USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=35 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: B 5 GLN : amide:sc= -0.0564 X(o=-0.11,f=0) USER MOD Set 1.2: B 9 HIS : no HD1:sc= -0.0507 X(o=-0.11,f=-0.06) USER MOD Set 2.1: A 105 MET CE :methyl 163:sc= 0 (180deg=-0.00624) USER MOD Set 2.2: A 120 MET CE :methyl 153:sc= -0.171 (180deg=-1.02) USER MOD Set 2.3: B 7 THR OG1 : rot 66:sc= 1.26 USER MOD Set 3.1: A 90 LYS NZ :NH3+ 176:sc= 0.105 (180deg=0) USER MOD Set 3.2: A 103 HIS : no HD1:sc= 0.107 K(o=0.21,f=-3.1) USER MOD Set 4.1: A 1 THR N :NH3+ -148:sc= 1.15 (180deg=-0.433) USER MOD Set 4.2: A 4 GLN : amide:sc= 1.03 K(o=2.2,f=-9.4!) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 61:sc= 1.16 USER MOD Single : A 17 LYS NZ :NH3+ -133:sc= 1.23 (180deg=0.954) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 170:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 71:sc= 0.175 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 62:sc= 1.22 USER MOD Single : A 37 GLN : amide:sc= -0.0416 K(o=-0.042,f=-0.56) USER MOD Single : A 38 ASN : amide:sc= -0.0562 K(o=-0.056,f=-1.2) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 94:sc= 1.27 USER MOD Single : A 67 MET CE :methyl -162:sc= -2.05 (180deg=-2.21!) USER MOD Single : A 68 MET CE :methyl 177:sc= -0.655 (180deg=-0.659) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -172:sc= 0 (180deg=-0.0606) USER MOD Single : A 73 LYS NZ :NH3+ -167:sc= 1.16 (180deg=1.09) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 76:sc= 1.24 USER MOD Single : A 93 ASN : amide:sc= 0.436 K(o=0.44,f=-3.5!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -57:sc= 0.668 USER MOD Single : A 106 THR OG1 : rot 69:sc= 0.0533 USER MOD Single : A 107 ASN : amide:sc= 0.493 K(o=0.49,f=-2.8!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.00403 USER MOD Single : A 131 GLN : amide:sc= 0.662 K(o=0.66,f=-0.019) USER MOD Single : A 133 ASN : amide:sc= -0.312 K(o=-0.31,f=-3.1) USER MOD Single : A 134 TYR OH : rot 177:sc= 1.3 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 MET CE :methyl -169:sc= -0.145 (180deg=-0.259) USER MOD Single : A 141 MET CE :methyl -123:sc= -0.0455 (180deg=-0.957) USER MOD Single : A 142 THR OG1 : rot -66:sc= 1.21 USER MOD Single : B 1 ARG N :NH3+ 175:sc= -0.0915 (180deg=-0.171) USER MOD Single : B 3 LYS NZ :NH3+ -168:sc= 1.29 (180deg=1.16) USER MOD Single : B 6 LYS NZ :NH3+ -135:sc= 1.2 (180deg=0.213) USER MOD Single : B 18 SER OG : rot -145:sc= 1.02 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 5.017 5.844 14.900 1.00 0.00 N ATOM 2 CA THR A 1 4.665 5.510 16.298 1.00 0.00 C ATOM 3 C THR A 1 4.972 4.070 16.529 1.00 0.00 C ATOM 4 O THR A 1 5.261 3.240 15.668 1.00 0.00 O ATOM 5 CB THR A 1 3.220 5.793 16.585 1.00 0.00 C ATOM 6 OG1 THR A 1 2.254 4.915 16.026 1.00 0.00 O ATOM 7 CG2 THR A 1 2.762 7.202 16.170 1.00 0.00 C ATOM 0 H1 THR A 1 5.334 6.833 14.849 1.00 0.00 H new ATOM 0 H2 THR A 1 5.782 5.218 14.576 1.00 0.00 H new ATOM 0 H3 THR A 1 4.183 5.716 14.292 1.00 0.00 H new ATOM 0 HA THR A 1 5.251 6.133 16.973 1.00 0.00 H new ATOM 0 HB THR A 1 3.239 5.655 17.666 1.00 0.00 H new ATOM 0 HG1 THR A 1 1.356 5.207 16.288 1.00 0.00 H new ATOM 0 HG21 THR A 1 1.706 7.327 16.411 1.00 0.00 H new ATOM 0 HG22 THR A 1 3.348 7.948 16.707 1.00 0.00 H new ATOM 0 HG23 THR A 1 2.907 7.331 15.097 1.00 0.00 H new ATOM 14 N GLU A 2 4.902 3.660 17.808 1.00 0.00 N ATOM 15 CA GLU A 2 5.373 2.395 18.281 1.00 0.00 C ATOM 16 C GLU A 2 4.379 1.369 17.857 1.00 0.00 C ATOM 17 O GLU A 2 4.765 0.242 17.551 1.00 0.00 O ATOM 18 CB GLU A 2 5.503 2.389 19.813 1.00 0.00 C ATOM 19 CG GLU A 2 5.966 1.041 20.370 1.00 0.00 C ATOM 20 CD GLU A 2 6.077 1.084 21.887 1.00 0.00 C ATOM 21 OE1 GLU A 2 6.039 2.180 22.506 1.00 0.00 O ATOM 22 OE2 GLU A 2 6.284 -0.018 22.462 1.00 0.00 O ATOM 0 H GLU A 2 4.499 4.237 18.546 1.00 0.00 H new ATOM 0 HA GLU A 2 6.360 2.187 17.868 1.00 0.00 H new ATOM 0 HB2 GLU A 2 6.209 3.162 20.115 1.00 0.00 H new ATOM 0 HB3 GLU A 2 4.540 2.647 20.255 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.263 0.262 20.076 1.00 0.00 H new ATOM 0 HG3 GLU A 2 6.932 0.778 19.939 1.00 0.00 H new ATOM 29 N GLU A 3 3.063 1.646 17.875 1.00 0.00 N ATOM 30 CA GLU A 3 1.962 0.826 17.475 1.00 0.00 C ATOM 31 C GLU A 3 2.144 0.536 16.025 1.00 0.00 C ATOM 32 O GLU A 3 2.031 -0.610 15.592 1.00 0.00 O ATOM 33 CB GLU A 3 0.628 1.520 17.796 1.00 0.00 C ATOM 34 CG GLU A 3 -0.634 0.718 17.473 1.00 0.00 C ATOM 35 CD GLU A 3 -1.952 1.366 17.873 1.00 0.00 C ATOM 36 OE1 GLU A 3 -2.172 1.605 19.090 1.00 0.00 O ATOM 37 OE2 GLU A 3 -2.800 1.636 16.981 1.00 0.00 O ATOM 0 H GLU A 3 2.737 2.552 18.210 1.00 0.00 H new ATOM 0 HA GLU A 3 1.934 -0.115 18.024 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.616 1.769 18.857 1.00 0.00 H new ATOM 0 HB3 GLU A 3 0.588 2.461 17.247 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.656 0.527 16.400 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.562 -0.251 17.968 1.00 0.00 H new ATOM 44 N GLN A 4 2.415 1.611 15.264 1.00 0.00 N ATOM 45 CA GLN A 4 2.613 1.533 13.850 1.00 0.00 C ATOM 46 C GLN A 4 3.639 0.568 13.362 1.00 0.00 C ATOM 47 O GLN A 4 3.257 -0.219 12.497 1.00 0.00 O ATOM 48 CB GLN A 4 2.907 2.893 13.196 1.00 0.00 C ATOM 49 CG GLN A 4 1.679 3.776 12.968 1.00 0.00 C ATOM 50 CD GLN A 4 2.079 5.223 12.720 1.00 0.00 C ATOM 51 OE1 GLN A 4 3.190 5.724 12.892 1.00 0.00 O ATOM 52 NE2 GLN A 4 1.000 5.938 12.303 1.00 0.00 N ATOM 0 H GLN A 4 2.498 2.556 15.640 1.00 0.00 H new ATOM 0 HA GLN A 4 1.641 1.150 13.540 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.615 3.435 13.822 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.396 2.721 12.237 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.112 3.402 12.116 1.00 0.00 H new ATOM 0 HG3 GLN A 4 1.022 3.721 13.836 1.00 0.00 H new ATOM 0 HE21 GLN A 4 0.100 5.475 12.175 1.00 0.00 H new ATOM 0 HE22 GLN A 4 1.091 6.937 12.118 1.00 0.00 H new ATOM 61 N ILE A 5 4.870 0.637 13.900 1.00 0.00 N ATOM 62 CA ILE A 5 5.848 -0.351 13.567 1.00 0.00 C ATOM 63 C ILE A 5 5.508 -1.768 13.875 1.00 0.00 C ATOM 64 O ILE A 5 5.778 -2.688 13.104 1.00 0.00 O ATOM 65 CB ILE A 5 7.207 0.022 14.080 1.00 0.00 C ATOM 66 CG1 ILE A 5 7.223 0.187 15.609 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.746 1.135 13.165 1.00 0.00 C ATOM 68 CD1 ILE A 5 8.691 0.178 16.033 1.00 0.00 C ATOM 0 H ILE A 5 5.183 1.358 14.550 1.00 0.00 H new ATOM 0 HA ILE A 5 5.857 -0.335 12.477 1.00 0.00 H new ATOM 0 HB ILE A 5 7.950 -0.771 14.002 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.740 1.119 15.903 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.675 -0.622 16.092 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.737 1.437 13.504 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.810 0.766 12.142 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.074 1.992 13.200 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.758 0.293 17.115 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.149 -0.767 15.739 1.00 0.00 H new ATOM 0 HD13 ILE A 5 9.215 1.001 15.548 1.00 0.00 H new ATOM 80 N ALA A 6 4.936 -2.099 15.047 1.00 0.00 N ATOM 81 CA ALA A 6 4.389 -3.385 15.350 1.00 0.00 C ATOM 82 C ALA A 6 3.383 -3.952 14.409 1.00 0.00 C ATOM 83 O ALA A 6 3.334 -5.162 14.190 1.00 0.00 O ATOM 84 CB ALA A 6 3.953 -3.347 16.824 1.00 0.00 C ATOM 0 H ALA A 6 4.851 -1.438 15.819 1.00 0.00 H new ATOM 0 HA ALA A 6 5.174 -4.125 15.193 1.00 0.00 H new ATOM 0 HB1 ALA A 6 3.527 -4.311 17.102 1.00 0.00 H new ATOM 0 HB2 ALA A 6 4.817 -3.136 17.454 1.00 0.00 H new ATOM 0 HB3 ALA A 6 3.205 -2.566 16.962 1.00 0.00 H new ATOM 90 N GLU A 7 2.569 -3.042 13.845 1.00 0.00 N ATOM 91 CA GLU A 7 1.552 -3.257 12.863 1.00 0.00 C ATOM 92 C GLU A 7 2.120 -3.785 11.592 1.00 0.00 C ATOM 93 O GLU A 7 1.621 -4.737 10.993 1.00 0.00 O ATOM 94 CB GLU A 7 0.726 -1.985 12.605 1.00 0.00 C ATOM 95 CG GLU A 7 -0.751 -2.214 12.278 1.00 0.00 C ATOM 96 CD GLU A 7 -1.692 -1.404 13.159 1.00 0.00 C ATOM 97 OE1 GLU A 7 -2.079 -0.255 12.816 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.114 -1.928 14.224 1.00 0.00 O ATOM 0 H GLU A 7 2.632 -2.058 14.105 1.00 0.00 H new ATOM 0 HA GLU A 7 0.878 -4.012 13.269 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.790 -1.346 13.486 1.00 0.00 H new ATOM 0 HB3 GLU A 7 1.182 -1.438 11.780 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.930 -1.957 11.234 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.981 -3.274 12.389 1.00 0.00 H new ATOM 105 N PHE A 8 3.180 -3.051 11.212 1.00 0.00 N ATOM 106 CA PHE A 8 3.999 -3.211 10.050 1.00 0.00 C ATOM 107 C PHE A 8 4.731 -4.508 9.999 1.00 0.00 C ATOM 108 O PHE A 8 4.835 -5.211 8.995 1.00 0.00 O ATOM 109 CB PHE A 8 5.045 -2.101 9.853 1.00 0.00 C ATOM 110 CG PHE A 8 5.520 -1.795 8.475 1.00 0.00 C ATOM 111 CD1 PHE A 8 4.612 -1.237 7.606 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.750 -2.182 7.996 1.00 0.00 C ATOM 113 CE1 PHE A 8 4.900 -1.181 6.262 1.00 0.00 C ATOM 114 CE2 PHE A 8 7.026 -2.072 6.653 1.00 0.00 C ATOM 115 CZ PHE A 8 6.125 -1.547 5.757 1.00 0.00 C ATOM 0 H PHE A 8 3.494 -2.264 11.779 1.00 0.00 H new ATOM 0 HA PHE A 8 3.261 -3.166 9.249 1.00 0.00 H new ATOM 0 HB2 PHE A 8 4.633 -1.182 10.271 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.918 -2.361 10.452 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.677 -0.844 7.977 1.00 0.00 H new ATOM 0 HD2 PHE A 8 7.497 -2.571 8.672 1.00 0.00 H new ATOM 0 HE1 PHE A 8 4.137 -0.837 5.580 1.00 0.00 H new ATOM 0 HE2 PHE A 8 7.985 -2.410 6.289 1.00 0.00 H new ATOM 0 HZ PHE A 8 6.367 -1.428 4.711 1.00 0.00 H new ATOM 125 N LYS A 9 5.263 -4.933 11.159 1.00 0.00 N ATOM 126 CA LYS A 9 5.912 -6.189 11.376 1.00 0.00 C ATOM 127 C LYS A 9 5.122 -7.427 11.126 1.00 0.00 C ATOM 128 O LYS A 9 5.678 -8.442 10.709 1.00 0.00 O ATOM 129 CB LYS A 9 6.394 -6.345 12.828 1.00 0.00 C ATOM 130 CG LYS A 9 7.663 -5.584 13.220 1.00 0.00 C ATOM 131 CD LYS A 9 8.007 -5.737 14.703 1.00 0.00 C ATOM 132 CE LYS A 9 9.017 -4.706 15.211 1.00 0.00 C ATOM 133 NZ LYS A 9 9.321 -5.023 16.625 1.00 0.00 N ATOM 0 H LYS A 9 5.237 -4.359 12.002 1.00 0.00 H new ATOM 0 HA LYS A 9 6.708 -6.124 10.634 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.589 -6.026 13.489 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.561 -7.405 13.018 1.00 0.00 H new ATOM 0 HG2 LYS A 9 8.498 -5.943 12.618 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.534 -4.527 12.988 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.092 -5.655 15.289 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.406 -6.737 14.873 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.926 -4.734 14.610 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.610 -3.699 15.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 10.007 -4.335 16.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.447 -4.977 17.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.723 -5.980 16.688 1.00 0.00 H new ATOM 147 N GLU A 10 3.789 -7.323 11.278 1.00 0.00 N ATOM 148 CA GLU A 10 2.885 -8.358 10.884 1.00 0.00 C ATOM 149 C GLU A 10 2.669 -8.415 9.410 1.00 0.00 C ATOM 150 O GLU A 10 2.547 -9.426 8.721 1.00 0.00 O ATOM 151 CB GLU A 10 1.518 -8.166 11.563 1.00 0.00 C ATOM 152 CG GLU A 10 1.689 -8.406 13.064 1.00 0.00 C ATOM 153 CD GLU A 10 1.732 -9.824 13.615 1.00 0.00 C ATOM 154 OE1 GLU A 10 0.732 -10.553 13.381 1.00 0.00 O ATOM 155 OE2 GLU A 10 2.744 -10.204 14.263 1.00 0.00 O ATOM 0 H GLU A 10 3.332 -6.506 11.682 1.00 0.00 H new ATOM 0 HA GLU A 10 3.348 -9.294 11.198 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.141 -7.160 11.380 1.00 0.00 H new ATOM 0 HB3 GLU A 10 0.787 -8.860 11.148 1.00 0.00 H new ATOM 0 HG2 GLU A 10 2.614 -7.914 13.366 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.873 -7.888 13.569 1.00 0.00 H new ATOM 162 N ALA A 11 2.480 -7.249 8.768 1.00 0.00 N ATOM 163 CA ALA A 11 2.437 -7.081 7.349 1.00 0.00 C ATOM 164 C ALA A 11 3.718 -7.385 6.652 1.00 0.00 C ATOM 165 O ALA A 11 3.737 -7.790 5.491 1.00 0.00 O ATOM 166 CB ALA A 11 2.041 -5.617 7.090 1.00 0.00 C ATOM 0 H ALA A 11 2.349 -6.371 9.270 1.00 0.00 H new ATOM 0 HA ALA A 11 1.720 -7.795 6.945 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.994 -5.437 6.016 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.065 -5.420 7.534 1.00 0.00 H new ATOM 0 HB3 ALA A 11 2.783 -4.955 7.537 1.00 0.00 H new ATOM 172 N PHE A 12 4.807 -7.321 7.439 1.00 0.00 N ATOM 173 CA PHE A 12 6.106 -7.804 7.087 1.00 0.00 C ATOM 174 C PHE A 12 6.312 -9.274 7.224 1.00 0.00 C ATOM 175 O PHE A 12 6.968 -9.854 6.361 1.00 0.00 O ATOM 176 CB PHE A 12 7.078 -7.043 8.003 1.00 0.00 C ATOM 177 CG PHE A 12 8.512 -7.018 7.599 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.353 -8.082 7.823 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.036 -5.887 7.019 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.668 -8.019 7.427 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.369 -5.800 6.693 1.00 0.00 C ATOM 182 CZ PHE A 12 11.202 -6.879 6.874 1.00 0.00 C ATOM 0 H PHE A 12 4.779 -6.910 8.372 1.00 0.00 H new ATOM 0 HA PHE A 12 6.263 -7.629 6.023 1.00 0.00 H new ATOM 0 HB2 PHE A 12 6.731 -6.013 8.083 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.015 -7.479 9.000 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.980 -8.970 8.311 1.00 0.00 H new ATOM 0 HD2 PHE A 12 8.386 -5.049 6.815 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.298 -8.887 7.554 1.00 0.00 H new ATOM 0 HE2 PHE A 12 10.764 -4.878 6.292 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.243 -6.832 6.591 1.00 0.00 H new ATOM 192 N SER A 13 5.685 -9.927 8.219 1.00 0.00 N ATOM 193 CA SER A 13 5.687 -11.350 8.358 1.00 0.00 C ATOM 194 C SER A 13 4.915 -12.082 7.315 1.00 0.00 C ATOM 195 O SER A 13 4.897 -13.310 7.247 1.00 0.00 O ATOM 196 CB SER A 13 5.089 -11.832 9.690 1.00 0.00 C ATOM 197 OG SER A 13 5.762 -11.219 10.780 1.00 0.00 O ATOM 0 H SER A 13 5.159 -9.449 8.951 1.00 0.00 H new ATOM 0 HA SER A 13 6.751 -11.573 8.277 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.026 -11.592 9.728 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.174 -12.916 9.764 1.00 0.00 H new ATOM 0 HG SER A 13 5.658 -10.246 10.723 1.00 0.00 H new ATOM 203 N LEU A 14 4.189 -11.342 6.457 1.00 0.00 N ATOM 204 CA LEU A 14 3.597 -11.810 5.243 1.00 0.00 C ATOM 205 C LEU A 14 4.644 -12.096 4.222 1.00 0.00 C ATOM 206 O LEU A 14 4.568 -13.146 3.586 1.00 0.00 O ATOM 207 CB LEU A 14 2.504 -10.880 4.690 1.00 0.00 C ATOM 208 CG LEU A 14 1.335 -10.477 5.605 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.598 -9.240 5.062 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.541 -11.787 5.743 1.00 0.00 C ATOM 0 H LEU A 14 4.005 -10.353 6.624 1.00 0.00 H new ATOM 0 HA LEU A 14 3.086 -12.741 5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.990 -9.964 4.354 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.081 -11.358 3.807 1.00 0.00 H new ATOM 0 HG LEU A 14 1.607 -10.118 6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.222 -8.982 5.732 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.292 -8.402 4.998 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.201 -9.459 4.071 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.327 -11.621 6.382 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.209 -12.117 4.758 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.177 -12.553 6.187 1.00 0.00 H new ATOM 222 N PHE A 15 5.546 -11.126 3.987 1.00 0.00 N ATOM 223 CA PHE A 15 6.617 -11.256 3.049 1.00 0.00 C ATOM 224 C PHE A 15 7.803 -12.052 3.472 1.00 0.00 C ATOM 225 O PHE A 15 8.247 -12.968 2.780 1.00 0.00 O ATOM 226 CB PHE A 15 7.249 -9.921 2.617 1.00 0.00 C ATOM 227 CG PHE A 15 6.314 -9.020 1.885 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.318 -8.359 2.564 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.427 -8.727 0.546 1.00 0.00 C ATOM 230 CE1 PHE A 15 4.514 -7.416 1.969 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.681 -7.755 -0.078 1.00 0.00 C ATOM 232 CZ PHE A 15 4.597 -7.256 0.606 1.00 0.00 C ATOM 0 H PHE A 15 5.529 -10.225 4.464 1.00 0.00 H new ATOM 0 HA PHE A 15 6.067 -11.765 2.257 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.620 -9.403 3.501 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.111 -10.127 1.983 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.161 -8.590 3.607 1.00 0.00 H new ATOM 0 HD2 PHE A 15 7.136 -9.288 -0.044 1.00 0.00 H new ATOM 0 HE1 PHE A 15 3.835 -6.816 2.557 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.936 -7.398 -1.065 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.812 -6.739 0.073 1.00 0.00 H new ATOM 242 N ASP A 16 8.340 -11.741 4.665 1.00 0.00 N ATOM 243 CA ASP A 16 9.349 -12.496 5.341 1.00 0.00 C ATOM 244 C ASP A 16 8.771 -13.803 5.763 1.00 0.00 C ATOM 245 O ASP A 16 7.788 -13.919 6.493 1.00 0.00 O ATOM 246 CB ASP A 16 9.836 -11.517 6.423 1.00 0.00 C ATOM 247 CG ASP A 16 10.917 -12.093 7.327 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.462 -13.187 7.022 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.240 -11.516 8.399 1.00 0.00 O ATOM 0 H ASP A 16 8.053 -10.914 5.188 1.00 0.00 H new ATOM 0 HA ASP A 16 10.218 -12.817 4.766 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.219 -10.618 5.941 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.987 -11.214 7.035 1.00 0.00 H new ATOM 254 N LYS A 17 9.349 -14.928 5.304 1.00 0.00 N ATOM 255 CA LYS A 17 8.853 -16.254 5.502 1.00 0.00 C ATOM 256 C LYS A 17 9.493 -16.877 6.695 1.00 0.00 C ATOM 257 O LYS A 17 8.934 -17.816 7.259 1.00 0.00 O ATOM 258 CB LYS A 17 9.088 -17.101 4.240 1.00 0.00 C ATOM 259 CG LYS A 17 8.513 -16.572 2.925 1.00 0.00 C ATOM 260 CD LYS A 17 6.985 -16.479 2.919 1.00 0.00 C ATOM 261 CE LYS A 17 6.302 -15.682 1.806 1.00 0.00 C ATOM 262 NZ LYS A 17 4.883 -15.419 2.135 1.00 0.00 N ATOM 0 H LYS A 17 10.213 -14.909 4.763 1.00 0.00 H new ATOM 0 HA LYS A 17 7.780 -16.206 5.685 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.163 -17.226 4.112 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.671 -18.092 4.416 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.930 -15.585 2.727 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.833 -17.222 2.111 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.592 -17.495 2.887 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.676 -16.048 3.871 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.825 -14.738 1.657 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.365 -16.233 0.