.994 1.00 0.00 H new ATOM 0 HE ARG A 122 -21.175 -8.439 7.478 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -20.177 -7.842 10.942 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -19.890 -9.560 11.235 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -20.496 -10.618 7.919 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.060 -11.092 9.565 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.863 -4.473 7.148 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.304 -3.350 7.835 1.00 0.00 C ATOM 1878 C GLU A 123 -15.698 -2.296 6.975 1.00 0.00 C ATOM 1879 O GLU A 123 -15.420 -1.192 7.441 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.401 -3.719 9.024 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.015 -4.320 8.780 1.00 0.00 C ATOM 1882 CD GLU A 123 -13.146 -4.375 10.029 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.709 -3.348 10.613 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.778 -5.513 10.425 1.00 0.00 O ATOM 0 H GLU A 123 -16.330 -5.336 7.259 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.194 -2.882 8.255 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.262 -2.815 9.617 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.955 -4.424 9.644 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.130 -5.329 8.383 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -13.503 -3.734 8.017 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.330 -2.703 5.747 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.476 -1.983 4.854 1.00 0.00 C ATOM 1893 C ALA A 124 -15.202 -1.353 3.716 1.00 0.00 C ATOM 1894 O ALA A 124 -14.639 -0.418 3.149 1.00 0.00 O ATOM 1895 CB ALA A 124 -13.424 -2.990 4.361 1.00 0.00 C ATOM 0 H ALA A 124 -15.649 -3.589 5.354 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.019 -1.144 5.379 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -12.740 -2.494 3.672 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -12.864 -3.377 5.212 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -13.921 -3.814 3.849 1.00 0.00 H new ATOM 1901 N ASP A 125 -16.341 -1.910 3.266 1.00 0.00 N ATOM 1902 CA ASP A 125 -17.150 -1.238 2.297 1.00 0.00 C ATOM 1903 C ASP A 125 -17.943 -0.117 2.876 1.00 0.00 C ATOM 1904 O ASP A 125 -18.389 -0.146 4.022 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.046 -2.337 1.703 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.109 -1.848 0.730 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.204 -1.369 1.128 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -18.934 -2.019 -0.506 1.00 0.00 O ATOM 0 H ASP A 125 -16.699 -2.816 3.569 1.00 0.00 H new ATOM 0 HA ASP A 125 -16.536 -0.754 1.537 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -17.414 -3.063 1.191 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -18.539 -2.864 2.520 1.00 0.00 H new ATOM 1913 N ILE A 126 -18.055 0.916 2.022 1.00 0.00 N ATOM 1914 CA ILE A 126 -18.577 2.195 2.390 1.00 0.00 C ATOM 1915 C ILE A 126 -19.921 2.484 1.814 1.00 0.00 C ATOM 1916 O ILE A 126 -20.862 2.803 2.538 1.00 0.00 O ATOM 1917 CB ILE A 126 -17.561 3.279 2.182 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -16.161 2.921 2.709 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -18.074 4.540 2.898 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -15.067 3.952 2.434 1.00 0.00 C ATOM 0 H ILE A 126 -17.773 0.859 1.043 1.00 0.00 H new ATOM 0 HA ILE A 126 -18.770 2.165 3.462 1.00 0.00 H new ATOM 0 HB ILE A 126 -17.447 3.433 1.109 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -16.227 2.766 3.786 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -15.859 1.971 2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -17.357 5.350 2.766 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.035 4.833 2.475 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -18.195 4.331 3.961 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -14.122 3.599 2.848 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -14.962 4.093 1.358 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -15.335 4.900 2.899 1.00 0.00 H new ATOM 1932 N ASP A 127 -20.125 2.445 0.485 1.00 0.00 N ATOM 1933 CA ASP A 127 -21.352 2.668 -0.215 1.00 0.00 C ATOM 1934 C ASP A 127 -22.508 1.791 0.123 1.00 0.00 C ATOM 1935 O ASP A 127 -23.426 2.237 0.810 1.00 0.00 O ATOM 1936 CB ASP A 127 -21.206 2.773 -1.742 1.00 0.00 C ATOM 1937 CG ASP A 127 -20.388 1.615 -2.294 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -20.845 0.441 -2.305 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -19.229 1.860 -2.723 1.00 0.00 O ATOM 0 H ASP A 127 -19.359 2.238 -0.156 1.00 0.00 H new ATOM 0 HA ASP A 127 -21.609 3.648 0.186 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -22.193 2.779 -2.205 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -20.727 3.717 -2.001 1.00 0.00 H new ATOM 1944 N GLY A 128 -22.524 0.516 -0.303 1.00 0.00 N ATOM 1945 CA GLY A 128 -23.504 -0.451 0.086 1.00 0.00 C ATOM 1946 C GLY A 