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.289 -15.642 1.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.597 -16.013 2.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.765 -14.417 2.386 1.00 0.00 H new ATOM 276 N ASP A 18 10.644 -16.334 7.130 1.00 0.00 N ATOM 277 CA ASP A 18 11.438 -16.769 8.237 1.00 0.00 C ATOM 278 C ASP A 18 11.028 -16.004 9.448 1.00 0.00 C ATOM 279 O ASP A 18 10.704 -16.576 10.487 1.00 0.00 O ATOM 280 CB ASP A 18 12.936 -16.536 7.977 1.00 0.00 C ATOM 281 CG ASP A 18 13.426 -17.072 6.639 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.552 -18.310 6.446 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.717 -16.245 5.734 1.00 0.00 O ATOM 0 H ASP A 18 11.052 -15.522 6.667 1.00 0.00 H new ATOM 0 HA ASP A 18 11.280 -17.838 8.381 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.140 -15.466 8.024 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.510 -17.005 8.776 1.00 0.00 H new ATOM 288 N GLY A 19 10.867 -14.672 9.344 1.00 0.00 N ATOM 289 CA GLY A 19 10.625 -13.946 10.552 1.00 0.00 C ATOM 290 C GLY A 19 11.938 -13.581 11.152 1.00 0.00 C ATOM 291 O GLY A 19 12.087 -13.463 12.367 1.00 0.00 O ATOM 0 H GLY A 19 10.901 -14.126 8.483 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.040 -13.050 10.345 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.045 -14.551 11.249 1.00 0.00 H new ATOM 295 N ASP A 20 12.969 -13.372 10.313 1.00 0.00 N ATOM 296 CA ASP A 20 14.233 -12.841 10.718 1.00 0.00 C ATOM 297 C ASP A 20 14.394 -11.362 10.624 1.00 0.00 C ATOM 298 O ASP A 20 15.313 -10.763 11.181 1.00 0.00 O ATOM 299 CB ASP A 20 15.398 -13.546 10.003 1.00 0.00 C ATOM 300 CG ASP A 20 15.335 -13.440 8.486 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.285 -13.533 7.797 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.413 -13.171 7.893 1.00 0.00 O ATOM 0 H ASP A 20 12.920 -13.581 9.316 1.00 0.00 H new ATOM 0 HA ASP A 20 14.258 -13.055 11.787 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.339 -13.118 10.350 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.403 -14.599 10.285 1.00 0.00 H new ATOM 307 N GLY A 21 13.481 -10.709 9.883 1.00 0.00 N ATOM 308 CA GLY A 21 13.477 -9.286 9.745 1.00 0.00 C ATOM 309 C GLY A 21 14.076 -8.897 8.437 1.00 0.00 C ATOM 310 O GLY A 21 14.432 -7.739 8.223 1.00 0.00 O ATOM 0 H GLY A 21 12.733 -11.177 9.371 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.457 -8.909 9.813 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.040 -8.832 10.561 1.00 0.00 H new ATOM 314 N THR A 22 14.225 -9.795 7.447 1.00 0.00 N ATOM 315 CA THR A 22 14.883 -9.627 6.188 1.00 0.00 C ATOM 316 C THR A 22 13.990 -10.221 5.154 1.00 0.00 C ATOM 317 O THR A 22 13.569 -11.362 5.340 1.00 0.00 O ATOM 318 CB THR A 22 16.246 -10.249 6.111 1.00 0.00 C ATOM 319 OG1 THR A 22 17.177 -9.561 6.933 1.00 0.00 O ATOM 320 CG2 THR A 22 16.840 -10.292 4.693 1.00 0.00 C ATOM 0 H THR A 22 13.844 -10.736 7.541 1.00 0.00 H new ATOM 0 HA THR A 22 15.056 -8.562 6.034 1.00 0.00 H new ATOM 0 HB THR A 22 16.089 -11.272 6.453 1.00 0.00 H new ATOM 0 HG1 THR A 22 18.055 -9.991 6.863 1.00 0.00 H new ATOM 0 HG21 THR A 22 17.826 -10.756 4.725 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.186 -10.873 4.042 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.929 -9.277 4.305 1.00 0.00 H new ATOM 328 N ILE A 23 13.669 -9.452 4.098 1.00 0.00 N ATOM 329 CA ILE A 23 12.955 -10.013 2.994 1.00 0.00 C ATOM 330 C ILE A 23 13.910 -10.269 1.880 1.00 0.00 C ATOM 331 O ILE A 23 14.671 -9.355 1.565 1.00 0.00 O ATOM 332 CB ILE A 23 11.891 -9.076 2.504 1.00 0.00 C ATOM 333 CG1 ILE A 23 10.756 -8.874 3.522 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.332 -9.500 1.135 1.00 0.00 C ATOM 335 CD1 ILE A 23 9.930 -7.592 3.425 1.00 0.00 C ATOM 0 H ILE A 23 13.898 -8.462 4.008 1.00 0.00 H new ATOM 0 HA ILE A 23 12.483 -10.938 3.325 1.00 0.00 H new ATOM 0 HB ILE A 23 12.383 -8.111 2.380 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.073 -9.719 3.434 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.191 -8.917 4.521 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.565 -8.793 0.820 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.138 -9.512 0.401 1.00 0.00 H new ATOM 0 HG23 ILE A 23 10.897 -10.496 1.212 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.169 -7.589 4.205 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.583 -6.728 3.552 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.448 -7.543 2.449 1.00 0.00 H new ATOM 347 N THR A 24 14.087 -11.509 1.389 1.00 0.00 N ATOM 348 CA THR A 24 14.908 -11.886 0.281 1.00 0.00 C ATOM 349 C THR A 24 14.266 -11.951 -1.063 1.00 0.00 C ATOM 350 O THR A 24 13.049 -11.820 -1.185 1.00 0.00 O ATOM 351 CB THR A 24 15.662 -13.150 0.572 1.00 0.00 C ATOM 352 OG1 THR A 24 15.086 -14.434 0.379 1.00 0.00 O ATOM 353 CG2 THR A 24 16.234 -13.201 1.999 1.00 0.00 C ATOM 0 H THR A 24 13.616 -12.313 1.803 1.00 0.00 H new ATOM 0 HA THR A 24 15.590 -11.041 0.189 1.00 0.00 H new ATOM 0 HB THR A 24 16.385 -13.022 -0.234 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.780 -15.120 0.468 1.00 0.00 H new ATOM 0 HG21 THR A 24 16.767 -14.141 2.144 1.00 0.00 H new ATOM 0 HG22 THR A 24 16.921 -12.368 2.146 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.420 -13.131 2.720 1.00 0.00 H new ATOM 361 N THR A 25 15.062 -12.224 -2.112 1.00 0.00 N ATOM 362 CA THR A 25 14.571 -12.365 -3.447 1.00 0.00 C ATOM 363 C THR A 25 13.663 -13.499 -3.778 1.00 0.00 C ATOM 364 O THR A 25 12.659 -13.380 -4.479 1.00 0.00 O ATOM 365 CB THR A 25 15.600 -12.307 -4.537 1.00 0.00 C ATOM 366 OG1 THR A 25 16.515 -13.392 -4.499 1.00 0.00 O ATOM 367 CG2 THR A 25 16.385 -10.989 -4.436 1.00 0.00 C ATOM 0 H THR A 25 16.071 -12.350 -2.030 1.00 0.00 H new ATOM 0 HA THR A 25 13.962 -11.461 -3.426 1.00 0.00 H new ATOM 0 HB THR A 25 15.059 -12.370 -5.481 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.159 -13.302 -5.232 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.132 -10.949 -5.229 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.699 -10.148 -4.541 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.881 -10.934 -3.467 1.00 0.00 H new ATOM 375 N LYS A 26 13.853 -14.610 -3.044 1.00 0.00 N ATOM 376 CA LYS A 26 13.017 -15.770 -3.066 1.00 0.00 C ATOM 377 C LYS A 26 11.700 -15.501 -2.423 1.00 0.00 C ATOM 378 O LYS A 26 10.663 -15.716 -3.048 1.00 0.00 O ATOM 379 CB LYS A 26 13.794 -16.796 -2.224 1.00 0.00 C ATOM 380 CG LYS A 26 12.900 -17.950 -1.763 1.00 0.00 C ATOM 381 CD LYS A 26 13.737 -18.992 -1.018 1.00 0.00 C ATOM 382 CE LYS A 26 12.941 -20.226 -0.588 1.00 0.00 C ATOM 383 NZ LYS A 26 13.609 -21.121 0.383 1.00 0.00 N ATOM 0 H LYS A 26 14.636 -14.703 -2.397 1.00 0.00 H new ATOM 0 HA LYS A 26 12.806 -16.102 -4.083 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.624 -17.191 -2.809 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.224 -16.300 -1.354 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.111 -17.573 -1.113 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.412 -18.410 -2.623 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.562 -19.307 -1.657 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.177 -18.528 -0.135 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.997 -19.893 -0.156 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.697 -20.805 -1.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 12.983 -21.922 0.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.496 -21.477 -0.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.818 -20.594 1.255 1.00 0.00 H new ATOM 397 N GLU A 27 11.627 -14.826 -1.262 1.00 0.00 N ATOM 398 CA GLU A 27 10.509 -14.564 -0.409 1.00 0.00 C ATOM 399 C GLU A 27 9.610 -13.615 -1.125 1.00 0.00 C ATOM 400 O GLU A 27 8.399 -13.796 -1.235 1.00 0.00 O ATOM 401 CB GLU A 27 10.945 -14.035 0.967 1.00 0.00 C ATOM 402 CG GLU A 27 11.820 -15.049 1.707 1.00 0.00 C ATOM 403 CD GLU A 27 12.196 -14.550 3.095 1.00 0.00 C ATOM 404 OE1 GLU A 27 12.913 -13.528 3.266 1.00 0.00 O ATOM 405 OE2 GLU A 27 11.749 -15.128 4.121 1.00 0.00 O ATOM 0 H GLU A 27 12.472 -14.408 -0.872 1.00 0.00 H new ATOM 0 HA GLU A 27 9.973 -15.489 -0.198 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.494 -13.102 0.842 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.063 -13.808 1.566 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.289 -15.997 1.791 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.725 -15.241 1.130 1.00 0.00 H new ATOM 412 N LEU A 28 10.208 -12.519 -1.626 1.00 0.00 N ATOM 413 CA LEU A 28 9.575 -11.544 -2.460 1.00 0.00 C ATOM 414 C LEU A 28 9.072 -12.176 -3.712 1.00 0.00 C ATOM 415 O LEU A 28 7.900 -12.042 -4.059 1.00 0.00 O ATOM 416 CB LEU A 28 10.465 -10.328 -2.768 1.00 0.00 C ATOM 417 CG LEU A 28 9.690 -9.123 -3.326 1.00 0.00 C ATOM 418 CD1 LEU A 28 8.789 -8.573 -2.207 1.00 0.00 C ATOM 419 CD2 LEU A 28 10.634 -8.005 -3.798 1.00 0.00 C ATOM 0 H LEU A 28 11.187 -12.302 -1.439 1.00 0.00 H new ATOM 0 HA LEU A 28 8.729 -11.154 -1.894 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.982 -10.027 -1.857 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.230 -10.621 -3.486 1.00 0.00 H new ATOM 0 HG LEU A 28 9.106 -9.453 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 28 8.228 -7.716 -2.580 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.094 -9.349 -1.885 1.00 0.00 H new ATOM 0 HD13 LEU A 28 9.405 -8.264 -1.363 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.047 -7.172 -4.185 1.00 0.00 H new ATOM 0 HD22 LEU A 28 11.240 -7.663 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 28 11.285 -8.386 -4.585 1.00 0.00 H new ATOM 431 N GLY A 29 9.838 -12.991 -4.459 1.00 0.00 N ATOM 432 CA GLY A 29 9.464 -13.865 -5.528 1.00 0.00 C ATOM 433 C GLY A 29 8.208 -14.613 -5.242 1.00 0.00 C ATOM 434 O GLY A 29 7.260 -14.657 -6.025 1.00 0.00 O ATOM 0 H GLY A 29 10.843 -13.040 -4.289 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.336 -13.283 -6.441 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.271 -14.574 -5.712 1.00 0.00 H new ATOM 438 N THR A 30 8.176 -15.377 -4.136 1.00 0.00 N ATOM 439 CA THR A 30 7.030 -16.103 -3.682 1.00 0.00 C ATOM 440 C THR A 30 5.778 -15.314 -3.513 1.00 0.00 C ATOM 441 O THR A 30 4.756 -15.848 -3.942 1.00 0.00 O ATOM 442 CB THR A 30 7.421 -16.910 -2.479 1.00 0.00 C ATOM 443 OG1 THR A 30 8.451 -17.869 -2.673 1.00 0.00 O ATOM 444 CG2 THR A 30 6.329 -17.830 -1.909 1.00 0.00 C ATOM 0 H THR A 30 8.988 -15.494 -3.529 1.00 0.00 H new ATOM 0 HA THR A 30 6.732 -16.775 -4.487 1.00 0.00 H new ATOM 0 HB THR A 30 7.700 -16.076 -1.835 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.306 -17.409 -2.807 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.719 -18.365 -1.043 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.469 -17.231 -1.608 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.023 -18.547 -2.671 1.00 0.00 H new ATOM 452 N VAL A 31 5.696 -14.029 -3.126 1.00 0.00 N ATOM 453 CA VAL A 31 4.604 -13.107 -3.068 1.00 0.00 C ATOM 454 C VAL A 31 4.112 -12.868 -4.454 1.00 0.00 C ATOM 455 O VAL A 31 3.088 -13.442 -4.821 1.00 0.00 O ATOM 456 CB VAL A 31 4.879 -11.840 -2.314 1.00 0.00 C ATOM 457 CG1 VAL A 31 3.595 -10.993 -2.322 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.172 -12.207 -0.850 1.00 0.00 C ATOM 0 H VAL A 31 6.544 -13.566 -2.800 1.00 0.00 H new ATOM 0 HA VAL A 31 3.817 -13.567 -2.471 1.00 0.00 H new ATOM 0 HB VAL A 31 5.714 -11.302 -2.762 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.769 -10.064 -1.779 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.316 -10.765 -3.351 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.790 -11.549 -1.842 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.375 -11.300 -0.281 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.309 -12.717 -0.423 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.040 -12.865 -0.807 1.00 0.00 H new ATOM 468 N MET A 32 4.853 -12.189 -5.348 1.00 0.00 N ATOM 469 CA MET A 32 4.649 -11.913 -6.736 1.00 0.00 C ATOM 470 C MET A 32 4.276 -13.078 -7.587 1.00 0.00 C ATOM 471 O MET A 32 3.282 -13.095 -8.311 1.00 0.00 O ATOM 472 CB MET A 32 5.952 -11.285 -7.257 1.00 0.00 C ATOM 473 CG MET A 32 6.562 -10.032 -6.626 1.00 0.00 C ATOM 474 SD MET A 32 5.360 -8.721 -6.249 1.00 0.00 S ATOM 475 CE MET A 32 6.378 -7.723 -5.123 1.00 0.00 C ATOM 0 H MET A 32 5.731 -11.771 -5.041 1.00 0.00 H new ATOM 0 HA MET A 32 3.785 -11.252 -6.807 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.715 -12.062 -7.211 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.791 -11.059 -8.311 1.00 0.00 H new ATOM 0 HG2 MET A 32 7.073 -10.315 -5.706 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.319 -9.632 -7.301 1.00 0.00 H new ATOM 0 HE1 MET A 32 5.805 -6.861 -4.781 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.671 -8.328 -4.265 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.270 -7.380 -5.647 1.00 0.00 H new ATOM 485 N ARG A 33 4.955 -14.224 -7.399 1.00 0.00 N ATOM 486 CA ARG A 33 4.799 -15.439 -8.137 1.00 0.00 C ATOM 487 C ARG A 33 3.519 -16.141 -7.838 1.00 0.00 C ATOM 488 O ARG A 33 2.845 -16.651 -8.731 1.00 0.00 O ATOM 489 CB ARG A 33 5.980 -16.422 -8.075 1.00 0.00 C ATOM 490 CG ARG A 33 5.857 -17.612 -9.027 1.00 0.00 C ATOM 491 CD ARG A 33 6.896 -18.723 -8.855 1.00 0.00 C ATOM 492 NE ARG A 33 6.781 -19.324 -7.497 1.00 0.00 N ATOM 493 CZ ARG A 33 7.650 -19.044 -6.482 1.00 0.00 C ATOM 494 NH1 ARG A 33 8.660 -18.151 -6.694 1.00 0.00 N ATOM 495 NH2 ARG A 33 7.408 -19.537 -5.232 1.00 0.00 N ATOM 0 H ARG A 33 5.668 -14.306 -6.674 1.00 0.00 H new ATOM 0 HA ARG A 33 4.774 -15.084 -9.167 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.899 -15.882 -8.303 1.00 0.00 H new ATOM 0 HB3 ARG A 33 6.074 -16.795 -7.055 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.865 -18.048 -8.905 1.00 0.00 H new ATOM 0 HG3 ARG A 33 5.918 -17.241 -10.050 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.749 -19.491 -9.615 1.00 0.00 H new ATOM 0 HD3 ARG A 33 7.898 -18.320 -8.999 1.00 0.00 H new ATOM 0 HE ARG A 33 6.017 -19.975 -7.317 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.760 -17.700 -7.604 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.315 -17.934 -5.943 1.00 0.00 H new ATOM 0 HH21 ARG A 33 6.582 -20.111 -5.061 1.00 0.00 H new ATOM 0 HH22 ARG A 33 8.053 -19.332 -4.469 1.00 0.00 H new ATOM 509 N SER A 34 3.144 -16.276 -6.554 1.00 0.00 N ATOM 510 CA SER A 34 1.882 -16.847 -6.195 1.00 0.00 C ATOM 511 C SER A 34 0.698 -16.020 -6.562 1.00 0.00 C ATOM 512 O SER A 34 -0.368 -16.550 -6.871 1.00 0.00 O ATOM 513 CB SER A 34 1.646 -17.140 -4.704 1.00 0.00 C ATOM 514 OG SER A 34 2.770 -17.752 -4.088 1.00 0.00 O ATOM 0 H SER A 34 3.717 -15.989 -5.761 1.00 0.00 H new ATOM 0 HA SER A 34 1.962 -17.771 -6.767 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.413 -16.210 -4.186 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.778 -17.790 -4.597 1.00 0.00 H new ATOM 0 HG SER A 34 3.539 -17.146 -4.135 1.00 0.00 H new ATOM 520 N LEU A 35 0.825 -14.683 -6.490 1.00 0.00 N ATOM 521 CA LEU A 35 -0.141 -13.732 -6.945 1.00 0.00 C ATOM 522 C LEU A 35 -0.254 -13.833 -8.428 1.00 0.00 C ATOM 523 O LEU A 35 -1.299 -14.297 -8.881 1.00 0.00 O ATOM 524 CB LEU A 35 0.315 -12.284 -6.702 1.00 0.00 C ATOM 525 CG LEU A 35 0.136 -11.834 -5.242 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.800 -10.475 -4.968 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.332 -11.795 -4.782 1.00 0.00 C ATOM 0 H LEU A 35 1.652 -14.240 -6.090 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.066 -13.948 -6.410 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.365 -12.188 -6.980 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.249 -11.617 -7.354 1.00 0.00 H new ATOM 0 HG LEU A 35 0.641 -12.601 -4.655 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.647 -10.199 -3.925 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.868 -10.544 -5.172 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.356 -9.717 -5.613 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.379 -11.469 -3.743 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.891 -11.098 -5.407 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.767 -12.790 -4.870 1.00 0.00 H new ATOM 539 N GLY A 36 0.736 -13.511 -9.279 1.00 0.00 N ATOM 540 CA GLY A 36 0.556 -13.731 -10.680 1.00 0.00 C ATOM 541 C GLY A 36 1.813 -13.566 -11.463 1.00 0.00 C ATOM 542 O GLY A 36 2.158 -14.490 -12.197 1.00 0.00 O ATOM 0 H GLY A 36 1.635 -13.111 -9.009 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.167 -14.737 -10.837 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.194 -13.036 -11.058 1.00 0.00 H new ATOM 546 N GLN A 37 2.401 -12.358 -11.403 1.00 0.00 N ATOM 547 CA GLN A 37 3.552 -11.869 -12.098 1.00 0.00 C ATOM 548 C GLN A 37 4.767 -12.560 -11.582 1.00 0.00 C ATOM 549 O GLN A 37 5.108 -12.341 -10.421 1.00 0.00 O ATOM 550 CB GLN A 37 3.471 -10.338 -11.966 1.00 0.00 C ATOM 551 CG GLN A 37 4.614 -9.453 -12.467 1.00 0.00 C ATOM 552 CD GLN A 37 4.960 -9.694 -13.929 1.00 0.00 C ATOM 553 OE1 GLN A 37 4.221 -10.249 -14.742 1.00 0.00 O ATOM 554 NE2 GLN A 37 6.255 -9.402 -14.222 1.00 0.00 N ATOM 0 H GLN A 37 2.019 -11.638 -10.790 1.00 0.00 H new ATOM 0 HA GLN A 37 3.600 -12.089 -13.164 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.566 -10.018 -12.483 1.00 0.00 H new ATOM 0 HB3 GLN A 37 3.330 -10.113 -10.909 1.00 0.00 H new ATOM 0 HG2 GLN A 37 4.341 -8.406 -12.332 1.00 0.00 H new ATOM 0 HG3 GLN A 37 5.499 -9.632 -11.856 1.00 0.00 H new ATOM 0 HE21 GLN A 37 6.844 -8.941 -13.528 1.00 0.00 H new ATOM 0 HE22 GLN A 37 6.638 -9.643 -15.136 1.00 0.00 H new ATOM 563 N ASN A 38 5.477 -13.402 -12.353 1.00 0.00 N ATOM 564 CA ASN A 38 6.762 -13.892 -11.957 1.00 0.00 C ATOM 565 C ASN A 38 7.763 -12.977 -12.574 1.00 0.00 C ATOM 566 O ASN A 38 7.726 -12.899 -13.801 1.00 0.00 O ATOM 567 CB ASN A 38 6.937 -15.341 -12.439 1.00 0.00 C ATOM 568 CG ASN A 38 8.192 -15.863 -11.754 1.00 0.00 C ATOM 569 OD1 ASN A 38 8.486 -15.657 -10.577 1.00 0.00 O ATOM 570 ND2 ASN A 38 9.002 -16.635 -12.526 1.00 0.00 N ATOM 0 H ASN A 38 5.158 -13.747 -13.259 1.00 0.00 H new ATOM 0 HA ASN A 38 6.883 -13.907 -10.874 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.069 -15.947 -12.177 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.039 -15.382 -13.523 1.00 0.00 H new ATOM 0 HD21 ASN A 38 9.849 -17.041 -12.129 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.762 -16.808 -13.502 1.00 0.00 H new ATOM 577 N PRO A 39 8.672 -12.312 -11.924 1.00 0.00 N ATOM 578 CA PRO A 39 9.512 -11.384 -12.623 1.00 0.00 C ATOM 579 C PRO A 39 10.663 -12.045 -13.299 1.00 0.00 C ATOM 580 O PRO A 39 10.837 -13.258 -13.185 1.00 0.00 O ATOM 581 CB PRO A 39 10.011 -10.441 -11.530 1.00 0.00 C ATOM 582 CG PRO A 39 9.826 -11.195 -10.204 1.00 0.00 C ATOM 583 CD PRO A 39 8.670 -12.171 -10.476 1.00 0.00 C ATOM 0 HA PRO A 39 8.966 -10.880 -13.420 1.00 0.00 H new ATOM 0 HB2 PRO A 39 11.057 -10.180 -11.688 1.00 0.00 H new ATOM 0 HB3 PRO A 39 9.446 -9.509 -11.531 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.735 -11.725 -9.918 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.586 -10.512 -9.389 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.829 -13.129 -9.980 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.720 -11.778 -10.113 1.00 0.00 H new ATOM 591 N THR A 40 11.562 -11.316 -13.984 1.00 0.00 N ATOM 592 CA THR A 40 12.889 -11.632 -14.414 1.00 0.00 C ATOM 593 C THR A 40 13.751 -11.201 -13.277 1.00 0.00 C ATOM 594 O THR A 40 13.552 -10.130 -12.705 1.00 0.00 O ATOM 595 CB THR A 40 13.263 -10.769 -15.583 1.00 0.00 C ATOM 596 OG1 THR A 40 12.400 -11.027 -16.681 1.00 0.00 O ATOM 597 CG2 THR A 40 14.689 -11.001 -16.108 1.00 0.00 C ATOM 0 H THR A 40 11.317 -10.370 -14.275 1.00 0.00 H new ATOM 0 HA THR A 40 12.986 -12.682 -14.689 1.00 0.00 H new ATOM 0 HB THR A 40 13.184 -9.749 -15.206 1.00 0.00 H new ATOM 0 HG1 THR A 40 12.653 -10.457 -17.437 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.878 -10.338 -16.952 1.00 0.00 H new ATOM 0 HG22 THR A 40 15.407 -10.793 -15.315 1.00 0.00 H new ATOM 0 HG23 THR A 40 14.794 -12.037 -16.430 1.00 0.00 H new ATOM 605 N GLU A 41 14.806 -11.955 -12.919 1.00 0.00 N ATOM 606 CA GLU A 41 15.535 -11.715 -11.713 1.00 0.00 C ATOM 607 C GLU A 41 16.385 -10.492 -11.760 1.00 0.00 C ATOM 608 O GLU A 41 16.540 -9.792 -10.761 1.00 0.00 O ATOM 609 CB GLU A 41 16.388 -12.961 -11.420 1.00 0.00 C ATOM 610 CG GLU A 41 17.040 -12.934 -10.037 1.00 0.00 C ATOM 611 CD GLU A 41 17.426 -14.356 -9.656 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.642 -15.302 -9.933 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.431 -14.478 -8.906 1.00 0.00 O ATOM 0 H GLU A 41 15.156 -12.738 -13.471 1.00 0.00 H new ATOM 0 HA GLU A 41 14.817 -11.531 -10.914 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.762 -13.849 -11.502 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.165 -13.048 -12.179 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.921 -12.292 -10.046 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.351 -12.519 -9.302 1.00 0.00 H new ATOM 620 N ALA A 42 16.777 -10.028 -12.961 1.00 0.00 N ATOM 621 CA ALA A 42 17.314 -8.713 -13.127 1.00 0.00 C ATOM 622 C ALA A 42 16.424 -7.633 -12.615 1.00 0.00 C ATOM 623 O ALA A 42 16.837 -6.672 -11.967 1.00 0.00 O ATOM 624 CB ALA A 42 17.717 -8.546 -14.602 1.00 0.00 C ATOM 0 H ALA A 42 16.721 -10.569 -13.824 1.00 0.00 H new ATOM 0 HA ALA A 42 18.202 -8.605 -12.504 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.130 -7.549 -14.756 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.467 -9.294 -14.861 1.00 0.00 H new ATOM 0 HB3 ALA A 42 16.840 -8.677 -15.236 1.00 0.00 H new ATOM 630 N GLU A 43 15.110 -7.659 -12.899 1.00 0.00 N ATOM 631 CA GLU A 43 14.131 -6.670 -12.571 1.00 0.00 C ATOM 632 C GLU A 43 13.606 -6.889 -11.194 1.00 0.00 C ATOM 633 O GLU A 43 13.259 -5.907 -10.540 1.00 0.00 O ATOM 634 CB GLU A 43 13.049 -6.681 -13.664 1.00 0.00 C ATOM 635 CG GLU A 43 13.644 -6.560 -15.068 1.00 0.00 C ATOM 636 CD GLU A 43 12.538 -6.471 -16.110 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.827 -7.462 -16.425 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.327 -5.325 -16.590 1.00 0.00 O ATOM 0 H GLU A 43 14.698 -8.444 -13.404 1.00 0.00 H new ATOM 0 HA GLU A 43 14.569 -5.672 -12.552 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.473 -7.604 -13.594 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.354 -5.858 -13.494 1.00 0.00 H new ATOM 0 HG2 GLU A 43 14.278 -5.675 -15.126 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.279 -7.421 -15.276 1.00 0.00 H new ATOM 645 N LEU A 44 13.718 -8.079 -10.577 1.00 0.00 N ATOM 646 CA LEU A 44 13.538 -8.423 -9.201 1.00 0.00 C ATOM 647 C LEU A 44 14.515 -7.767 -8.287 1.00 0.00 C ATOM 648 O LEU A 44 14.246 -7.243 -7.208 1.00 0.00 O ATOM 649 CB LEU A 44 13.369 -9.945 -9.062 1.00 0.00 C ATOM 650 CG LEU A 44 13.102 -10.424 -7.625 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.800 -9.825 -7.065 1.00 0.00 C ATOM 652 CD2 LEU A 44 12.922 -11.940 -7.807 1.00 0.00 C ATOM 0 H LEU A 44 13.968 -8.906 -11.120 1.00 0.00 H new ATOM 0 HA LEU A 44 12.603 -7.993 -8.841 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.545 -10.267 -9.699 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.269 -10.434 -9.434 1.00 0.00 H new ATOM 0 HG LEU A 44 13.895 -10.138 -6.934 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.642 -10.184 -6.048 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.873 -8.737 -7.058 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.961 -10.128 -7.691 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.723 -12.402 -6.840 1.00 0.00 H new ATOM 0 HD22 LEU A 44 12.084 -12.129 -8.478 1.00 0.00 H new ATOM 0 HD23 LEU A 44 13.831 -12.366 -8.232 1.00 0.00 H new ATOM 664 N GLN A 45 15.783 -7.877 -8.723 1.00 0.00 N ATOM 665 CA GLN A 45 16.878 -7.366 -7.959 1.00 0.00 C ATOM 666 C GLN A 45 16.839 -5.878 -8.032 1.00 0.00 C ATOM 667 O GLN A 45 17.253 -5.183 -7.106 1.00 0.00 O ATOM 668 CB GLN A 45 18.256 -7.942 -8.324 1.00 0.00 C ATOM 669 CG GLN A 45 18.383 -9.451 -8.107 1.00 0.00 C ATOM 670 CD GLN A 45 19.813 -9.819 -8.477 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.064 -10.604 -9.390 1.00 0.00 O ATOM 672 NE2 GLN A 45 20.795 -9.514 -7.587 1.00 0.00 N ATOM 0 H GLN A 45 16.049 -8.319 -9.603 1.00 0.00 H new ATOM 0 HA GLN A 45 16.747 -7.700 -6.930 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.465 -7.718 -9.370 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.018 -7.436 -7.731 1.00 0.00 H new ATOM 0 HG2 GLN A 45 18.170 -9.714 -7.071 1.00 0.00 H new ATOM 0 HG3 GLN A 45 17.669 -9.994 -8.727 1.00 0.00 H new ATOM 0 HE21 GLN A 45 20.607 -8.865 -6.823 1.00 0.00 H new ATOM 0 HE22 GLN A 45 21.719 -9.934 -7.684 1.00 0.00 H new ATOM 681 N ASP A 46 16.402 -5.290 -9.160 1.00 0.00 N ATOM 682 CA ASP A 46 16.190 -3.885 -9.319 1.00 0.00 C ATOM 683 C ASP A 46 15.133 -3.321 -8.434 1.00 0.00 C ATOM 684 O ASP A 46 15.414 -2.345 -7.740 1.00 0.00 O ATOM 685 CB ASP A 46 16.032 -3.633 -10.828 1.00 0.00 C ATOM 686 CG ASP A 46 16.349 -2.169 -11.099 1.00 0.00 C ATOM 687 OD1 ASP A 46 17.447 -1.627 -10.799 1.00 0.00 O ATOM 688 OD2 ASP A 46 15.425 -1.488 -11.618 1.00 0.00 O ATOM 0 H ASP A 46 16.186 -5.822 -10.003 1.00 0.00 H new ATOM 0 HA ASP A 46 17.049 -3.316 -8.962 1.00 0.00 H new ATOM 0 HB2 ASP A 46 16.703 -4.279 -11.394 1.00 0.00 H new ATOM 0 HB3 ASP A 46 15.017 -3.868 -11.149 1.00 0.00 H new ATOM 693 N MET A 47 13.881 -3.808 -8.362 1.00 0.00 N ATOM 694 CA MET A 47 12.850 -3.365 -7.476 1.00 0.00 C ATOM 695 C MET A 47 13.219 -3.421 -6.033 1.00 0.00 C ATOM 696 O MET A 47 12.835 -2.466 -5.359 1.00 0.00 O ATOM 697 CB MET A 47 11.495 -4.008 -7.816 1.00 0.00 C ATOM 698 CG MET A 47 11.461 -5.503 -7.494 1.00 0.00 C ATOM 699 SD MET A 47 9.826 -6.062 -6.929 1.00 0.00 S ATOM 700 CE MET A 47 9.049 -6.275 -8.557 1.00 0.00 C ATOM 0 H MET A 47 13.568 -4.567 -8.968 1.00 0.00 H new ATOM 0 HA MET A 47 12.728 -2.297 -7.654 1.00 0.00 H new ATOM 0 HB2 MET A 47 10.706 -3.501 -7.260 1.00 0.00 H new ATOM 0 HB3 MET A 47 11.283 -3.862 -8.875 1.00 0.00 H new ATOM 0 HG2 MET A 47 11.747 -6.068 -8.381 1.00 0.00 H new ATOM 0 HG3 MET A 47 12.201 -5.722 -6.724 1.00 0.00 H new ATOM 0 HE1 MET A 47 8.023 -6.620 -8.428 1.00 0.00 H new ATOM 0 HE2 MET A 47 9.048 -5.323 -9.087 1.00 0.00 H new ATOM 0 HE3 MET A 47 9.609 -7.011 -9.134 1.00 0.00 H new ATOM 710 N ILE A 48 14.051 -4.375 -5.578 1.00 0.00 N ATOM 711 CA ILE A 48 14.633 -4.440 -4.274 1.00 0.00 C ATOM 712 C ILE A 48 15.609 -3.323 -4.128 1.00 0.00 C ATOM 713 O ILE A 48 15.643 -2.627 -3.114 1.00 0.00 O ATOM 714 CB ILE A 48 15.124 -5.834 -4.021 1.00 0.00 C ATOM 715 CG1 ILE A 48 13.852 -6.694 -3.925 1.00 0.00 C ATOM 716 CG2 ILE A 48 15.982 -5.829 -2.744 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.179 -8.186 -3.972 1.00 0.00 C ATOM 0 H ILE A 48 14.337 -5.158 -6.166 1.00 0.00 H new ATOM 0 HA ILE A 48 13.917 -4.272 -3.470 1.00 0.00 H new ATOM 0 HB ILE A 48 15.768 -6.238 -4.802 1.00 0.00 H new ATOM 0 HG12 ILE A 48 13.326 -6.465 -2.998 1.00 0.00 H new ATOM 0 HG13 ILE A 48 13.179 -6.442 -4.744 1.00 0.00 H new ATOM 0 HG21 ILE A 48 16.347 -6.837 -2.547 1.00 0.00 H new ATOM 0 HG22 ILE A 48 16.829 -5.156 -2.878 1.00 0.00 H new ATOM 0 HG23 ILE A 48 15.379 -5.490 -1.902 1.00 0.00 H new ATOM 0 HD11 ILE A 48 13.257 -8.763 -3.902 1.00 0.00 H new ATOM 0 HD12 ILE A 48 14.682 -8.419 -4.910 1.00 0.00 H new ATOM 0 HD13 ILE A 48 14.832 -8.442 -3.137 1.00 0.00 H new ATOM 729 N ASN A 49 16.524 -3.108 -5.091 1.00 0.00 N ATOM 730 CA ASN A 49 17.653 -2.245 -4.932 1.00 0.00 C ATOM 731 C ASN A 49 17.354 -0.786 -4.879 1.00 0.00 C ATOM 732 O ASN A 49 18.016 0.015 -4.222 1.00 0.00 O ATOM 733 CB ASN A 49 18.657 -2.603 -6.041 1.00 0.00 C ATOM 734 CG ASN A 49 19.958 -1.819 -5.944 1.00 0.00 C ATOM 735 OD1 ASN A 49 20.644 -1.814 -4.923 1.00 0.00 O ATOM 736 ND2 ASN A 49 20.481 -1.233 -7.054 1.00 0.00 N ATOM 0 H ASN A 49 16.476 -3.549 -6.009 1.00 0.00 H new ATOM 0 HA ASN A 49 18.073 -2.422 -3.942 1.00 0.00 H new ATOM 0 HB2 ASN A 49 18.878 -3.669 -5.993 1.00 0.00 H new ATOM 0 HB3 ASN A 49 18.199 -2.416 -7.012 1.00 0.00 H new ATOM 0 HD21 ASN A 49 21.409 -0.811 -7.019 1.00 0.00 H new ATOM 0 HD22 ASN A 49 19.945 -1.215 -7.922 1.00 0.00 H new ATOM 743 N GLU A 50 16.206 -0.469 -5.504 1.00 0.00 N ATOM 744 CA GLU A 50 15.401 0.705 -5.373 1.00 0.00 C ATOM 745 C GLU A 50 14.957 1.045 -3.991 1.00 0.00 C ATOM 746 O GLU A 50 14.793 2.247 -3.790 1.00 0.00 O ATOM 747 CB GLU A 50 14.174 0.751 -6.299 1.00 0.00 C ATOM 748 CG GLU A 50 14.648 1.203 -7.682 1.00 0.00 C ATOM 749 CD GLU A 50 13.632 1.098 -8.810 1.00 0.00 C ATOM 750 OE1 GLU A 50 12.722 0.226 -8.823 1.00 0.00 O ATOM 751 OE2 GLU A 50 13.592 2.003 -9.686 1.00 0.00 O ATOM 0 H GLU A 50 15.798 -1.115 -6.180 1.00 0.00 H new ATOM 0 HA GLU A 50 16.118 1.463 -5.687 1.00 0.00 H new ATOM 0 HB2 GLU A 50 13.703 -0.230 -6.358 1.00 0.00 H new ATOM 0 HB3 GLU A 50 13.426 1.440 -5.908 1.00 0.00 H new ATOM 0 HG2 GLU A 50 14.973 2.241 -7.610 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.523 0.613 -7.954 1.00 0.00 H new ATOM 758 N VAL A 51 14.746 0.075 -3.084 1.00 0.00 N ATOM 759 CA VAL A 51 14.387 0.259 -1.711 1.00 0.00 C ATOM 760 C VAL A 51 15.641 0.166 -0.912 1.00 0.00 C ATOM 761 O VAL A 51 15.787 0.868 0.087 1.00 0.00 O ATOM 762 CB VAL A 51 13.501 -0.818 -1.160 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.148 -0.606 0.321 1.00 0.00 C ATOM 764 CG2 VAL A 51 12.192 -0.795 -1.968 1.00 0.00 C ATOM 0 H VAL A 51 14.833 -0.911 -3.329 1.00 0.00 H new ATOM 0 HA VAL A 51 13.861 1.212 -1.653 1.00 0.00 H new ATOM 0 HB VAL A 51 14.034 -1.766 -1.237 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.505 -1.418 0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.062 -0.594 0.915 1.00 0.00 H new ATOM 0 HG13 VAL A 51 12.626 0.344 0.438 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.520 -1.568 -1.594 1.00 0.00 H new ATOM 0 HG22 VAL A 51 11.717 0.180 -1.863 1.00 0.00 H new ATOM 0 HG23 VAL A 51 12.410 -0.981 -3.020 1.00 0.00 H new ATOM 774 N ASP A 52 16.590 -0.720 -1.263 1.00 0.00 N ATOM 775 CA ASP A 52 17.768 -1.031 -0.514 1.00 0.00 C ATOM 776 C ASP A 52 18.671 0.105 -0.179 1.00 0.00 C ATOM 777 O ASP A 52 19.057 0.936 -1.000 1.00 