128 -23.353 -1.788 -0.554 1.00 0.00 C ATOM 1947 O GLY A 128 -23.868 -2.781 -0.043 1.00 0.00 O ATOM 0 H GLY A 128 -21.825 0.143 -0.945 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.461 -0.575 1.168 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -24.493 -0.060 -0.151 1.00 0.00 H new ATOM 1951 N ASP A 129 -22.649 -1.971 -1.686 1.00 0.00 N ATOM 1952 CA ASP A 129 -22.893 -3.099 -2.530 1.00 0.00 C ATOM 1953 C ASP A 129 -22.134 -4.276 -2.021 1.00 0.00 C ATOM 1954 O ASP A 129 -22.381 -5.400 -2.456 1.00 0.00 O ATOM 1955 CB ASP A 129 -22.618 -2.723 -3.996 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.218 -2.206 -4.294 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -20.364 -2.176 -3.368 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -20.981 -1.766 -5.450 1.00 0.00 O ATOM 0 H ASP A 129 -21.916 -1.343 -2.015 1.00 0.00 H new ATOM 0 HA ASP A 129 -23.941 -3.396 -2.504 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -22.801 -3.600 -4.617 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.338 -1.962 -4.298 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.182 -4.025 -1.105 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.356 -5.101 -0.654 1.00 0.00 C ATOM 1965 C GLY A 130 -19.233 -5.547 -1.525 1.00 0.00 C ATOM 1966 O GLY A 130 -18.546 -6.518 -1.211 1.00 0.00 O ATOM 0 H GLY A 130 -20.988 -3.114 -0.690 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -19.935 -4.814 0.310 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.000 -5.962 -0.477 1.00 0.00 H new ATOM 1970 N GLN A 131 -18.899 -4.841 -2.620 1.00 0.00 N ATOM 1971 CA GLN A 131 -17.661 -5.009 -3.315 1.00 0.00 C ATOM 1972 C GLN A 131 -16.817 -3.784 -3.229 1.00 0.00 C ATOM 1973 O GLN A 131 -17.294 -2.651 -3.231 1.00 0.00 O ATOM 1974 CB GLN A 131 -17.632 -5.750 -4.662 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.674 -5.139 -5.601 1.00 0.00 C ATOM 1976 CD GLN A 131 -18.534 -5.654 -7.027 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -17.674 -6.449 -7.402 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -19.403 -5.111 -7.921 1.00 0.00 N ATOM 0 H GLN A 131 -19.507 -4.134 -3.033 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.176 -5.799 -2.742 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -16.640 -5.679 -5.107 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.839 -6.809 -4.511 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -19.673 -5.367 -5.230 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -18.573 -4.054 -5.597 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -20.115 -4.452 -7.605 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.343 -5.363 -8.908 1.00 0.00 H new ATOM 1987 N VAL A 132 -15.498 -3.931 -3.010 1.00 0.00 N ATOM 1988 CA VAL A 132 -14.660 -2.855 -2.580 1.00 0.00 C ATOM 1989 C VAL A 132 -14.232 -2.124 -3.806 1.00 0.00 C ATOM 1990 O VAL A 132 -13.508 -2.632 -4.660 1.00 0.00 O ATOM 1991 CB VAL A 132 -13.461 -3.295 -1.792 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -12.526 -2.160 -1.342 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -13.925 -3.836 -0.430 1.00 0.00 C ATOM 0 H VAL A 132 -15.004 -4.815 -3.134 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.230 -2.223 -1.899 1.00 0.00 H new ATOM 0 HB VAL A 132 -12.956 -3.991 -2.462 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -11.690 -2.578 -0.780 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.147 -1.632 -2.217 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -13.077 -1.464 -0.709 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.059 -4.158 0.148 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.452 -3.051 0.113 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.594 -4.683 -0.584 1.00 0.00 H new ATOM 2003 N ASN A 133 -14.550 -0.827 -3.967 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.190 0.047 -5.041 1.00 0.00 C ATOM 2005 C ASN A 133 -12.866 0.663 -4.747 1.00 0.00 C ATOM 2006 O ASN A 133 -12.426 0.599 -3.600 1.00 0.00 O ATOM 2007 CB ASN A 133 -15.316 1.093 -5.103 1.00 0.00 C ATOM 2008 CG ASN A 133 -15.283 2.130 -6.217 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -15.286 3.340 -5.996 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -15.143 1.621 -7.470 1.00 0.00 N ATOM 0 H ASN A 133 -15.118 -0.343 -3.272 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.090 -0.463 -5.999 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -16.262 0.557 -5.177 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -15.325 1.627 -4.153 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -15.036 2.249 -8.267 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -15.145 0.611 -7.613 1.00 0.00 H new ATOM 2017 N TYR A 134 -12.290 1.356 -5.745 1.00 0.00 N ATOM 2018 CA TYR A 134 -11.119 2.167 -5.615 1.00 0.00 C ATOM 2019 C TYR A 134 -11.182 3.105 -4.459 1.00 0.00 C ATOM 2020 O TYR A 134 -10.247 3.100 -3.660 1.00 0.00 O ATOM 2021 CB TYR A 134 -10.776 3.081 -6.804 1.00 0.00 