0.00 O ATOM 778 CB ASP A 52 18.558 -2.055 -1.347 1.00 0.00 C ATOM 779 CG ASP A 52 19.551 -2.774 -0.445 1.00 0.00 C ATOM 780 OD1 ASP A 52 19.140 -3.368 0.587 1.00 0.00 O ATOM 781 OD2 ASP A 52 20.760 -2.786 -0.800 1.00 0.00 O ATOM 0 H ASP A 52 16.529 -1.255 -2.129 1.00 0.00 H new ATOM 0 HA ASP A 52 17.426 -1.394 0.455 1.00 0.00 H new ATOM 0 HB2 ASP A 52 17.877 -2.773 -1.804 1.00 0.00 H new ATOM 0 HB3 ASP A 52 19.084 -1.553 -2.159 1.00 0.00 H new ATOM 786 N ALA A 53 18.961 0.205 1.131 1.00 0.00 N ATOM 787 CA ALA A 53 19.813 1.275 1.548 1.00 0.00 C ATOM 788 C ALA A 53 21.220 0.782 1.560 1.00 0.00 C ATOM 789 O ALA A 53 22.090 1.145 0.769 1.00 0.00 O ATOM 790 CB ALA A 53 19.471 1.792 2.955 1.00 0.00 C ATOM 0 H ALA A 53 18.627 -0.418 1.867 1.00 0.00 H new ATOM 0 HA ALA A 53 19.674 2.099 0.848 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.149 2.603 3.219 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.445 2.158 2.968 1.00 0.00 H new ATOM 0 HB3 ALA A 53 19.576 0.981 3.676 1.00 0.00 H new ATOM 796 N ASP A 54 21.521 -0.052 2.570 1.00 0.00 N ATOM 797 CA ASP A 54 22.764 -0.707 2.836 1.00 0.00 C ATOM 798 C ASP A 54 23.660 -1.203 1.754 1.00 0.00 C ATOM 799 O ASP A 54 24.783 -0.768 1.505 1.00 0.00 O ATOM 800 CB ASP A 54 22.632 -1.653 4.042 1.00 0.00 C ATOM 801 CG ASP A 54 21.541 -2.690 3.817 1.00 0.00 C ATOM 802 OD1 ASP A 54 21.430 -3.205 2.672 1.00 0.00 O ATOM 803 OD2 ASP A 54 20.641 -2.925 4.667 1.00 0.00 O ATOM 0 H ASP A 54 20.820 -0.291 3.271 1.00 0.00 H new ATOM 0 HA ASP A 54 23.388 0.157 3.063 1.00 0.00 H new ATOM 0 HB2 ASP A 54 23.583 -2.156 4.218 1.00 0.00 H new ATOM 0 HB3 ASP A 54 22.407 -1.074 4.938 1.00 0.00 H new ATOM 808 N GLY A 55 23.322 -2.247 0.976 1.00 0.00 N ATOM 809 CA GLY A 55 24.088 -2.783 -0.106 1.00 0.00 C ATOM 810 C GLY A 55 23.996 -4.267 -0.204 1.00 0.00 C ATOM 811 O GLY A 55 24.715 -4.844 -1.018 1.00 0.00 O ATOM 0 H GLY A 55 22.447 -2.753 1.115 1.00 0.00 H new ATOM 0 HA2 GLY A 55 23.745 -2.340 -1.041 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.132 -2.496 0.018 1.00 0.00 H new ATOM 815 N ASN A 56 23.203 -5.035 0.566 1.00 0.00 N ATOM 816 CA ASN A 56 23.043 -6.454 0.509 1.00 0.00 C ATOM 817 C ASN A 56 22.111 -6.783 -0.607 1.00 0.00 C ATOM 818 O ASN A 56 22.135 -7.875 -1.171 1.00 0.00 O ATOM 819 CB ASN A 56 22.710 -7.081 1.873 1.00 0.00 C ATOM 820 CG ASN A 56 21.545 -6.456 2.628 1.00 0.00 C ATOM 821 OD1 ASN A 56 20.677 -5.740 2.131 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.492 -6.543 3.984 1.00 0.00 N ATOM 0 H ASN A 56 22.622 -4.621 1.295 1.00 0.00 H new ATOM 0 HA ASN A 56 23.996 -6.930 0.276 1.00 0.00 H new ATOM 0 HB2 ASN A 56 22.493 -8.138 1.721 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.598 -7.025 2.503 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.772 -6.037 4.500 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.172 -7.115 4.485 1.00 0.00 H new ATOM 829 N GLY A 57 21.095 -5.926 -0.815 1.00 0.00 N ATOM 830 CA GLY A 57 19.987 -6.111 -1.700 1.00 0.00 C ATOM 831 C GLY A 57 19.055 -7.166 -1.213 1.00 0.00 C ATOM 832 O GLY A 57 18.506 -7.925 -2.009 1.00 0.00 O ATOM 0 H GLY A 57 21.046 -5.033 -0.324 1.00 0.00 H new ATOM 0 HA2 GLY A 57 19.447 -5.170 -1.806 1.00 0.00 H new ATOM 0 HA3 GLY A 57 20.355 -6.381 -2.690 1.00 0.00 H new ATOM 836 N THR A 58 18.806 -7.217 0.108 1.00 0.00 N ATOM 837 CA THR A 58 17.687 -7.810 0.772 1.00 0.00 C ATOM 838 C THR A 58 17.067 -6.713 1.568 1.00 0.00 C ATOM 839 O THR A 58 17.746 -5.810 2.055 1.00 0.00 O ATOM 840 CB THR A 58 18.046 -8.962 1.662 1.00 0.00 C ATOM 841 OG1 THR A 58 19.027 -8.668 2.646 1.00 0.00 O ATOM 842 CG2 THR A 58 18.487 -10.155 0.797 1.00 0.00 C ATOM 0 H THR A 58 19.455 -6.800 0.775 1.00 0.00 H new ATOM 0 HA THR A 58 17.011 -8.237 0.032 1.00 0.00 H new ATOM 0 HB THR A 58 17.146 -9.206 2.227 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.202 -9.469 3.183 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.749 -10.994 1.441 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.671 -10.446 0.135 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.354 -9.871 0.201 1.00 0.00 H new ATOM 850 N ILE A 59 15.726 -6.684 1.663 1.00 0.00 N ATOM 851 CA ILE A 59 14.945 -5.606 2.187 1.00 0.00 C ATOM 852 C ILE A 59 14.755 -5.752 3.657 1.00 0.00 C ATOM 853 O ILE A 59 14.128 -6.696 4.136 1.00 0.00 O ATOM 854 CB ILE A 59 13.602 -5.332 1.578 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.518 -5.807 0.118 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.412 -3.815 1.741 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.057 -5.617 -0.289 1.00 0.00 C ATOM 0 H ILE A 59 15.149 -7.466 1.353 1.00 0.00 H new ATOM 0 HA ILE A 59 15.557 -4.747 1.911 1.00 0.00 H new ATOM 0 HB ILE A 59 12.800 -5.885 2.067 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.183 -5.227 -0.522 1.00 0.00 H new ATOM 0 HG13 ILE A 59 13.818 -6.851 0.027 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.450 -3.522 1.321 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.440 -3.556 2.800 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.211 -3.290 1.218 1.00 0.00 H new ATOM 0 HD11 ILE A 59 11.923 -5.936 -1.322 1.00 0.00 H new ATOM 0 HD12 ILE A 59 11.418 -6.214 0.361 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.787 -4.565 -0.196 1.00 0.00 H new ATOM 869 N ASP A 60 15.283 -4.784 4.427 1.00 0.00 N ATOM 870 CA ASP A 60 15.335 -4.765 5.856 1.00 0.00 C ATOM 871 C ASP A 60 14.133 -4.005 6.302 1.00 0.00 C ATOM 872 O ASP A 60 13.425 -3.314 5.570 1.00 0.00 O ATOM 873 CB ASP A 60 16.629 -4.061 6.297 1.00 0.00 C ATOM 874 CG ASP A 60 17.819 -4.977 6.046 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.393 -4.914 4.926 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.322 -5.689 6.955 1.00 0.00 O ATOM 0 H ASP A 60 15.706 -3.951 4.018 1.00 0.00 H new ATOM 0 HA ASP A 60 15.336 -5.765 6.289 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.753 -3.128 5.747 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.572 -3.803 7.354 1.00 0.00 H new ATOM 881 N PHE A 61 13.864 -4.003 7.620 1.00 0.00 N ATOM 882 CA PHE A 61 12.761 -3.423 8.321 1.00 0.00 C ATOM 883 C PHE A 61 12.682 -1.945 8.151 1.00 0.00 C ATOM 884 O PHE A 61 11.629 -1.580 7.631 1.00 0.00 O ATOM 885 CB PHE A 61 12.686 -3.885 9.786 1.00 0.00 C ATOM 886 CG PHE A 61 11.464 -3.558 10.574 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.227 -4.005 10.175 1.00 0.00 C ATOM 888 CD2 PHE A 61 11.541 -2.671 11.622 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.111 -3.566 10.848 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.463 -2.324 12.402 1.00 0.00 C ATOM 891 CZ PHE A 61 9.237 -2.751 11.948 1.00 0.00 C ATOM 0 H PHE A 61 14.500 -4.466 8.269 1.00 0.00 H new ATOM 0 HA PHE A 61 11.857 -3.809 7.851 1.00 0.00 H new ATOM 0 HB2 PHE A 61 12.808 -4.968 9.799 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.542 -3.461 10.311 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.133 -4.690 9.346 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.498 -2.223 11.844 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.129 -3.863 10.510 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.572 -1.753 13.312 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.346 -2.437 12.471 1.00 0.00 H new ATOM 901 N PRO A 62 13.618 -1.111 8.497 1.00 0.00 N ATOM 902 CA PRO A 62 13.506 0.277 8.152 1.00 0.00 C ATOM 903 C PRO A 62 13.523 0.658 6.711 1.00 0.00 C ATOM 904 O PRO A 62 13.072 1.787 6.523 1.00 0.00 O ATOM 905 CB PRO A 62 14.677 0.914 8.896 1.00 0.00 C ATOM 906 CG PRO A 62 15.755 -0.166 8.711 1.00 0.00 C ATOM 907 CD PRO A 62 14.922 -1.406 9.070 1.00 0.00 C ATOM 0 HA PRO A 62 12.509 0.620 8.430 1.00 0.00 H new ATOM 0 HB2 PRO A 62 14.971 1.870 8.463 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.450 1.096 9.946 1.00 0.00 H new ATOM 0 HG2 PRO A 62 16.145 -0.201 7.694 1.00 0.00 H new ATOM 0 HG3 PRO A 62 16.608 -0.026 9.374 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.351 -2.315 8.647 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.864 -1.553 10.148 1.00 0.00 H new ATOM 915 N GLU A 63 13.967 -0.236 5.811 1.00 0.00 N ATOM 916 CA GLU A 63 14.016 0.136 4.431 1.00 0.00 C ATOM 917 C GLU A 63 12.707 0.009 3.730 1.00 0.00 C ATOM 918 O GLU A 63 12.250 0.917 3.037 1.00 0.00 O ATOM 919 CB GLU A 63 14.936 -0.844 3.684 1.00 0.00 C ATOM 920 CG GLU A 63 16.376 -0.768 4.194 1.00 0.00 C ATOM 921 CD GLU A 63 17.266 -1.778 3.483 1.00 0.00 C ATOM 922 OE1 GLU A 63 16.826 -2.912 3.156 1.00 0.00 O ATOM 923 OE2 GLU A 63 18.404 -1.344 3.164 1.00 0.00 O ATOM 0 H GLU A 63 14.282 -1.182 6.025 1.00 0.00 H new ATOM 0 HA GLU A 63 14.348 1.174 4.422 1.00 0.00 H new ATOM 0 HB2 GLU A 63 14.560 -1.860 3.805 1.00 0.00 H new ATOM 0 HB3 GLU A 63 14.915 -0.621 2.617 1.00 0.00 H new ATOM 0 HG2 GLU A 63 16.767 0.238 4.039 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.395 -0.955 5.268 1.00 0.00 H new ATOM 930 N PHE A 64 11.976 -1.083 4.017 1.00 0.00 N ATOM 931 CA PHE A 64 10.617 -1.328 3.647 1.00 0.00 C ATOM 932 C PHE A 64 9.741 -0.316 4.302 1.00 0.00 C ATOM 933 O PHE A 64 8.856 0.196 3.619 1.00 0.00 O ATOM 934 CB PHE A 64 10.217 -2.757 4.053 1.00 0.00 C ATOM 935 CG PHE A 64 9.201 -3.423 3.190 1.00 0.00 C ATOM 936 CD1 PHE A 64 9.302 -3.327 1.823 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.185 -4.170 3.738 1.00 0.00 C ATOM 938 CE1 PHE A 64 8.351 -3.901 1.013 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.260 -4.799 2.937 1.00 0.00 C ATOM 940 CZ PHE A 64 7.348 -4.658 1.572 1.00 0.00 C ATOM 0 H PHE A 64 12.370 -1.857 4.552 1.00 0.00 H new ATOM 0 HA PHE A 64 10.502 -1.240 2.567 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.115 -3.375 4.065 1.00 0.00 H new ATOM 0 HB3 PHE A 64 9.836 -2.730 5.074 1.00 0.00 H new ATOM 0 HD1 PHE A 64 10.134 -2.797 1.382 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.112 -4.264 4.811 1.00 0.00 H new ATOM 0 HE1 PHE A 64 8.391 -3.758 -0.057 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.474 -5.396 3.375 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.625 -5.145 0.935 1.00 0.00 H new ATOM 950 N LEU A 65 10.007 0.102 5.553 1.00 0.00 N ATOM 951 CA LEU A 65 9.206 1.160 6.084 1.00 0.00 C ATOM 952 C LEU A 65 9.462 2.544 5.597 1.00 0.00 C ATOM 953 O LEU A 65 8.533 3.327 5.405 1.00 0.00 O ATOM 954 CB LEU A 65 9.378 1.023 7.606 1.00 0.00 C ATOM 955 CG LEU A 65 8.520 1.925 8.510 1.00 0.00 C ATOM 956 CD1 LEU A 65 7.072 1.406 8.503 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.143 2.009 9.913 1.00 0.00 C ATOM 0 H LEU A 65 10.733 -0.267 6.167 1.00 0.00 H new ATOM 0 HA LEU A 65 8.182 1.039 5.731 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.172 -0.013 7.874 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.425 1.211 7.843 1.00 0.00 H new ATOM 0 HG LEU A 65 8.495 2.947 8.133 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.456 2.039 9.141 1.00 0.00 H new ATOM 0 HD12 LEU A 65 6.683 1.428 7.485 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.050 0.383 8.878 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.529 2.650 10.546 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.195 1.011 10.348 1.00 0.00 H new ATOM 0 HD23 LEU A 65 10.147 2.426 9.841 1.00 0.00 H new ATOM 969 N THR A 66 10.749 2.893 5.418 1.00 0.00 N ATOM 970 CA THR A 66 11.096 4.171 4.879 1.00 0.00 C ATOM 971 C THR A 66 10.615 4.433 3.493 1.00 0.00 C ATOM 972 O THR A 66 10.470 5.566 3.036 1.00 0.00 O ATOM 973 CB THR A 66 12.539 4.554 5.023 1.00 0.00 C ATOM 974 OG1 THR A 66 12.967 4.373 6.366 1.00 0.00 O ATOM 975 CG2 THR A 66 12.934 5.981 4.610 1.00 0.00 C ATOM 0 H THR A 66 11.544 2.295 5.645 1.00 0.00 H new ATOM 0 HA THR A 66 10.528 4.833 5.533 1.00 0.00 H new ATOM 0 HB THR A 66 13.032 3.888 4.315 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.378 3.488 6.462 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.004 6.122 4.766 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.697 6.134 3.557 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.382 6.701 5.214 1.00 0.00 H new ATOM 983 N MET A 67 10.333 3.394 2.687 1.00 0.00 N ATOM 984 CA MET A 67 9.747 3.474 1.385 1.00 0.00 C ATOM 985 C MET A 67 8.345 3.974 1.462 1.00 0.00 C ATOM 986 O MET A 67 7.824 4.777 0.690 1.00 0.00 O ATOM 987 CB MET A 67 9.869 2.057 0.799 1.00 0.00 C ATOM 988 CG MET A 67 9.093 1.774 -0.489 1.00 0.00 C ATOM 989 SD MET A 67 9.132 0.057 -1.085 1.00 0.00 S ATOM 990 CE MET A 67 7.785 -0.538 -0.023 1.00 0.00 C ATOM 0 H MET A 67 10.528 2.432 2.965 1.00 0.00 H new ATOM 0 HA MET A 67 10.251 4.190 0.736 1.00 0.00 H new ATOM 0 HB2 MET A 67 10.924 1.857 0.611 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.540 1.346 1.557 1.00 0.00 H new ATOM 0 HG2 MET A 67 8.053 2.059 -0.333 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.486 2.419 -1.275 1.00 0.00 H new ATOM 0 HE1 MET A 67 7.821 -1.626 0.035 1.00 0.00 H new ATOM 0 HE2 MET A 67 7.897 -0.117 0.976 1.00 0.00 H new ATOM 0 HE3 MET A 67 6.828 -0.229 -0.442 1.00 0.00 H new ATOM 1000 N MET A 68 7.548 3.479 2.426 1.00 0.00 N ATOM 1001 CA MET A 68 6.166 3.740 2.682 1.00 0.00 C ATOM 1002 C MET A 68 5.957 4.973 3.491 1.00 0.00 C ATOM 1003 O MET A 68 5.098 5.748 3.072 1.00 0.00 O ATOM 1004 CB MET A 68 5.429 2.576 3.367 1.00 0.00 C ATOM 1005 CG MET A 68 5.543 1.224 2.659 1.00 0.00 C ATOM 1006 SD MET A 68 5.005 1.309 0.924 1.00 0.00 S ATOM 1007 CE MET A 68 3.360 2.068 1.043 1.00 0.00 C ATOM 0 H MET A 68 7.922 2.816 3.105 1.00 0.00 H new ATOM 0 HA MET A 68 5.739 3.877 1.688 1.00 0.00 H new ATOM 0 HB2 MET A 68 5.814 2.470 4.381 1.00 0.00 H new ATOM 0 HB3 MET A 68 4.374 2.835 3.452 1.00 0.00 H new ATOM 0 HG2 MET A 68 6.576 0.880 2.701 1.00 0.00 H new ATOM 0 HG3 MET A 68 4.940 0.486 3.189 1.00 0.00 H new ATOM 0 HE1 MET A 68 2.956 2.219 0.042 1.00 0.00 H new ATOM 0 HE2 MET A 68 2.697 1.412 1.607 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.439 3.029 1.551 1.00 0.00 H new ATOM 1017 N ALA A 69 6.748 5.281 4.535 1.00 0.00 N ATOM 1018 CA ALA A 69 6.483 6.402 5.382 1.00 0.00 C ATOM 1019 C ALA A 69 6.842 7.665 4.676 1.00 0.00 C ATOM 1020 O ALA A 69 6.230 8.678 5.011 1.00 0.00 O ATOM 1021 CB ALA A 69 7.399 6.332 6.616 1.00 0.00 C ATOM 0 H ALA A 69 7.578 4.748 4.794 1.00 0.00 H new ATOM 0 HA ALA A 69 5.428 6.384 5.655 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.201 7.185 7.265 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.205 5.408 7.161 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.441 6.353 6.297 1.00 0.00 H new ATOM 1027 N ARG A 70 7.810 7.662 3.743 1.00 0.00 N ATOM 1028 CA ARG A 70 8.165 8.855 3.039 1.00 0.00 C ATOM 1029 C ARG A 70 7.065 9.311 2.144 1.00 0.00 C ATOM 1030 O ARG A 70 6.130 8.595 1.788 1.00 0.00 O ATOM 1031 CB ARG A 70 9.425 8.681 2.174 1.00 0.00 C ATOM 1032 CG ARG A 70 9.329 7.834 0.904 1.00 0.00 C ATOM 1033 CD ARG A 70 10.746 7.487 0.445 1.00 0.00 C ATOM 1034 NE ARG A 70 11.242 8.591 -0.424 1.00 0.00 N ATOM 1035 CZ ARG A 70 12.175 8.397 -1.402 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.847 7.213 -1.497 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.507 9.422 -2.240 1.00 0.00 N ATOM 0 H ARG A 70 8.346 6.836 3.476 1.00 0.00 H new ATOM 0 HA ARG A 70 8.359 9.596 3.814 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.768 9.674 1.884 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.202 8.247 2.804 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.760 6.925 1.097 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.801 8.381 0.123 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.402 7.358 1.305 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.747 6.544 -0.102 1.00 0.00 H new ATOM 0 HE ARG A 70 10.869 9.530 -0.283 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.654 6.463 -0.834 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.542 7.079 -2.231 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.058 10.332 -2.135 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.204 9.278 -2.971 1.00 0.00 H new ATOM 1051 N LYS A 71 7.084 10.601 1.765 1.00 0.00 N ATOM 1052 CA LYS A 71 6.115 11.248 0.936 1.00 0.00 C ATOM 1053 C LYS A 71 6.526 11.340 -0.493 1.00 0.00 C ATOM 1054 O LYS A 71 7.675 11.719 -0.713 1.00 0.00 O ATOM 1055 CB LYS A 71 5.920 12.687 1.444 1.00 0.00 C ATOM 1056 CG LYS A 71 4.619 13.428 1.131 1.00 0.00 C ATOM 1057 CD LYS A 71 3.372 12.711 1.652 1.00 0.00 C ATOM 1058 CE LYS A 71 3.030 13.004 3.114 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.883 12.212 3.612 1.00 0.00 N ATOM 0 H LYS A 71 7.828 11.235 2.058 1.00 0.00 H new ATOM 0 HA LYS A 71 5.206 10.649 0.990 1.00 0.00 H new ATOM 0 HB2 LYS A 71 6.032 12.668 2.528 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.740 13.286 1.049 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.664 14.426 1.567 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.532 13.555 0.052 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.522 12.992 1.031 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.511 11.636 1.534 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.903 12.797 3.733 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.806 14.065 3.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.700 12.454 4.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.040 12.426 3.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.103 11.198 3.537 1.00 0.00 H new ATOM 1073 N MET A 72 5.639 10.976 -1.435 1.00 0.00 N ATOM 1074 CA MET A 72 5.928 11.157 -2.824 1.00 0.00 C ATOM 1075 C MET A 72 5.057 12.191 -3.451 1.00 0.00 C ATOM 1076 O MET A 72 4.149 12.700 -2.796 1.00 0.00 O ATOM 1077 CB MET A 72 5.786 9.832 -3.591 1.00 0.00 C ATOM 1078 CG MET A 72 6.540 8.626 -3.028 1.00 0.00 C ATOM 1079 SD MET A 72 8.324 8.954 -2.906 1.00 0.00 S ATOM 1080 CE MET A 72 8.692 7.207 -3.239 1.00 0.00 C ATOM 0 H MET A 72 4.729 10.560 -1.238 1.00 0.00 H new ATOM 0 HA MET A 72 6.960 11.503 -2.885 1.00 0.00 H new ATOM 0 HB2 MET A 72 4.727 9.579 -3.639 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.121 9.995 -4.615 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.146 8.377 -2.042 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.371 7.759 -3.667 1.00 0.00 H new ATOM 0 HE1 MET A 72 9.757 7.026 -3.095 1.00 0.00 H new ATOM 0 HE2 MET A 72 8.121 6.578 -2.556 1.00 0.00 H new ATOM 0 HE3 MET A 72 8.419 6.967 -4.267 1.00 0.00 H new ATOM 1090 N LYS A 73 5.197 12.462 -4.761 1.00 0.00 N ATOM 1091 CA LYS A 73 4.406 13.470 -5.398 1.00 0.00 C ATOM 1092 C LYS A 73 3.059 12.946 -5.759 1.00 0.00 C ATOM 1093 O LYS A 73 2.557 11.894 -5.367 1.00 0.00 O ATOM 1094 CB LYS A 73 5.208 14.282 -6.429 1.00 0.00 C ATOM 1095 CG LYS A 73 5.675 13.337 -7.538 1.00 0.00 C ATOM 1096 CD LYS A 73 6.647 13.984 -8.526 1.00 0.00 C ATOM 1097 CE LYS A 73 7.044 13.137 -9.737 1.00 0.00 C ATOM 1098 NZ LYS A 73 7.444 11.769 -9.339 1.00 0.00 N ATOM 0 H LYS A 73 5.855 11.985 -5.378 1.00 0.00 H new ATOM 0 HA LYS A 73 4.151 14.264 -4.696 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.592 15.079 -6.845 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.065 14.758 -5.952 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.154 12.469 -7.086 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.805 12.973 -8.084 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.202 14.911 -8.888 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.554 14.256 -7.986 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.208 13.084 -10.434 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.868 13.619 -10.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 7.911 11.297 -10.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.102 11.820 -8.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.600 11.227 -9.062 1.00 0.00 H new ATOM 1112 N ASP A 74 2.266 13.746 -6.494 1.00 0.00 N ATOM 1113 CA ASP A 74 0.886 13.432 -6.696 1.00 0.00 C ATOM 1114 C ASP A 74 0.644 12.370 -7.713 1.00 0.00 C ATOM 1115 O ASP A 74 -0.370 11.675 -7.715 1.00 0.00 O ATOM 1116 CB ASP A 74 0.269 14.796 -7.048 1.00 0.00 C ATOM 1117 CG ASP A 74 1.015 15.620 -8.088 1.00 0.00 C ATOM 1118 OD1 ASP A 74 2.156 16.054 -7.777 1.00 0.00 O ATOM 1119 OD2 ASP A 74 0.417 15.955 -9.145 1.00 0.00 O ATOM 0 H ASP A 74 2.578 14.605 -6.946 1.00 0.00 H new ATOM 0 HA ASP A 74 0.427 12.982 -5.816 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.747 14.631 -7.406 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.193 15.385 -6.134 1.00 0.00 H new ATOM 1124 N THR A 75 1.589 12.210 -8.656 1.00 0.00 N ATOM 1125 CA THR A 75 1.528 11.297 -9.756 1.00 0.00 C ATOM 1126 C THR A 75 1.721 9.916 -9.232 1.00 0.00 C ATOM 1127 O THR A 75 0.937 9.003 -9.487 1.00 0.00 O ATOM 1128 CB THR A 75 2.534 11.573 -10.833 1.00 0.00 C ATOM 1129 OG1 THR A 75 3.889 11.660 -10.418 1.00 0.00 O ATOM 1130 CG2 THR A 75 2.226 12.907 -11.535 1.00 0.00 C ATOM 0 H THR A 75 2.452 12.754 -8.650 1.00 0.00 H new ATOM 0 HA THR A 75 0.550 11.419 -10.222 1.00 0.00 H new ATOM 0 HB THR A 75 2.437 10.702 -11.481 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.458 11.840 -11.195 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.968 13.088 -12.313 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.234 12.862 -11.983 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.258 13.717 -10.807 1.00 0.00 H new ATOM 1138 N ASP A 76 2.714 9.734 -8.343 1.00 0.00 N ATOM 1139 CA ASP A 76 3.161 8.548 -7.681 1.00 0.00 C ATOM 1140 C ASP A 76 2.168 8.097 -6.666 1.00 0.00 C ATOM 1141 O ASP A 76 1.860 6.919 -6.490 1.00 0.00 O ATOM 1142 CB ASP A 76 4.533 8.659 -6.994 1.00 0.00 C ATOM 1143 CG ASP A 76 5.616 9.017 -8.001 1.00 0.00 C ATOM 1144 OD1 ASP A 76 5.530 10.179 -8.480 1.00 0.00 O ATOM 1145 OD2 ASP A 76 6.473 8.112 -8.186 1.00 0.00 O ATOM 0 H ASP A 76 3.278 10.533 -8.052 1.00 0.00 H new ATOM 0 HA ASP A 76 3.267 7.822 -8.487 1.00 0.00 H new ATOM 0 HB2 ASP A 76 4.493 9.417 -6.212 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.779 7.714 -6.509 1.00 0.00 H new ATOM 1150 N SER A 77 1.581 9.123 -6.026 1.00 0.00 N ATOM 1151 CA SER A 77 0.697 8.906 -4.924 1.00 0.00 C ATOM 1152 C SER A 77 -0.643 8.407 -5.343 1.00 0.00 C ATOM 1153 O SER A 77 -1.447 8.145 -4.450 1.00 0.00 O ATOM 1154 CB SER A 77 0.508 10.068 -3.934 1.00 0.00 C ATOM 1155 OG SER A 77 1.730 10.400 -3.292 1.00 0.00 O ATOM 0 H SER A 77 1.718 10.103 -6.272 1.00 0.00 H new ATOM 0 HA SER A 77 1.240 8.137 -4.375 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.123 10.940 -4.462 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.236 9.794 -3.186 1.00 0.00 H new ATOM 0 HG SER A 77 2.301 10.899 -3.913 1.00 0.00 H new ATOM 1161 N GLU A 78 -0.871 8.439 -6.668 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.009 7.985 -7.405 1.00 0.00 C ATOM 1163 C GLU A 78 -1.844 6.611 -7.956 1.00 0.00 C ATOM 1164 O GLU A 78 -2.635 5.721 -7.647 1.00 0.00 O ATOM 1165 CB GLU A 78 -2.331 8.743 -8.704 1.00 0.00 C ATOM 1166 CG GLU A 78 -3.561 8.368 -9.533 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.877 8.570 -8.795 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.999 9.631 -8.127 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -5.787 7.704 -8.897 1.00 0.00 O ATOM 0 H GLU A 78 -0.169 8.832 -7.295 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.774 8.108 -6.638 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -2.425 9.798 -8.447 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -1.462 8.650 -9.356 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -3.570 8.965 -10.445 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.480 7.324 -9.836 1.00 0.00 H new ATOM 1176 N GLU A 79 -0.747 6.421 -8.710 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.508 5.128 -9.272 1.00 0.00 C ATOM 1178 C GLU A 79 -0.215 4.143 -8.192 1.00 0.00 C ATOM 1179 O GLU A 79 -0.572 2.981 -8.383 1.00 0.00 O ATOM 1180 CB GLU A 79 0.699 5.309 -10.208 1.00 0.00 C ATOM 1181 CG GLU A 79 0.326 6.118 -11.452 1.00 0.00 C ATOM 1182 CD GLU A 79 1.520 6.297 -12.378 1.00 0.00 C ATOM 1183 OE1 GLU A 79 2.585 6.887 -12.054 1.00 0.00 O ATOM 1184 OE2 GLU A 79 1.437 5.866 -13.559 1.00 0.00 O ATOM 0 H GLU A 79 -0.049 7.133 -8.925 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.373 4.744 -9.813 1.00 0.00 H new ATOM 0 HB2 GLU A 79 1.504 5.813 -9.673 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.078 4.332 -10.508 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.479 5.614 -11.987 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.053 7.095 -11.152 1.00 0.00 H new ATOM 1191 N GLU A 80 0.300 4.559 -7.022 1.00 0.00 N ATOM 1192 CA GLU A 80 0.330 3.629 -5.936 1.00 0.00 C ATOM 1193 C GLU A 80 -0.901 2.848 -5.627 1.00 0.00 C ATOM 1194 O GLU A 80 -0.910 1.618 -5.609 1.00 0.00 O ATOM 1195 CB GLU A 80 0.845 4.352 -4.680 1.00 0.00 C ATOM 1196 CG GLU A 80 1.128 3.539 -3.416 1.00 0.00 C ATOM 1197 CD GLU A 80 1.618 4.409 -2.267 1.00 0.00 C ATOM 1198 OE1 GLU A 80 2.705 5.042 -2.336 1.00 0.00 O ATOM 1199 OE2 GLU A 80 0.888 4.471 -1.241 1.00 0.00 O ATOM 0 H GLU A 80 0.677 5.487 -6.831 1.00 0.00 H new ATOM 0 HA GLU A 80 1.003 2.845 -6.284 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.766 4.867 -4.952 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.116 5.119 -4.420 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.221 3.017 -3.112 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.876 2.777 -3.637 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.023 3.589 -5.580 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.300 3.135 -5.125 1.00 0.00 C ATOM 1208 C ILE A 81 -3.963 2.374 -6.221 1.00 0.00 C ATOM 1209 O ILE A 81 -4.629 1.372 -5.964 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.135 4.315 -4.725 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.374 5.168 -3.695 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.528 3.904 -4.219 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -2.878 4.447 -2.442 1.00 0.00 C ATOM 0 H ILE A 81 -2.038 4.564 -5.878 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.181 2.483 -4.260 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.312 4.922 -5.613 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.514 5.617 -4.193 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.024 5.985 -3.383 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.092 4.795 -3.942 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -6.058 3.369 -5.007 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.422 3.257 -3.348 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.359 5.155 -1.796 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.727 4.023 -1.906 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.194 3.648 -2.729 1.00 0.00 H new ATOM 1225 N ARG A 82 -3.612 2.691 -7.480 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.061 1.999 -8.648 1.00 0.00 C ATOM 1227 C ARG A 82 -3.431 0.658 -8.805 1.00 0.00 C ATOM 1228 O ARG A 82 -4.050 -0.330 -9.199 1.00 0.00 O ATOM 1229 CB ARG A 82 -3.641 2.922 -9.804 1.00 0.00 C ATOM 1230 CG ARG A 82 -4.024 2.594 -11.249 1.00 0.00 C ATOM 1231 CD ARG A 82 -5.389 3.029 -11.785 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.581 2.522 -13.173 1.00 0.00 N ATOM 1233 CZ ARG A 82 -6.843 2.422 -13.683 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -7.961 3.002 -13.157 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -6.920 1.766 -14.878 1.00 0.00 N ATOM 0 H ARG A 82 -2.985 3.467 -7.693 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.133 1.804 -8.605 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -4.040 3.912 -9.584 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.554 3.002 -9.771 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -3.264 3.033 -11.896 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.957 1.513 -11.367 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.180 2.649 -11.138 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -5.463 4.116 -11.774 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.776 2.252 -13.738 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -7.892 3.567 -12.311 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -8.865 2.870 -13.610 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.074 1.399 -15.314 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -7.824 1.643 -15.335 1.00 0.00 H new ATOM 1249 N GLU A 83 -2.096 0.546 -8.684 1.00 0.00 N ATOM 1250 CA GLU A 83 -1.445 -0.726 -8.743 1.00 0.00 C ATOM 1251 C GLU A 83 -1.782 -1.724 -7.689 1.00 0.00 C ATOM 1252 O GLU A 83 -1.717 -2.915 -7.989 1.00 0.00 O ATOM 1253 CB GLU A 83 0.063 -0.424 -8.706 1.00 0.00 C ATOM 1254 CG GLU A 83 0.633 -0.085 -10.085 1.00 0.00 C ATOM 1255 CD GLU A 83 0.673 -1.217 -11.101 1.00 0.00 C ATOM 1256 OE1 GLU A 83 1.404 -2.204 -10.819 1.00 0.00 O ATOM 1257 OE2 GLU A 83 0.074 -1.127 -12.206 1.00 0.00 O ATOM 0 H GLU A 83 -1.467 1.337 -8.545 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.796 -1.215 -9.651 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.246 0.409 -8.027 1.00 0.00 H new ATOM 0 HB3 GLU A 83 0.592 -1.287 -8.301 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.045 0.730 -10.506 1.00 0.00 H new ATOM 0 HG3 GLU A 83 1.648 0.290 -9.952 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.053 -1.315 -6.437 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.537 -1.891 -5.221 1.00 0.00 C ATOM 1266 C ALA A 84 -3.867 -2.459 -5.578 1.00 0.00 C ATOM 1267 O ALA A 84 -4.176 -3.576 -5.165 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.592 -0.729 -4.214 1.00 0.00 C ATOM 0 H ALA A 84 -1.884 -0.327 -6.248 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.935 -2.684 -4.777 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.956 -1.096 -3.254 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.594 -0.310 -4.088 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.266 0.043 -4.586 1.00 0.00 H new ATOM 1274 N PHE A 85 -4.737 -1.775 -6.343 1.00 0.00 N ATOM 1275 CA PHE A 85 -5.984 -2.198 -6.901 1.00 0.00 C ATOM 1276 C PHE A 85 -5.812 -3.287 -7.904 1.00 0.00 C ATOM 1277 O PHE A 85 -6.541 -4.276 -7.864 1.00 0.00 O ATOM 1278 CB PHE A 85 -6.678 -0.975 -7.523 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.157 -1.125 -7.624 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -8.977 -0.790 -6.572 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -8.802 -1.660 -8.714 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.351 -0.836 -6.617 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.144 -1.960 -8.696 1.00 0.00 C ATOM 1284 CZ PHE A 85 -10.936 -1.488 -7.676 1.00 0.00 C ATOM 0 H PHE A 85 -4.538 -0.808 -6.599 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.603 -2.615 -6.107 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.449 -0.093 -6.925 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.269 -0.801 -8.518 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.512 -0.470 -5.651 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.236 -1.851 -9.614 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -10.950 -0.375 -5.846 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -10.574 -2.564 -9.481 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.006 -1.628 -7.707 1.00 0.00 H new ATOM 1294 N ARG A 86 -4.895 -3.201 -8.883 1.00 0.00 N ATOM 1295 CA ARG A 86 -4.636 -4.129 -9.940 1.00 0.00 C ATOM 1296 C ARG A 86 -4.247 -5.449 -9.370 1.00 0.00 C ATOM 1297 O ARG A 86 -4.462 -6.467 -10.026 1.00 0.00 O ATOM 1298 CB ARG A 86 -3.528 -3.598 -10.865 1.00 0.00 C ATOM 1299 CG ARG A 86 -3.397 -4.352 -12.190 1.00 0.00 C ATOM 1300 CD ARG A 86 -2.506 -3.731 -13.268 1.00 0.00 C ATOM 1301 NE ARG A 86 -1.184 -3.648 -12.584 1.00 0.00 N ATOM 1302 CZ ARG A 86 -0.140 -4.475 -12.882 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -0.391 -5.672 -13.488 1.00 0.00 N ATOM 1304 NH2 ARG A 86 1.150 -4.052 -12.745 1.00 0.00 N ATOM 0 H ARG A 86 -4.271 -2.396 -8.938 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.544 -4.251 -10.530 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.721 -2.546 -11.077 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.576 -3.647 -10.337 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.017 -5.351 -11.973 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.396 -4.475 -12.608 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.461 -4.350 -14.164 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.866 -2.749 -13.576 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.054 -2.941 -11.860 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.350 -5.939 -13.713 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.380 -6.300 -13.716 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.344 -3.106 -12.416 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.920 -4.682 -12.972 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.620 -5.563 -8.186 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.264 -6.754 -7.480 1.00 0.00 C ATOM 1320 C VAL A 87 -4.425 -7.657 -7.242 1.00 0.00 C ATOM 1321 O VAL A 87 -4.441 -8.828 -7.619 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.335 -6.580 -6.315 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -1.831 -7.902 -5.711 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.188 -5.635 -6.712 1.00 0.00 C ATOM 0 H VAL A 87 -3.333 -4.730 -7.671 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.621 -7.293 -8.176 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.907 -6.125 -5.506 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.165 -7.689 -4.874 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.680 -8.488 -5.359 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.290 -8.466 -6.471 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.512 -5.508 -5.866 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.641 -6.060 -7.553 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.597 -4.666 -6.998 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.480 -7.124 -6.600 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.785 -7.688 -6.444 1.00 0.00 C ATOM 1336 C PHE A 88 -7.576 -7.927 -7.684 1.00 0.00 C ATOM 1337 O PHE A 88 -7.908 -9.090 -7.907 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.520 -6.611 -5.627 1.00 0.00 C ATOM 1339 CG PHE A 88 -6.983 -6.486 -4.242 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.351 -7.376 -3.261 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.199 -5.408 -3.904 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.040 -7.061 -1.959 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.890 -5.062 -2.610 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.327 -5.929 -1.637 1.00 0.00 C ATOM 0 H PHE A 88 -5.410 -6.212 -6.148 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.683 -8.682 -6.008 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.434 -5.651 -6.136 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.582 -6.854 -5.582 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.867 -8.293 -3.505 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -5.803 -4.797 -4.702 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -7.364 -7.720 -1.167 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.338 -4.165 -2.373 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.107 -5.718 -0.601 1.00 0.00 H new ATOM 1354 N ASP A 89 -7.893 -6.909 -8.503 1.00 0.00 N ATOM 1355 CA ASP A 89 -8.772 -6.967 -9.630 1.00 0.00 C ATOM 1356 C ASP A 89 -8.147 -7.802 -10.694 1.00 0.00 C ATOM 1357 O ASP A 89 -6.995 -7.526 -11.026 1.00 0.00 O ATOM 1358 CB ASP A 89 -9.225 -5.628 -10.235 1.00 0.00 C ATOM 1359 CG ASP A 89 -10.402 -5.696 -11.197 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -10.956 -6.800 -11.446 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -10.771 -4.607 -11.712 1.00 0.00 O ATOM 0 H ASP A 89 -7.505 -5.976 -8.366 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.689 -7.402 -9.233 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.486 -4.953 -9.420 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.379 -5.183 -10.758 1.00 0.00 H new ATOM 1366 N LYS A 90 -8.747 -8.954 -11.042 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.168 -9.940 -11.901 1.00 0.00 C ATOM 1368 C LYS A 90 -8.645 -9.671 -13.287 1.00 0.00 C ATOM 1369 O LYS A 90 -7.857 -9.495 -14.214 1.00 0.00 O ATOM 1370 CB LYS A 90 -8.578 -11.335 -11.399 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.376 -12.536 -12.325 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.244 -13.797 -11.468 1.00 0.00 C ATOM 1373 CE LYS A 90 -6.866 -13.937 -10.820 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.840 -15.021 -9.813 1.00 0.00 N ATOM 0 H LYS A 90 -9.677 -9.210 -10.710 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.079 -9.899 -11.898 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.027 -11.530 -10.479 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.635 -11.294 -11.136 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.218 -12.631 -13.010 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.483 -12.398 -12.935 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.006 -13.782 -10.689 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.439 -14.673 -12.087 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -6.121 -14.138 -11.590 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -6.589 -12.995 -10.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.873 -15.130 -9.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.483 -14.784 -9.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -7.145 -15.912 -10.254 1.00 0.00 H new ATOM 1388 N ASP A 91 -9.968 -9.787 -13.502 1.00 0.00 N ATOM 1389 CA ASP A 91 -10.632 -9.428 -14.717 1.00 0.00 C ATOM 1390 C ASP A 91 -10.406 -8.051 -15.239 1.00 0.00 C ATOM 1391 O ASP A 91 -10.167 -7.869 -16.431 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.115 -9.822 -14.610 1.00 0.00 C ATOM 1393 CG ASP A 91 -12.700 -9.303 -13.304 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -12.468 -9.898 -12.218 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -13.299 -8.194 -13.320 1.00 0.00 O ATOM 0 H ASP A 91 -10.606 -10.149 -12.793 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.149 -10.006 -15.505 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.670 -9.413 -15.454 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.216 -10.906 -14.657 1.00 0.00 H new ATOM 1400 N GLY A 92 -10.495 -7.048 -14.347 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.035 -5.738 -14.691 1.00 0.00 C ATOM 1402 C GLY A 92 -11.208 -4.895 -15.056 1.00 0.00 C ATOM 1403 O GLY A 92 -10.995 -3.988 -15.859 1.00 0.00 O ATOM 0 H GLY A 92 -10.877 -7.140 -13.406 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.499 -5.295 -13.852 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.335 -5.791 -15.525 1.00 0.00 H new ATOM 1407 N ASN A 93 -12.433 -5.080 -14.530 1.00 0.00 N ATOM 1408 CA ASN A 93 -13.545 -4.192 -14.666 1.00 0.00 C ATOM 1409 C ASN A 93 -13.532 -2.922 -13.886 1.00 0.00 C ATOM 1410 O ASN A 93 -14.223 -1.962 -14.223 1.00 0.00 O ATOM 1411 CB ASN A 93 -14.898 -4.882 -14.420 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.072 -5.504 -13.041 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -14.180 -5.651 -12.207 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -16.347 -5.836 -12.705 1.00 0.00 N ATOM 0 H ASN A 93 -12.660 -5.904 -13.974 1.00 0.00 H new ATOM 0 HA ASN A 93 -13.421 -3.900 -15.709 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -15.692 -4.152 -14.574 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.031 -5.661 -15.171 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -16.551 -6.200 -11.774 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.100 -5.721 -13.384 1.00 0.00 H new ATOM 1421 N GLY A 94 -12.743 -2.899 -12.797 1.00 0.00 N ATOM 1422 CA GLY A 94 -12.784 -1.783 -11.904 1.00 0.00 C ATOM 1423 C GLY A 94 -13.408 -2.094 -10.588 1.00 0.00 C ATOM 1424 O GLY A 94 -13.369 -1.221 -9.722 1.00 0.00 O ATOM 0 H GLY A 94 -12.089 -3.637 -12.538 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.768 -1.423 -11.739 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -13.337 -0.971 -12.376 1.00 0.00 H new ATOM 1428 N TYR A 95 -13.906 -3.326 -10.378 1.00 0.00 N ATOM 1429 CA TYR A 95 -14.528 -3.786 -9.176 1.00 0.00 C ATOM 1430 C TYR A 95 -13.803 -4.965 -8.626 1.00 0.00 C ATOM 1431 O TYR A 95 -13.441 -5.925 -9.304 1.00 0.00 O ATOM 1432 CB TYR A 95 -15.996 -4.191 -9.395 1.00 0.00 C ATOM 1433 CG TYR A 95 -16.814 -2.962 -9.598 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.057 -2.382 -10.821 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -17.468 -2.367 -8.546 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -17.795 -1.237 -11.009 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.351 -1.328 -8.723 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.384 -0.646 -9.916 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.120 0.558 -9.924 1.00 0.00 O ATOM 0 H TYR A 95 -13.871 -4.048 -11.097 1.00 0.00 H new ATOM 0 HA TYR A 95 -14.491 -2.951 -8.477 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -16.080 -4.847 -10.262 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -16.364 -4.751 -8.535 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -16.639 -2.859 -11.695 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.282 -2.728 -7.545 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -17.910 -0.811 -11.995 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.020 -1.047 -7.923 1.00 0.00 H new ATOM 0 HH TYR A 95 -19.432 0.757 -9.016 1.00 0.00 H new ATOM 1449 N ILE A 96 -13.507 -4.968 -7.314 1.00 0.00 N ATOM 1450 CA ILE A 96 -12.935 -5.988 -6.491 1.00 0.00 C ATOM 1451 C ILE A 96 -14.004 -6.736 -5.772 1.00 0.00 C ATOM 1452 O ILE A 96 -14.562 -6.196 -4.817 1.00 0.00 O ATOM 1453 CB ILE A 96 -11.870 -5.539 -5.535 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -10.949 -4.487 -6.175 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.084 -6.809 -5.168 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -9.862 -3.906 -5.272 1.00 0.00 C ATOM 0 H ILE A 96 -13.698 -4.135 -6.758 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.413 -6.642 -7.189 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.302 -5.063 -4.655 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.469 -4.935 -7.045 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.567 -3.666 -6.539 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.287 -6.554 -4.470 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.756 -7.531 -4.704 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -10.652 -7.243 -6.070 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.276 -3.176 -5.831 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.324 -3.419 -4.413 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.209 -4.708 -4.927 1.00 0.00 H new ATOM 1468 N SER A 97 -14.324 -7.964 -6.217 1.00 0.00 N ATOM 1469 CA SER A 97 -15.178 -8.973 -5.672 1.00 0.00 C ATOM 1470 C SER A 97 -14.470 -9.681 -4.569 1.00 0.00 C ATOM 1471 O SER A 97 -13.280 -9.686 -4.256 1.00 0.00 O ATOM 1472 CB SER A 97 -15.779 -9.950 -6.697 1.00 0.00 C ATOM 1473 OG SER A 97 -14.857 -10.776 -7.394 1.00 0.00 O ATOM 0 H SER A 97 -13.918 -8.292 -7.093 1.00 0.00 H new ATOM 0 HA SER A 97 -16.052 -8.454 -5.278 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.491 -10.593 -6.180 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.343 -9.373 -7.430 1.00 0.00 H new ATOM 0 HG SER A 97 -14.197 -10.215 -7.852 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.310 -10.404 -3.807 1.00 0.00 N ATOM 1480 CA ALA A 98 -14.838 -11.067 -2.631 1.00 0.00 C ATOM 1481 C ALA A 98 -13.875 -12.198 -2.747 1.00 0.00 C ATOM 1482 O ALA A 98 -13.014 -12.428 -1.899 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.048 -11.572 -1.826 1.00 0.00 C ATOM 0 H ALA A 98 -16.304 -10.529 -4.001 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.247 -10.283 -2.157 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.700 -12.080 -0.926 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.677 -10.727 -1.546 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.625 -12.268 -2.435 1.00 0.00 H new ATOM 1489 N ALA A 99 -13.907 -12.808 -3.946 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.035 -13.832 -4.430 1.00 0.00 C ATOM 1491 C ALA A 99 -11.641 -13.336 -4.604 1.00 0.00 C ATOM 1492 O ALA A 99 -10.597 -13.841 -4.194 1.00 0.00 O ATOM 1493 CB ALA A 99 -13.598 -14.581 -5.650 1.00 0.00 C ATOM 0 H ALA A 99 -14.611 -12.558 -4.640 1.00 0.00 H new ATOM 0 HA ALA A 99 -12.980 -14.596 -3.654 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -12.888 -15.345 -5.968 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -14.543 -15.053 -5.383 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -13.762 -13.877 -6.465 1.00 0.00 H new ATOM 1499 N GLU A 100 -11.567 -12.171 -5.273 1.00 0.00 N ATOM 1500 CA GLU A 100 -10.439 -11.356 -5.600 1.00 0.00 C ATOM 1501 C GLU A 100 -9.759 -10.857 -4.372 1.00 0.00 C ATOM 1502 O GLU A 100 -8.543 -10.920 -4.195 1.00 0.00 O ATOM 1503 CB GLU A 100 -10.812 -10.173 -6.510 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.395 -10.592 -7.862 1.00 0.00 C ATOM 1505 CD GLU A 100 -11.923 -9.444 -8.710 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.015 -8.841 -8.532 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -11.243 -9.153 -9.730 1.00 0.00 O ATOM 0 H GLU A 100 -12.422 -11.747 -5.632 1.00 0.00 H new ATOM 0 HA GLU A 100 -9.750 -11.995 -6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.536 -9.543 -5.993 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.924 -9.564 -6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.626 -11.119 -8.427 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.205 -11.301 -7.689 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.554 -10.424 -3.378 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.026 -10.128 -2.082 1.00 0.00 C ATOM 1516 C LEU A 101 -9.409 -11.262 -1.338 1.00 0.00 C ATOM 1517 O LEU A 101 -8.260 -11.142 -0.915 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.097 -9.486 -1.185 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.577 -8.103 -1.657 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -12.800 -7.723 -0.805 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -10.447 -7.070 -1.514 1.00 0.00 C ATOM 0 H LEU A 101 -11.559 -10.279 -3.470 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.211 -9.439 -2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.955 -10.155 -1.129 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -10.699 -9.393 -0.174 1.00 0.00 H new ATOM 0 HG LEU A 101 -11.855 -8.125 -2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -13.168 -6.744 -1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -13.585 -8.466 -0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -12.514 -7.689 0.246 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -10.800 -6.096 -1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -10.144 -7.004 -0.469 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -9.595 -7.377 -2.120 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.111 -12.409 -1.335 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.646 -13.596 -0.687 1.00 0.00 C ATOM 1535 C ARG A 102 -8.448 -14.186 -1.349 1.00 0.00 C ATOM 1536 O ARG A 102 -7.492 -14.604 -0.698 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.821 -14.586 -0.754 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.499 -15.947 -0.135 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.687 -16.900 0.003 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.189 -18.031 0.835 1.00 0.00 N ATOM 1541 CZ ARG A 102 -11.974 -18.909 1.525 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.336 -18.820 1.546 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -11.349 -20.010 2.036 1.00 0.00 N ATOM 0 H ARG A 102 -11.018 -12.514 -1.791 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.337 -13.369 0.333 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.680 -14.155 -0.241 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.110 -14.727 -1.796 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.734 -16.432 -0.742 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.067 -15.785 0.853 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.535 -16.406 0.478 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.027 -17.249 -0.972 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.179 -18.160 0.894 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.806 -18.075 1.032 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.883 -19.499 2.076 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.348 -20.141 1.893 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.883 -20.702 2.561 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.379 -14.299 -2.688 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.255 -14.636 -3.505 1.00 0.00 C ATOM 1559 C HIS A 103 -5.958 -13.972 -3.193 1.00 0.00 C ATOM 1560 O HIS A 103 -4.957 -14.623 -2.899 1.00 0.00 O ATOM 1561 CB HIS A 103 -7.496 -14.273 -4.981 1.00 0.00 C ATOM 1562 CG HIS A 103 -6.446 -14.803 -5.912 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -5.300 -14.143 -6.307 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.501 -15.913 -6.695 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -4.673 -14.964 -7.191 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.372 -16.047 -7.477 1.00 0.00 N ATOM 0 H HIS A 103 -9.208 -14.135 -3.259 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.171 -15.703 -3.298 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.468 -14.659 -5.287 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.540 -13.188 -5.077 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -7.329 -16.607 -6.704 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -3.703 -14.752 -7.616 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -5.135 -16.801 -8.121 1.00 0.00 H new ATOM 1574 N VAL A 104 -5.936 -12.627 -3.174 1.00 0.00 N ATOM 1575 CA VAL A 104 -4.803 -11.858 -2.762 1.00 0.00 C ATOM 1576 C VAL A 104 -4.325 -12.155 -1.382 1.00 0.00 C ATOM 1577 O VAL A 104 -3.192 -12.613 -1.245 1.00 0.00 O ATOM 1578 CB VAL A 104 -4.919 -10.382 -3.004 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -3.919 -9.493 -2.244 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.777 -10.100 -4.509 1.00 0.00 C ATOM 0 H VAL A 104 -6.733 -12.056 -3.455 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.024 -12.208 -3.439 1.00 0.00 H new ATOM 0 HB VAL A 104 -5.902 -10.115 -2.616 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.097 -8.448 -2.496 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.049 -9.634 -1.171 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -2.902 -9.766 -2.526 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.861 -9.028 -4.688 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.805 -10.451 -4.855 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -5.565 -10.621 -5.053 1.00 0.00 H new ATOM 1590 N MET A 105 -5.215 -12.078 -0.377 1.00 0.00 N ATOM 1591 CA MET A 105 -4.933 -12.350 0.998 1.00 0.00 C ATOM 1592 C MET A 105 -4.269 -13.662 1.237 1.00 0.00 C ATOM 1593 O MET A 105 -3.165 -13.665 1.779 1.00 0.00 O ATOM 1594 CB MET A 105 -6.178 -12.267 1.898 1.00 0.00 C ATOM 1595 CG MET A 105 -6.796 -10.873 2.020 1.00 0.00 C ATOM 1596 SD MET A 105 -8.271 -10.767 3.078 1.00 0.00 S ATOM 1597 CE MET A 105 -8.311 -8.960 2.895 1.00 0.00 C ATOM 0 H MET A 105 -6.187 -11.811 -0.534 1.00 0.00 H new ATOM 0 HA MET A 105 -4.235 -11.557 1.267 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.934 -12.950 1.511 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.911 -12.618 2.895 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.040 -10.191 2.409 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.059 -10.521 1.022 1.00 0.00 H new ATOM 0 HE1 MET A 105 -9.291 -8.586 3.190 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.546 -8.513 3.530 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.119 -8.695 1.855 1.00 0.00 H new ATOM 1607 N THR A 106 -4.879 -14.721 0.676 1.00 0.00 N ATOM 1608 CA THR A 106 -4.369 -16.057 0.650 1.00 0.00 C ATOM 1609 C THR A 106 -3.020 -16.292 0.062 1.00 0.00 C ATOM 1610 O THR A 106 -2.107 -16.850 0.669 1.00 0.00 O ATOM 1611 CB THR A 106 -5.302 -17.165 0.261 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.583 -17.217 0.871 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.652 -18.536 0.511 1.00 0.00 C ATOM 0 H THR A 106 -5.784 -14.639 0.212 1.00 0.00 H new ATOM 0 HA THR A 106 -4.244 -16.121 1.731 1.00 0.00 H new ATOM 0 HB THR A 106 -5.478 -16.931 -0.789 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.128 -16.468 0.551 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.346 -19.326 0.222 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.740 -18.620 -0.080 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.409 -18.636 1.569 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.787 -15.813 -1.173 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.570 -16.009 -1.898 1.00 0.00 C ATOM 1623 C ASN A 107 -0.527 -15.069 -1.398 1.00 0.00 C ATOM 1624 O ASN A 107 0.647 -15.343 -1.641 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.805 -15.791 -3.403 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.422 -17.077 -3.935 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -1.654 -18.009 -4.166 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.773 -17.071 -4.087 1.00 0.00 N ATOM 0 H ASN A 107 -3.476 -15.266 -1.688 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.228 -17.033 -1.745 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.468 -14.943 -3.573 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.868 -15.570 -3.914 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.252 -17.905 -4.427 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.308 -16.232 -3.861 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.846 -13.955 -0.714 1.00 0.00 N ATOM 1636 CA LEU A 108 0.108 -13.168 0.004 1.00 0.00 C ATOM 1637 C LEU A 108 0.785 -13.764 1.191 1.00 0.00 C ATOM 1638 O LEU A 108 1.981 -13.665 1.460 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.503 -11.827 0.444 1.00 0.00 C ATOM 1640 CG LEU A 108 0.259 -10.727 1.201 1.00 0.00 C ATOM 1641 CD1 LEU A 108 1.512 -10.191 0.488 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -0.718 -9.557 1.408 1.00 0.00 C ATOM 0 H LEU A 108 -1.797 -13.591 -0.659 1.00 0.00 H new ATOM 0 HA LEU A 108 0.895 -13.067 -0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -0.887 -11.359 -0.462 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.365 -12.077 1.063 1.00 0.00 H new ATOM 0 HG LEU A 108 0.616 -11.172 2.130 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.978 -9.420 1.102 1.00 0.00 H new ATOM 0 HD12 LEU A 108 2.218 -11.006 0.331 1.00 0.00 H new ATOM 0 HD13 LEU A 108 1.229 -9.766 -0.475 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.214 -8.753 1.944 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -1.057 -9.191 0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -1.576 -9.898 1.988 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.014 -14.458 2.021 1.00 0.00 N ATOM 1655 CA GLY A 109 0.344 -15.169 3.208 1.00 0.00 C ATOM 1656 C GLY A 109 -0.785 -15.440 4.143 1.00 0.00 C ATOM 1657 O GLY A 109 -0.491 -16.200 5.064 1.00 0.00 O ATOM 0 H GLY A 109 -1.015 -14.526 1.838 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.796 -16.119 2.922 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.107 -14.600 3.739 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.998 -14.877 3.998 1.00 0.00 N ATOM 1662 CA GLU A 110 -3.051 -15.070 4.946 1.00 0.00 C ATOM 1663 C GLU A 110 -3.756 -16.379 4.842 1.00 0.00 C ATOM 1664 O GLU A 110 -4.023 -17.011 3.821 1.00 0.00 O ATOM 1665 CB GLU A 110 -4.102 -13.951 4.856 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.441 -12.573 4.786 1.00 0.00 C ATOM 1667 CD GLU A 110 -3.397 -11.947 6.173 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -2.698 -12.481 7.076 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.935 -10.832 6.408 1.00 0.00 O ATOM 0 H GLU A 110 -2.252 -14.279 3.211 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.540 -15.051 5.909 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.724 -14.104 3.974 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.761 -13.997 5.723 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.431 -12.665 4.387 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.996 -11.928 4.104 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.088 -16.986 5.995 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.674 -18.274 6.201 1.00 0.00 C ATOM 1678 C LYS A 111 -6.025 -17.994 6.763 1.00 0.00 C ATOM 1679 O LYS A 111 -6.221 -17.890 7.973 1.00 0.00 O ATOM 1680 CB LYS A 111 -3.832 -18.960 7.291 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.364 -19.195 6.930 1.00 0.00 C ATOM 1682 CD LYS A 111 -1.613 -20.183 7.823 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.127 -20.404 7.532 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.072 -21.008 6.195 1.00 0.00 N ATOM 0 H LYS A 111 -3.925 -16.516 6.885 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.722 -18.888 5.302 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.874 -18.353 8.196 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -4.289 -19.920 7.530 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.314 -19.553 5.902 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -1.844 -18.238 6.960 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.708 -19.844 8.855 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.117 -21.147 7.757 1.00 0.00 H new ATOM 0 HE2 LYS A 111 0.403 -19.453 7.587 1.00 0.00 H new ATOM 0 HE3 LYS A 111 0.303 -21.053 8.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.089 -21.147 6.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.414 -21.926 6.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -0.318 -20.376 5.467 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.049 -18.093 5.896 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.405 -17.654 6.014 1.00 0.00 C ATOM 1700 C LEU A 112 -9.307 -18.806 6.297 1.00 0.00 C ATOM 1701 O LEU A 112 -9.273 -19.830 5.618 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.796 -16.653 4.914 1.00 0.00 C ATOM 1703 CG LEU A 112 -7.927 -15.393 4.767 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.361 -14.817 3.408 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -7.957 -14.450 5.982 1.00 0.00 C ATOM 0 H LEU A 112 -6.900 -18.542 4.992 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.534 -17.030 6.898 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.790 -17.180 3.960 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.823 -16.336 5.096 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.857 -15.600 4.764 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.798 -13.907 3.202 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.167 -15.549 2.624 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.426 -14.586 3.434 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.316 -13.589 5.790 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.979 -14.111 6.154 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.597 -14.981 6.863 1.00 0.00 H new ATOM 1717 N THR A 113 -10.222 -18.722 7.279 1.00 0.00 N ATOM 1718 CA THR A 113 -11.494 -19.369 7.374 1.00 0.00 C ATOM 1719 C THR A 113 -12.560 -18.566 6.711 1.00 0.00 C ATOM 1720 O THR A 113 -12.380 -17.407 6.340 1.00 0.00 O ATOM 1721 CB THR A 113 -11.863 -19.747 8.778 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.751 -18.630 9.646 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.867 -20.828 9.232 1.00 0.00 C ATOM 0 H THR A 113 -10.048 -18.135 8.095 1.00 0.00 H new ATOM 0 HA THR A 113 -11.402 -20.311 6.833 1.00 0.00 H new ATOM 0 HB THR A 113 -12.893 -20.103 8.809 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.998 -18.897 10.556 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.100 -21.132 10.252 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.940 -21.691 8.570 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.854 -20.428 9.196 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.697 -19.223 6.418 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.793 -18.706 5.659 1.00 0.00 C ATOM 1733 C ASP A 114 -15.541 -17.574 6.274 1.00 0.00 C ATOM 1734 O ASP A 114 -15.886 -16.533 5.717 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.782 -19.829 5.307 1.00 0.00 C ATOM 1736 CG ASP A 114 -14.982 -20.722 4.370 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.699 -20.352 3.199 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -14.704 -21.899 4.726 1.00 0.00 O ATOM 0 H ASP A 114 -13.860 -20.179 6.733 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.321 -18.292 4.768 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.109 -20.369 6.195 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.678 -19.439 4.823 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.570 -17.729 7.610 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.092 -16.788 8.551 1.00 0.00 C ATOM 1745 C GLU A 115 -15.319 -15.521 8.680 1.00 0.00 C ATOM 1746 O GLU A 115 -15.929 -14.469 8.867 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.417 -17.490 9.880 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.198 -18.116 10.561 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.512 -18.717 11.923 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -16.499 -18.327 12.602 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.768 -19.664 12.296 1.00 0.00 O ATOM 0 H GLU A 115 -15.204 -18.568 8.061 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.032 -16.418 8.142 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.871 -16.769 10.560 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -17.159 -18.267 9.698 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -14.788 -18.892 9.915 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.425 -17.356 10.676 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.995 -15.609 8.459 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.112 -14.487 8.545 1.00 0.00 C ATOM 1760 C GLU A 116 -13.209 -13.728 7.267 1.00 0.00 C ATOM 1761 O GLU A 116 -13.273 -12.500 7.285 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.655 -14.858 8.867 1.00 0.00 C ATOM 1763 CG GLU A 116 -10.712 -13.662 9.017 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.432 -14.057 9.738 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -8.714 -14.961 9.232 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.109 -13.442 10.790 1.00 0.00 O ATOM 0 H GLU A 116 -13.527 -16.482 8.215 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.428 -13.873 9.388 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.637 -15.437 9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.276 -15.506 8.077 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.469 -13.261 8.033 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.213 -12.867 9.570 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.235 -14.321 6.060 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.520 -13.628 4.842 1.00 0.00 C ATOM 1775 C VAL A 117 -14.739 -12.773 4.802 1.00 0.00 C ATOM 1776 O VAL A 117 -14.689 -11.613 4.396 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.533 -14.572 3.677 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -13.838 -13.876 2.340 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.279 -15.462 3.713 1.00 0.00 C ATOM 0 H VAL A 117 -13.052 -15.316 5.927 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.695 -12.918 4.779 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.379 -15.253 3.770 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.833 -14.613 1.537 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.818 -13.402 2.392 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.079 -13.119 2.143 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.294 -16.146 2.864 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.388 -14.837 3.660 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.266 -16.035 4.640 1.00 0.00 H new ATOM 1789 N ASP A 118 -15.862 -13.430 5.143 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.138 -12.808 5.319 1.00 0.00 C ATOM 1791 C ASP A 118 -17.219 -11.699 6.311 1.00 0.00 C ATOM 1792 O ASP A 118 -17.738 -10.654 5.923 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.083 -13.952 5.724 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.433 -13.823 5.034 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -19.906 -12.693 4.739 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.052 -14.866 4.691 1.00 0.00 O ATOM 0 H ASP A 118 -15.882 -14.437 5.303 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.396 -12.306 4.387 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -17.630 -14.909 5.466 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.222 -13.946 6.805 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.722 -11.807 7.557 