C ATOM 2022 CG TYR A 134 -10.763 2.274 -8.056 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.712 1.430 -8.327 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.616 2.649 -9.067 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.625 0.848 -9.570 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -11.532 2.035 -10.294 1.00 0.00 C ATOM 2027 CZ TYR A 134 -10.564 1.091 -10.545 1.00 0.00 C ATOM 2028 OH TYR A 134 -10.495 0.521 -11.834 1.00 0.00 O ATOM 0 H TYR A 134 -12.662 1.350 -6.695 1.00 0.00 H new ATOM 0 HA TYR A 134 -10.363 1.389 -5.511 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.508 3.885 -6.883 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -9.804 3.549 -6.649 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -8.965 1.227 -7.574 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.350 3.423 -8.898 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.800 0.185 -9.785 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -12.235 2.297 -11.071 1.00 0.00 H new ATOM 0 HH TYR A 134 -11.260 0.824 -12.367 1.00 0.00 H new ATOM 2038 N GLU A 135 -12.186 3.982 -4.280 1.00 0.00 N ATOM 2039 CA GLU A 135 -12.371 4.816 -3.133 1.00 0.00 C ATOM 2040 C GLU A 135 -12.319 4.125 -1.814 1.00 0.00 C ATOM 2041 O GLU A 135 -11.675 4.476 -0.827 1.00 0.00 O ATOM 2042 CB GLU A 135 -13.714 5.539 -3.332 1.00 0.00 C ATOM 2043 CG GLU A 135 -13.704 6.516 -4.509 1.00 0.00 C ATOM 2044 CD GLU A 135 -12.705 7.657 -4.379 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -13.007 8.667 -3.689 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -11.650 7.608 -5.066 1.00 0.00 O ATOM 0 H GLU A 135 -12.914 4.117 -4.981 1.00 0.00 H new ATOM 0 HA GLU A 135 -11.527 5.503 -3.078 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -14.498 4.798 -3.490 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -13.966 6.081 -2.420 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -13.485 5.962 -5.422 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.703 6.937 -4.623 1.00 0.00 H new ATOM 2053 N GLU A 136 -12.882 2.906 -1.733 1.00 0.00 N ATOM 2054 CA GLU A 136 -12.974 2.179 -0.506 1.00 0.00 C ATOM 2055 C GLU A 136 -11.666 1.565 -0.145 1.00 0.00 C ATOM 2056 O GLU A 136 -11.471 1.164 1.002 1.00 0.00 O ATOM 2057 CB GLU A 136 -14.096 1.154 -0.743 1.00 0.00 C ATOM 2058 CG GLU A 136 -15.460 1.782 -1.037 1.00 0.00 C ATOM 2059 CD GLU A 136 -16.543 0.760 -1.352 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -16.400 0.154 -2.447 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -17.555 0.624 -0.613 1.00 0.00 O ATOM 0 H GLU A 136 -13.280 2.417 -2.534 1.00 0.00 H new ATOM 0 HA GLU A 136 -13.211 2.812 0.349 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -13.816 0.511 -1.577 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -14.183 0.516 0.136 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -15.771 2.376 -0.177 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -15.362 2.467 -1.879 1.00 0.00 H new ATOM 2068 N PHE A 137 -10.769 1.439 -1.140 1.00 0.00 N ATOM 2069 CA PHE A 137 -9.594 0.626 -1.085 1.00 0.00 C ATOM 2070 C PHE A 137 -8.577 1.510 -0.449 1.00 0.00 C ATOM 2071 O PHE A 137 -7.869 1.116 0.476 1.00 0.00 O ATOM 2072 CB PHE A 137 -9.105 0.275 -2.500 1.00 0.00 C ATOM 2073 CG PHE A 137 -7.856 -0.536 -2.532 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -7.950 -1.877 -2.242 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -6.669 0.019 -2.950 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -6.900 -2.736 -2.473 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -5.626 -0.847 -3.177 1.00 0.00 C ATOM 2078 CZ PHE A 137 -5.738 -2.203 -2.979 1.00 0.00 C ATOM 0 H PHE A 137 -10.869 1.930 -2.028 1.00 0.00 H new ATOM 0 HA PHE A 137 -9.773 -0.308 -0.553 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -9.893 -0.271 -3.019 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -8.939 1.199 -3.054 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -8.867 -2.264 -1.824 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -6.562 1.084 -3.093 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -6.986 -3.792 -2.264 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -4.684 -0.448 -3.524 1.00 0.00 H new ATOM 0 HZ PHE A 137 -4.910 -2.852 -3.222 1.00 0.00 H new ATOM 2088 N VAL A 138 -8.566 2.807 -0.804 1.00 0.00 N ATOM 2089 CA VAL A 138 -7.595 3.759 -0.361 1.00 0.00 C ATOM 2090 C VAL A 138 -7.840 4.053 1.079 1.00 0.00 C ATOM 2091 O VAL A 138 -7.018 4.116 1.992 1.00 0.00 O ATOM 2092 CB VAL A 138 -7.527 5.002 -1.199 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -6.357 5.910 -0.786 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -7.390 4.583 -2.673 1.00 0.00 C ATOM 0 H VAL A 138 -9.265 3.210 -1.428 1.00 0.00 H new ATOM 0 HA VAL A 138 -6.608 3.314 -0.483 1.00 0.00 H new ATOM 0 HB VAL A 138 -8.439 5.580 -1.050 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -6.345 6.798 -1.418 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -6.478 6.208 0.256 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -5.418 5.369 -0.902 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -7.339 5.473 -3.301 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -6.481 3.995 -2.801 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -8.253 3.984 -2.963 1.00 0.00 H new ATOM 2104 N GLN A 139 -9.118 4.338 1.386 1.00 0.00 N ATOM 2105 CA GLN A 139 -9.557 4.842 2.650 1.00 0.00 C ATOM 2106 C GLN A 139 -9.239 3.976 3.821 1.00 0.00 C ATOM 2107 O GLN A 139 -9.009 4.459 4.928 1.00 0.00 O ATOM 2108 CB GLN A 139 -11.087 4.954 2.540 1.00 0.00 C ATOM 2109 CG GLN A 139 -11.747 5.721 3.688 1.00 0.00 C ATOM 2110 CD GLN A 139 -11.137 7.080 3.998 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -10.698 7.924 3.217 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -10.997 7.306 5.331 1.00 0.00 N ATOM 0 H GLN A 139 -9.881 4.211 0.721 1.00 0.00 H new ATOM 0 HA GLN A 139 -9.038 5.783 2.836 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -11.337 5.445 1.600 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -11.511 3.951 2.498 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -12.802 5.860 3.451 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -11.701 5.107 4.587 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -11.350 6.625 6.004 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -10.539 8.156 5.659 1.00 0.00 H new ATOM 2121 N MET A 140 -9.330 2.640 3.699 1.00 0.00 N ATOM 2122 CA MET A 140 -9.027 1.678 4.713 1.00 0.00 C ATOM 2123 C MET A 140 -7.605 1.781 5.147 1.00 0.00 C ATOM 2124 O MET A 140 -7.400 1.699 6.357 1.00 0.00 O ATOM 2125 CB MET A 140 -9.466 0.220 4.497 1.00 0.00 C ATOM 2126 CG MET A 140 -9.028 -0.400 3.169 1.00 0.00 C ATOM 2127 SD MET A 140 -9.030 -2.217 3.212 1.00 0.00 S ATOM 2128 CE MET A 140 -8.352 -2.360 1.533 1.00 0.00 C ATOM 0 H MET A 140 -9.637 2.202 2.830 1.00 0.00 H new ATOM 0 HA MET A 140 -9.691 1.978 5.524 1.00 0.00 H new ATOM 0 HB2 MET A 140 -9.070 -0.387 5.311 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.553 0.171 4.562 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.693 -0.058 2.376 1.00 0.00 H new ATOM 0 HG3 MET A 140 -8.027 -0.047 2.920 1.00 0.00 H new ATOM 0 HE1 MET A 140 -8.895 -3.131 0.986 1.00 0.00 H new ATOM 0 HE2 MET A 140 -8.457 -1.406 1.016 1.00 0.00 H new ATOM 0 HE3 MET A 140 -7.297 -2.629 1.588 1.00 0.00 H new ATOM 2138 N MET A 141 -6.705 2.060 4.188 1.00 0.00 N ATOM 2139 CA MET A 141 -5.295 2.079 4.423 1.00 0.00 C ATOM 2140 C MET A 141 -4.712 3.276 5.091 1.00 0.00 C ATOM 2141 O MET A 141 -3.605 3.272 5.629 1.00 0.00 O ATOM 2142 CB MET A 141 -4.627 1.825 3.061 1.00 0.00 C ATOM 2143 CG MET A 141 -5.045 0.526 2.368 1.00 0.00 C ATOM 2144 SD MET A 141 -3.911 0.024 1.039 1.00 0.00 S ATOM 2145 CE MET A 141 -4.671 1.062 -0.243 1.00 0.00 C ATOM 0 H MET A 141 -6.964 2.278 3.226 1.00 0.00 H new ATOM 0 HA MET A 141 -5.097 1.307 5.166 1.00 0.00 H new ATOM 0 HB2 MET A 141 -4.855 2.661 2.400 1.00 0.00 H new ATOM 0 HB3 MET A 141 -3.546 1.814 3.200 1.00 0.00 H new ATOM 0 HG2 MET A 141 -5.101 -0.271 3.109 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.046 0.648 1.955 1.00 0.00 H new ATOM 0 HE1 MET A 141 -4.075 1.010 -1.154 1.00 0.00 H new ATOM 0 HE2 MET A 141 -5.680 0.705 -0.449 1.00 0.00 H new ATOM 0 HE3 MET A 141 -4.715 2.095 0.103 1.00 0.00 H new ATOM 2155 N THR A 142 -5.428 4.411 4.997 1.00 0.00 N ATOM 2156 CA THR A 142 -5.070 5.678 5.555 1.00 0.00 C ATOM 2157 C THR A 142 -5.667 5.816 6.948 1.00 0.00 C ATOM 2158 O THR A 142 -6.896 6.031 7.127 1.00 0.00 O ATOM 2159 CB THR A 142 -5.328 6.911 4.741 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.730 6.985 4.527 1.00 0.00 O ATOM 2161 CG2 THR A 142 -4.784 6.785 3.307 1.00 0.00 C ATOM 0 H THR A 142 -6.317 4.445 4.497 1.00 0.00 H new ATOM 0 HA THR A 142 -3.981 5.642 5.579 1.00 0.00 H new ATOM 0 HB THR A 142 -4.874 7.748 5.271 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.200 6.778 5.362 1.00 0.00 H new ATOM 0 HG21 THR A 142 -4.994 7.702 2.756 1.00 0.00 H new ATOM 0 HG22 THR A 142 -3.707 6.620 3.340 1.00 0.00 H new ATOM 0 HG23 THR A 142 -5.265 5.944 2.808 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -8.947 -4.565 12.975 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.071 -3.657 12.201 1.00 0.00 C ATOM 2172 C ARG B 1 -6.775 -4.186 11.689 1.00 0.00 C ATOM 2173 O ARG B 1 -6.427 -3.882 10.549 1.00 0.00 O ATOM 2174 CB ARG B 1 -7.905 -2.360 13.011 1.00 0.00 C ATOM 2175 CG ARG B 1 -6.976 -1.306 12.405 1.00 0.00 C ATOM 2176 CD ARG B 1 -6.873 -0.039 13.257 1.00 0.00 C ATOM 2177 NE ARG B 1 -5.491 0.495 13.097 1.00 0.00 N ATOM 2178 CZ ARG B 1 -5.169 1.765 12.712 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -6.140 2.695 12.481 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -3.837 1.945 12.474 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.808 -4.056 13.262 1.00 0.00 H new ATOM 0 H2 ARG B 1 -9.208 -5.382 12.386 1.00 0.00 H new ATOM 0 H3 ARG B 1 -8.442 -4.896 13.822 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.587 -3.489 11.256 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.889 -1.912 13.149 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -7.531 -2.619 14.002 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -5.982 -1.735 12.280 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -7.336 -1.041 11.411 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -7.609 0.699 12.938 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -7.079 -0.263 14.304 1.00 0.00 H new ATOM 0 HE ARG B 1 -4.719 -0.143 13.292 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.122 2.446 12.595 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -5.884 3.640 12.194 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -3.188 1.166 12.589 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -3.490 2.858 12.181 1.00 0.00 H new ATOM 2193 N ARG B 2 -5.955 -4.940 12.444 1.00 0.00 N ATOM 2194 CA ARG B 2 -4.698 -5.453 11.997 1.00 0.00 C ATOM 2195 C ARG B 2 -4.651 -6.206 10.712 1.00 0.00 C ATOM 2196 O ARG B 2 -3.838 -5.931 9.831 1.00 0.00 O ATOM 2197 CB ARG B 2 -4.046 -6.187 13.181 1.00 0.00 C ATOM 2198 CG ARG B 2 -3.883 -5.382 14.472 1.00 0.00 C ATOM 2199 CD ARG B 2 -3.137 -6.045 15.631 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.290 -5.092 16.766 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.619 -5.256 17.943 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -1.889 -6.370 18.243 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -2.726 -4.270 18.881 1.00 0.00 N ATOM 0 H ARG B 2 -6.177 -5.202 13.404 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.110 -4.588 11.692 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -4.641 -7.073 13.403 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -3.061 -6.534 12.868 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -3.366 -4.455 14.226 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -4.877 -5.109 14.825 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -3.562 -7.020 15.871 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -2.087 -6.206 15.387 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.915 -4.293 16.660 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -1.825 -7.134 17.570 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -1.407 -6.438 19.140 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -3.294 -3.444 18.691 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -2.238 -4.359 19.772 1.00 0.00 H new ATOM 2217 N LYS B 3 -5.550 -7.176 10.468 1.00 0.00 N ATOM 2218 CA LYS B 3 -5.545 -8.167 9.437 1.00 0.00 C ATOM 2219 C LYS B 3 -5.951 -7.582 8.128 1.00 0.00 C ATOM 2220 O LYS B 3 -5.654 -8.073 7.040 1.00 0.00 O ATOM 2221 CB LYS B 3 -6.380 -9.421 9.743 1.00 0.00 C ATOM 2222 CG LYS B 3 -6.290 -10.647 8.832 1.00 0.00 C ATOM 2223 CD LYS B 3 -7.360 -11.671 9.215 1.00 0.00 C ATOM 2224 CE LYS B 3 -7.045 -12.264 10.590 1.00 0.00 C ATOM 2225 NZ LYS B 3 -5.704 -12.883 10.673 1.00 0.00 N ATOM 0 H LYS B 3 -6.373 -7.274 11.063 1.00 0.00 H new ATOM 0 HA LYS B 3 -4.511 -8.508 9.385 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -6.117 -9.746 10.750 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.426 -9.114 9.770 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.420 -10.347 7.792 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -5.300 -11.097 8.913 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -8.341 -11.196 9.230 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -7.401 -12.464 8.468 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -7.121 -11.478 11.342 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.798 -13.013 10.835 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -5.800 -13.886 10.932 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -5.229 -12.807 9.751 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -5.139 -12.392 11.395 1.00 0.00 H new ATOM 2239 N TRP B 4 -6.587 -6.397 8.159 1.00 0.00 N ATOM 2240 CA TRP B 4 -6.649 -5.578 6.989 1.00 0.00 C ATOM 2241 C TRP B 4 -5.416 -4.766 6.793 1.00 0.00 C ATOM 2242 O TRP B 4 -4.868 -4.760 5.692 1.00 0.00 O ATOM 2243 CB TRP B 4 -7.804 -4.563 7.017 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.142 -5.052 6.518 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.336 -5.073 7.180 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.411 -5.459 5.163 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.329 -5.469 6.323 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -10.787 -5.707 5.082 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -8.627 -5.518 4.044 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.382 -6.008 3.888 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.175 -5.947 2.858 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -10.544 -6.064 2.800 1.00 0.00 C ATOM 0 H TRP B 4 -7.052 -6.011 8.981 1.00 0.00 H new ATOM 0 HA TRP B 4 -6.786 -6.300 6.184 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -7.928 -4.216 8.043 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -7.513 -3.698 6.421 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.476 -4.817 8.220 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.314 -5.571 6.567 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -7.587 -5.230 4.091 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.443 -6.190 3.805 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -8.555 -6.183 2.006 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -10.993 -6.211 1.829 1.00 0.00 H new ATOM 2263 N GLN B 5 -4.867 -4.025 7.773 1.00 0.00 N ATOM 2264 CA GLN B 5 -3.736 -3.160 7.638 1.00 0.00 C ATOM 2265 C GLN B 5 -2.529 -3.861 7.117 1.00 0.00 C ATOM 2266 O GLN B 5 -1.946 -3.352 6.161 1.00 0.00 O ATOM 2267 CB GLN B 5 -3.343 -2.374 8.900 1.00 0.00 C ATOM 2268 CG GLN B 5 -4.464 -1.423 9.323 1.00 0.00 C ATOM 2269 CD GLN B 5 -4.815 -0.447 8.209 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -3.920 -0.091 7.444 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -6.086 0.025 8.100 1.00 0.00 N ATOM 0 H GLN B 5 -5.239 -4.032 8.723 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.091 -2.432 6.908 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -3.124 -3.068 9.712 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -2.432 -1.807 8.711 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -5.348 -1.999 9.596 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -4.158 -0.869 10.211 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -6.805 -0.291 8.751 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -6.320 0.695 7.367 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.136 -5.048 7.614 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.011 -5.784 7.128 1.00 0.00 C ATOM 2282 C LYS B 6 -1.027 -6.109 5.674 1.00 0.00 C ATOM 2283 O LYS B 6 -0.020 -6.021 4.973 1.00 0.00 O ATOM 2284 CB LYS B 6 -0.691 -6.999 8.014 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.822 -8.020 8.155 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.829 -9.241 7.232 1.00 0.00 C ATOM 2287 CE LYS B 6 -2.658 -10.449 7.671 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.064 -11.153 8.829 1.00 0.00 N ATOM 0 H LYS B 6 -2.620 -5.512 8.383 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.178 -5.086 7.212 1.00 0.00 H new ATOM 0 HB2 LYS B 6 0.184 -7.505 7.607 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -0.419 -6.642 9.008 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.814 -8.383 9.183 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -2.764 -7.491 8.011 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -2.190 -8.922 6.254 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.798 -9.570 7.100 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.665 -10.121 7.927 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.752 -11.144 6.836 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.418 -12.131 8.860 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.028 -11.162 8.736 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.328 -10.662 9.707 1.00 0.00 H new ATOM 2302 N THR B 7 -2.257 -6.355 5.188 1.00 0.00 N ATOM 2303 CA THR B 7 -2.646 -6.669 3.848 1.00 0.00 C ATOM 2304 C THR B 7 -2.538 -5.460 2.983 1.00 0.00 C ATOM 2305 O THR B 7 -2.098 -5.543 1.838 1.00 0.00 O ATOM 2306 CB THR B 7 -4.036 -7.213 3.699 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.196 -8.283 4.618 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.310 -7.852 2.327 1.00 0.00 C ATOM 0 H THR B 7 -3.068 -6.330 5.807 1.00 0.00 H new ATOM 0 HA THR B 7 -1.958 -7.458 3.544 1.00 0.00 H new ATOM 0 HB THR B 7 -4.704 -6.365 3.852 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.760 -7.991 5.365 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.335 -8.222 2.296 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.169 -7.107 1.544 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.620 -8.681 2.167 1.00 0.00 H new ATOM 2316 N GLY B 8 -2.981 -4.299 3.498 1.00 0.00 N ATOM 2317 CA GLY B 8 -2.853 -3.004 2.905 1.00 0.00 C ATOM 2318 C GLY B 8 -1.449 -2.618 2.589 1.00 0.00 C ATOM 2319 O GLY B 8 -1.131 -2.364 1.428 1.00 0.00 O ATOM 0 H GLY B 8 -3.464 -4.265 4.396 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.442 -2.976 1.988 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.279 -2.263 3.581 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.608 -2.611 3.638 1.00 0.00 N ATOM 2324 CA HIS B 9 0.804 -2.406 3.533 1.00 0.00 C ATOM 2325 C HIS B 9 1.534 -3.250 2.546 1.00 0.00 C ATOM 2326 O HIS B 9 2.419 -2.873 1.779 1.00 0.00 O ATOM 2327 CB HIS B 9 1.505 -2.720 4.866 1.00 0.00 C ATOM 2328 CG HIS B 9 1.293 -1.740 5.982 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.090 -1.467 6.599 1.00 0.00 N ATOM 2330 CD2 HIS B 9 2.154 -0.839 6.526 1.00 0.00 C ATOM 2331 CE1 HIS B 9 0.292 -0.414 7.436 1.00 0.00 C ATOM 2332 NE2 HIS B 9 1.540 0.016 7.418 1.00 0.00 N ATOM 0 H HIS B 9 -0.923 -2.754 4.597 1.00 0.00 H new ATOM 0 HA HIS B 9 0.851 -1.364 3.217 1.00 0.00 H new ATOM 0 HB2 HIS B 9 1.170 -3.700 5.205 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.576 -2.797 4.678 1.00 0.00 H new ATOM 0 HD1 HIS B 9 -0.789 -1.963 6.454 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.206 -0.797 6.286 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.483 0.022 8.048 1.00 0.00 H new ATOM 2340 N ALA B 10 1.166 -4.544 2.556 1.00 0.00 N ATOM 2341 CA ALA B 10 1.779 -5.491 1.677 1.00 0.00 C ATOM 2342 C ALA B 10 1.384 -5.319 0.251 1.00 0.00 C ATOM 2343 O ALA B 10 2.218 -5.166 -0.640 1.00 0.00 O ATOM 2344 CB ALA B 10 1.477 -6.933 2.115 1.00 0.00 C ATOM 0 H ALA B 10 0.449 -4.933 3.168 1.00 0.00 H new ATOM 0 HA ALA B 10 2.850 -5.298 1.746 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.956 -7.630 1.428 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.861 -7.095 3.122 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.400 -7.098 2.106 1.00 0.00 H new ATOM 2350 N VAL B 11 0.083 -5.403 -0.077 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.334 -5.233 -1.435 1.00 0.00 C ATOM 2352 C VAL B 11 -0.167 -3.877 -2.031 1.00 0.00 C ATOM 2353 O VAL B 11 -0.043 -3.681 -3.239 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.744 -5.740 -1.497 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.764 -4.780 -0.862 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.245 -6.125 -2.900 1.00 0.00 C ATOM 0 H VAL B 11 -0.671 -5.586 0.586 1.00 0.00 H new ATOM 0 HA VAL B 11 0.341 -5.802 -2.074 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.681 -6.655 -0.909 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.764 -5.207 -0.941 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.516 -4.628 0.188 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.736 -3.823 -1.383 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.274 -6.479 -2.835 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.202 -5.254 -3.554 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.615 -6.916 -3.307 1.00 0.00 H new ATOM 2366 N ARG B 12 -0.113 -2.819 -1.203 1.00 0.00 N ATOM 2367 CA ARG B 12 0.294 -1.571 -1.770 1.00 0.00 C ATOM 2368 C ARG B 12 1.762 -1.500 -2.011 1.00 0.00 C ATOM 2369 O ARG B 12 2.227 -0.858 -2.952 1.00 0.00 O ATOM 2370 CB ARG B 12 -0.058 -0.527 -0.696 1.00 0.00 C ATOM 2371 CG ARG B 12 0.218 0.925 -1.090 1.00 0.00 C ATOM 2372 CD ARG B 12 -0.417 1.859 -0.057 1.00 0.00 C ATOM 2373 NE ARG B 12 0.015 3.245 -0.394 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.436 4.190 0.497 1.00 0.00 C ATOM 2375 NH1 ARG B 12 0.385 3.994 1.847 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.940 5.368 0.026 1.00 0.00 N ATOM 0 H ARG B 12 -0.334 -2.818 -0.207 1.00 0.00 H new ATOM 0 HA ARG B 12 -0.194 -1.420 -2.733 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -1.115 -0.626 -0.448 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.505 -0.755 0.209 1.00 0.00 H new ATOM 0 HG2 ARG B 12 1.292 1.101 -1.145 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -0.189 1.129 -2.080 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -1.504 1.778 -0.081 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -0.100 1.591 0.951 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.006 3.511 -1.378 1.00 0.00 H new ATOM 0 HH11 ARG B 12 0.023 3.117 2.222 1.00 0.00 H new ATOM 0 HH12 ARG B 12 0.709 4.724 2.481 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.998 5.532 -0.979 1.00 0.00 H new ATOM 0 HH22 ARG B 12 1.259 6.084 0.679 1.00 0.00 H new ATOM 2390 N ALA B 13 2.567 -2.188 -1.183 1.00 0.00 N ATOM 2391 CA ALA B 13 3.969 -2.355 -1.413 1.00 0.00 C ATOM 2392 C ALA B 13 4.175 -3.009 -2.736 1.00 0.00 C ATOM 2393 O ALA B 13 5.066 -2.738 -3.540 1.00 0.00 O ATOM 2394 CB ALA B 13 4.703 -3.073 -0.269 1.00 0.00 C ATOM 0 H ALA B 13 2.235 -2.640 -0.331 1.00 0.00 H new ATOM 0 HA ALA B 13 4.426 -1.366 -1.434 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.761 -3.163 -0.515 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.592 -2.499 0.651 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.277 -4.067 -0.131 1.00 0.00 H new ATOM 2400 N ILE B 14 3.434 -4.102 -2.988 1.00 0.00 N ATOM 2401 CA ILE B 14 3.556 -4.794 -4.234 1.00 0.00 C ATOM 2402 C ILE B 14 3.191 -4.132 -5.518 1.00 0.00 C ATOM 2403 O ILE B 14 3.835 -4.173 -6.565 1.00 0.00 O ATOM 2404 CB ILE B 14 2.836 -6.105 -4.120 1.00 0.00 C ATOM 2405 CG1 ILE B 14 3.412 -7.050 -3.052 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.579 -6.899 -5.412 1.00 0.00 C ATOM 2407 CD1 ILE B 14 2.522 -8.243 -2.705 1.00 0.00 C ATOM 0 H ILE B 14 2.758 -4.504 -2.338 1.00 0.00 H new ATOM 0 HA ILE B 14 4.638 -4.866 -4.348 1.00 0.00 H new ATOM 0 HB ILE B 14 1.858 -5.740 -3.805 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.376 -7.422 -3.398 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.599 -6.478 -2.143 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.051 -7.822 -5.173 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.973 -6.301 -6.092 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.530 -7.138 -5.888 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.010 -8.852 -1.944 1.00 0.00 H new ATOM 0 HD12 ILE B 14 1.566 -7.885 -2.324 1.00 0.00 H new ATOM 0 HD13 ILE B 14 2.355 -8.844 -3.599 1.00 0.00 H new ATOM 2419 N GLY B 15 2.291 -3.144 -5.363 1.00 0.00 N ATOM 2420 CA GLY B 15 2.118 -2.081 -6.303 1.00 0.00 C ATOM 2421 C GLY B 15 3.160 -1.026 -6.447 1.00 0.00 C ATOM 2422 O GLY B 15 3.549 -0.671 -7.559 1.00 0.00 O ATOM 0 H GLY B 15 1.665 -3.083 -4.560 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.983 -2.537 -7.284 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.183 -1.579 -6.053 1.00 0.00 H new ATOM 2426 N ARG B 16 3.636 -0.495 -5.306 1.00 0.00 N ATOM 2427 CA ARG B 16 4.657 0.504 -5.243 1.00 0.00 C ATOM 2428 C ARG B 16 5.915 0.057 -5.905 1.00 0.00 C ATOM 2429 O ARG B 16 6.571 0.805 -6.628 1.00 0.00 O ATOM 2430 CB ARG B 16 4.993 0.745 -3.762 1.00 0.00 C ATOM 2431 CG ARG B 16 6.221 1.551 -3.333 1.00 0.00 C ATOM 2432 CD ARG B 16 6.040 3.070 -3.322 1.00 0.00 C ATOM 2433 NE ARG B 16 6.429 3.591 -4.663 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.902 4.689 -5.280 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.841 5.327 -4.704 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.372 5.070 -6.503 1.00 0.00 N ATOM 0 H ARG B 16 3.294 -0.775 -4.387 1.00 0.00 H new ATOM 0 HA ARG B 16 4.287 1.397 -5.747 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.125 1.232 -3.317 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.081 -0.236 -3.295 1.00 0.00 H new ATOM 0 HG2 ARG B 16 6.514 1.230 -2.333 1.00 0.00 H new ATOM 0 HG3 ARG B 16 7.047 1.306 -4.001 1.00 0.00 H new ATOM 0 HD2 ARG B 16 5.005 3.329 -3.099 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.656 3.521 -2.545 1.00 0.00 H new ATOM 0 HE ARG B 16 7.155 3.081 -5.166 1.00 0.00 H new ATOM 0 HH11 ARG B 16 4.454 4.982 -3.826 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.436 6.149 -5.152 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.115 4.535 -6.953 1.00 0.00 H new ATOM 0 HH22 ARG B 16 5.981 5.890 -6.967 1.00 0.00 H new ATOM 2450 N LEU B 17 6.237 -1.240 -5.751 1.00 0.00 N ATOM 2451 CA LEU B 17 7.385 -1.781 -6.411 1.00 0.00 C ATOM 2452 C LEU B 17 7.228 -1.999 -7.876 1.00 0.00 C ATOM 2453 O LEU B 17 8.194 -2.175 -8.617 1.00 0.00 O ATOM 2454 CB LEU B 17 7.931 -3.041 -5.718 1.00 0.00 C ATOM 2455 CG LEU B 17 8.360 -2.972 -4.242 1.00 0.00 C ATOM 2456 CD1 LEU B 17 8.723 -4.389 -3.764 1.00 0.00 C ATOM 2457 CD2 LEU B 17 9.503 -1.958 -4.070 1.00 0.00 C ATOM 0 H LEU B 17 5.714 -1.904 -5.180 1.00 0.00 H new ATOM 0 HA LEU B 17 8.129 -0.991 -6.315 1.00 0.00 H new ATOM 0 HB2 LEU B 17 7.168 -3.815 -5.800 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.793 -3.381 -6.292 1.00 0.00 H new ATOM 0 HG LEU B 17 7.543 -2.615 -3.616 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.029 -4.353 -2.718 1.00 0.00 H new ATOM 0 HD12 LEU B 17 7.855 -5.041 -3.866 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.542 -4.778 -4.369 1.00 0.00 H new ATOM 0 HD21 LEU B 17 9.799 -1.917 -3.022 1.00 0.00 H new ATOM 0 HD22 LEU B 17 10.356 -2.265 -4.676 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.166 -0.972 -4.390 1.00 0.00 H new ATOM 2469 N SER B 18 6.020 -2.057 -8.465 1.00 0.00 N ATOM 2470 CA SER B 18 5.686 -2.509 -9.780 1.00 0.00 C ATOM 2471 C SER B 18 5.723 -1.277 -10.617 1.00 0.00 C ATOM 2472 O SER B 18 6.180 -1.189 -11.756 1.00 0.00 O ATOM 2473 CB SER B 18 4.229 -2.998 -9.851 1.00 0.00 C ATOM 2474 OG SER B 18 3.900 -3.662 -11.062 1.00 0.00 O ATOM 0 H SER B 18 5.187 -1.753 -7.961 1.00 0.00 H new ATOM 0 HA SER B 18 6.357 -3.313 -10.084 1.00 0.00 H new ATOM 0 HB2 SER B 18 4.042 -3.674 -9.016 1.00 0.00 H new ATOM 0 HB3 SER B 18 3.564 -2.144 -9.725 1.00 0.00 H new ATOM 0 HG SER B 18 2.959 -3.498 -11.280 1.00 0.00 H new ATOM 2480 N SER B 19 5.226 -0.188 -10.003 1.00 0.00 N ATOM 2481 CA SER B 19 4.971 1.119 -10.525 1.00 0.00 C ATOM 2482 C SER B 19 6.163 1.667 -11.297 1.00 0.00 C ATOM 2483 O SER B 19 7.193 1.996 -10.651 1.00 0.00 O ATOM 2484 CB SER B 19 4.383 2.071 -9.470 1.00 0.00 C ATOM 2485 OG SER B 19 3.261 2.748 -10.017 1.00 0.00 O ATOM 2486 OXT SER B 19 6.051 1.762 -12.548 1.00 0.00 O ATOM 0 H SER B 19 4.973 -0.235 -9.016 1.00 0.00 H new ATOM 0 HA SER B 19 4.179 1.030 -11.269 1.00 0.00 H new ATOM 0 HB2 SER B 19 4.086 1.510 -8.584 1.00 0.00 H new ATOM 0 HB3 SER B 19 5.137 2.791 -9.154 1.00 0.00 H new ATOM 0 HG SER B 19 2.885 3.354 -9.345 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 14.427 -13.015 5.506 1.00 0.00 CA HETATM 2494 CA CA A 152 18.981 -2.496 2.915 1.00 0.00 CA HETATM 2495 CA CA A 153 -13.582 -7.527 -9.943 1.00 0.00 CA HETATM 2496 CA CA A 154 -18.664 -0.710 -2.480 1.00 0.00 CA