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.573 -10.795 8.556 1.00 0.00 C ATOM 1803 C GLU A 119 -15.819 -9.626 8.025 1.00 0.00 C ATOM 1804 O GLU A 119 -16.253 -8.487 8.193 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.966 -11.478 9.793 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.995 -10.698 11.109 1.00 0.00 C ATOM 1807 CD GLU A 119 -15.222 -11.149 12.340 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -15.304 -12.374 12.624 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.508 -10.258 12.873 1.00 0.00 O ATOM 0 H GLU A 119 -16.388 -12.708 7.899 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.525 -10.357 8.856 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.489 -12.422 9.948 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.928 -11.722 9.568 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -15.657 -9.687 10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -17.041 -10.625 11.406 1.00 0.00 H new ATOM 1816 N MET A 120 -14.707 -9.858 7.305 1.00 0.00 N ATOM 1817 CA MET A 120 -13.911 -8.868 6.647 1.00 0.00 C ATOM 1818 C MET A 120 -14.635 -8.152 5.560 1.00 0.00 C ATOM 1819 O MET A 120 -14.678 -6.924 5.627 1.00 0.00 O ATOM 1820 CB MET A 120 -12.529 -9.365 6.193 1.00 0.00 C ATOM 1821 CG MET A 120 -11.624 -9.665 7.390 1.00 0.00 C ATOM 1822 SD MET A 120 -9.916 -10.012 6.872 1.00 0.00 S ATOM 1823 CE MET A 120 -9.517 -8.290 6.454 1.00 0.00 C ATOM 0 H MET A 120 -14.340 -10.801 7.174 1.00 0.00 H new ATOM 0 HA MET A 120 -13.713 -8.131 7.426 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.645 -10.264 5.588 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.060 -8.612 5.559 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.632 -8.816 8.074 1.00 0.00 H new ATOM 0 HG3 MET A 120 -12.018 -10.520 7.939 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.445 -8.128 6.564 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.810 -8.088 5.424 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.056 -7.619 7.123 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.361 -8.855 4.672 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.180 -8.238 3.675 1.00 0.00 C ATOM 1835 C ILE A 121 -17.251 -7.358 4.222 1.00 0.00 C ATOM 1836 O ILE A 121 -17.456 -6.198 3.869 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.887 -9.163 2.730 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.045 -10.164 1.921 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.726 -8.378 1.706 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -14.861 -9.547 1.176 1.00 0.00 C ATOM 0 H ILE A 121 -15.379 -9.875 4.646 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.417 -7.673 3.139 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.477 -9.756 3.429 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.671 -10.933 2.597 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.692 -10.662 1.199 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.227 -9.076 1.035 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.472 -7.779 2.229 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.075 -7.722 1.128 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.326 -10.327 0.634 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.224 -8.799 0.471 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.187 -9.075 1.891 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.993 -7.852 5.230 1.00 0.00 N ATOM 1853 CA ARG A 122 -19.111 -7.362 5.975 1.00 0.00 C ATOM 1854 C ARG A 122 -18.800 -6.055 6.619 1.00 0.00 C ATOM 1855 O ARG A 122 -19.532 -5.067 6.608 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.578 -8.385 7.025 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.710 -7.810 7.878 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.470 -8.878 8.668 1.00 0.00 C ATOM 1859 NE ARG A 122 -20.610 -9.503 9.712 1.00 0.00 N ATOM 1860 CZ ARG A 122 -20.687 -10.793 10.151 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -21.250 -11.793 9.412 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -20.289 -11.081 11.425 1.00 0.00 N ATOM 0 H ARG A 122 -17.751 -8.778 5.583 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.927 -7.207 5.269 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.917 -9.294 6.528 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.741 -8.665 7.664 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.298 -7.078 8.572 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.409 -7.278 7.232 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -22.346 -8.430 9.137 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.832 -9.647 7.986 1.00 0.00 H new ATOM 0 HE ARG A 122 -19.897 -8.911 10.139 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.636 -11.590 8.490 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -21.285 -12.743 9.782 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -19.941 -10.338 12.031 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -20.339 -12.039 11.771 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.614 -6.083 7.252 1.00 0.00 N ATOM 1877 CA GLU A 123 -17.080 -4.950 7.942 1.00 0.00 C ATOM 1878 C GLU A 123 -16.720 -3.785 7.086 1.00 0.00 C ATOM 1879 O GLU A 123 -17.057 -2.637 7.374 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.813 -5.410 8.682 1.00 0.00 C ATOM 1881 CG GLU A 123 -15.123 -4.334 9.523 1.00 0.00 C ATOM 1882 CD GLU A 123 -14.198 -4.876 10.603 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -14.665 -5.724 11.409 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -13.024 -4.425 10.679 1.00 0.00 O ATOM 0 H GLU A 123 -17.015 -6.908 7.285 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.872 -4.596 8.601 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -16.074 -6.245 9.332 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.100 -5.788 7.949 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.548 -3.686 8.861 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.886 -3.713 9.993 1.00 0.00 H new ATOM 1891 N ALA A 124 -16.115 -3.966 5.899 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.749 -2.982 4.928 1.00 0.00 C ATOM 1893 C ALA A 124 -16.924 -2.577 4.105 1.00 0.00 C ATOM 1894 O ALA A 124 -17.080 -1.393 3.811 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.704 -3.476 3.913 1.00 0.00 C ATOM 0 H ALA A 124 -15.856 -4.903 5.589 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.343 -2.162 5.521 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.475 -2.677 3.208 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.795 -3.767 4.439 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.100 -4.335 3.371 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.809 -3.475 3.637 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.787 -3.188 2.634 1.00 0.00 C ATOM 1903 C ASP A 125 -20.107 -2.942 3.281 1.00 0.00 C ATOM 1904 O ASP A 125 -21.001 -3.783 3.364 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.798 -4.216 1.490 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.347 -3.579 0.222 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -18.543 -2.963 -0.528 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -20.563 -3.745 -0.065 1.00 0.00 O ATOM 0 H ASP A 125 -17.845 -4.438 3.970 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.513 -2.266 2.121 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -17.788 -4.586 1.313 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.408 -5.075 1.768 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.175 -1.750 3.900 1.00 0.00 N ATOM 1914 CA ILE A 126 -21.352 -1.251 4.541 1.00 0.00 C ATOM 1915 C ILE A 126 -22.447 -0.846 3.615 1.00 0.00 C ATOM 1916 O ILE A 126 -23.625 -0.718 3.945 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.989 -0.247 5.594 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -22.111 0.346 6.463 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.294 0.931 4.890 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -22.942 -0.615 7.311 1.00 0.00 C ATOM 0 H ILE A 126 -19.382 -1.111 3.956 1.00 0.00 H new ATOM 0 HA ILE A 126 -21.819 -2.088 5.060 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.377 -0.815 6.295 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -21.663 1.080 7.132 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -22.792 0.887 5.806 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.015 1.683 5.628 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -19.399 0.574 4.380 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.974 1.372 4.162 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -23.692 -0.053 7.868 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -23.437 -1.337 6.662 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -22.290 -1.141 8.009 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.046 -0.579 2.359 1.00 0.00 N ATOM 1933 CA ASP A 127 -22.938 -0.131 1.335 1.00 0.00 C ATOM 1934 C ASP A 127 -23.751 -1.260 0.802 1.00 0.00 C ATOM 1935 O ASP A 127 -24.980 -1.221 0.841 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.252 0.663 0.211 1.00 0.00 C ATOM 1937 CG ASP A 127 -21.150 -0.104 -0.506 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -20.046 -0.377 0.037 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.386 -0.602 -1.639 1.00 0.00 O ATOM 0 H ASP A 127 -21.079 -0.677 2.048 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.611 0.581 1.813 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.004 0.964 -0.518 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -21.831 1.577 0.631 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.150 -2.386 0.377 1.00 0.00 N ATOM 1945 CA GLY A 128 -23.981 -3.522 0.122 1.00 0.00 C ATOM 1946 C GLY A 128 -23.754 -4.461 -1.012 1.00 0.00 C ATOM 1947 O GLY A 128 -24.352 -5.530 -1.120 1.00 0.00 O ATOM 0 H GLY A 128 -22.150 -2.510 0.217 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.965 -4.125 1.030 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -24.996 -3.142 0.009 1.00 0.00 H new ATOM 1951 N ASP A 129 -22.986 -4.098 -2.055 1.00 0.00 N ATOM 1952 CA ASP A 129 -22.749 -4.887 -3.224 1.00 0.00 C ATOM 1953 C ASP A 129 -21.756 -5.973 -2.986 1.00 0.00 C ATOM 1954 O ASP A 129 -21.721 -7.031 -3.612 1.00 0.00 O ATOM 1955 CB ASP A 129 -22.434 -4.072 -4.490 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.208 -3.173 -4.410 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -20.615 -2.985 -3.315 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -20.840 -2.733 -5.531 1.00 0.00 O ATOM 0 H ASP A 129 -22.502 -3.200 -2.083 1.00 0.00 H new ATOM 0 HA ASP A 129 -23.706 -5.366 -3.433 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -22.300 -4.764 -5.321 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -23.300 -3.454 -4.726 1.00 0.00 H new ATOM 1963 N GLY A 130 -20.880 -5.748 -1.991 1.00 0.00 N ATOM 1964 CA GLY A 130 -19.760 -6.600 -1.739 1.00 0.00 C ATOM 1965 C GLY A 130 -18.648 -6.346 -2.697 1.00 0.00 C ATOM 1966 O GLY A 130 -18.006 -7.316 -3.097 1.00 0.00 O ATOM 0 H GLY A 130 -20.951 -4.959 -1.349 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -19.406 -6.443 -0.720 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -20.072 -7.642 -1.811 1.00 0.00 H new ATOM 1970 N GLN A 131 -18.542 -5.122 -3.243 1.00 0.00 N ATOM 1971 CA GLN A 131 -17.578 -4.813 -4.253 1.00 0.00 C ATOM 1972 C GLN A 131 -16.875 -3.533 -3.959 1.00 0.00 C ATOM 1973 O GLN A 131 -17.503 -2.567 -3.530 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.052 -4.788 -5.716 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.998 -5.940 -6.064 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.557 -5.744 -7.466 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -19.357 -6.530 -8.392 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.172 -4.556 -7.709 1.00 0.00 N ATOM 0 H GLN A 131 -19.134 -4.334 -2.980 1.00 0.00 H new ATOM 0 HA GLN A 131 -16.912 -5.674 -4.191 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.556 -3.841 -5.912 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.183 -4.829 -6.373 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.466 -6.890 -6.004 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.812 -5.985 -5.341 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -20.339 -3.902 -6.944 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -20.466 -4.318 -8.656 1.00 0.00 H new ATOM 1987 N VAL A 132 -15.537 -3.549 -4.103 1.00 0.00 N ATOM 1988 CA VAL A 132 -14.749 -2.410 -3.751 1.00 0.00 C ATOM 1989 C VAL A 132 -14.438 -1.701 -5.023 1.00 0.00 C ATOM 1990 O VAL A 132 -13.773 -2.268 -5.889 1.00 0.00 O ATOM 1991 CB VAL A 132 -13.531 -2.917 -3.037 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -12.735 -1.771 -2.390 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -13.820 -3.971 -1.955 1.00 0.00 C ATOM 0 H VAL A 132 -15.006 -4.343 -4.460 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.250 -1.707 -3.085 1.00 0.00 H new ATOM 0 HB VAL A 132 -12.947 -3.398 -3.822 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -11.860 -2.177 -1.882 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.414 -1.070 -3.161 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -13.366 -1.252 -1.668 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -12.884 -4.282 -1.491 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.477 -3.544 -1.197 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -14.304 -4.836 -2.409 1.00 0.00 H new ATOM 2003 N ASN A 133 -14.825 -0.415 -5.102 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.564 0.462 -6.201 1.00 0.00 C ATOM 2005 C ASN A 133 -13.367 1.271 -5.837 1.00 0.00 C ATOM 2006 O ASN A 133 -12.787 1.125 -4.762 1.00 0.00 O ATOM 2007 CB ASN A 133 -15.796 1.267 -6.650 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.358 2.111 -5.515 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -15.813 3.104 -5.036 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -17.544 1.609 -5.079 1.00 0.00 N ATOM 0 H ASN A 133 -15.351 0.038 -4.355 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.339 -0.105 -7.104 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.525 1.913 -7.485 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -16.565 0.585 -7.012 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.037 2.061 -4.309 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -17.941 0.780 -5.522 1.00 0.00 H new ATOM 2017 N TYR A 134 -12.852 2.177 -6.688 1.00 0.00 N ATOM 2018 CA TYR A 134 -11.616 2.845 -6.422 1.00 0.00 C ATOM 2019 C TYR A 134 -11.751 3.814 -5.298 1.00 0.00 C ATOM 2020 O TYR A 134 -10.998 3.827 -4.326 1.00 0.00 O ATOM 2021 CB TYR A 134 -11.273 3.581 -7.728 1.00 0.00 C ATOM 2022 CG TYR A 134 -9.853 4.032 -7.769 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -8.844 3.153 -7.453 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -9.536 5.335 -8.074 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -7.550 3.573 -7.651 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -8.251 5.802 -7.931 1.00 0.00 C ATOM 2027 CZ TYR A 134 -7.222 4.902 -7.788 1.00 0.00 C ATOM 2028 OH TYR A 134 -5.873 5.201 -8.072 1.00 0.00 O ATOM 0 H TYR A 134 -13.295 2.448 -7.566 1.00 0.00 H new ATOM 0 HA TYR A 134 -10.838 2.142 -6.123 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.467 2.923 -8.575 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -11.929 4.444 -7.839 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -9.060 2.169 -7.064 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -10.308 6.001 -8.431 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -6.764 2.834 -7.701 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -8.052 6.864 -7.931 1.00 0.00 H new ATOM 0 HH TYR A 134 -5.771 6.168 -8.195 1.00 0.00 H new ATOM 2038 N GLU A 135 -12.771 4.686 -5.202 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.102 5.508 -4.080 1.00 0.00 C ATOM 2040 C GLU A 135 -13.219 4.814 -2.767 1.00 0.00 C ATOM 2041 O GLU A 135 -12.630 5.276 -1.790 1.00 0.00 O ATOM 2042 CB GLU A 135 -14.452 6.187 -4.363 1.00 0.00 C ATOM 2043 CG GLU A 135 -14.953 7.037 -3.193 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.243 7.774 -3.521 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -17.015 7.309 -4.401 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -16.616 8.706 -2.759 1.00 0.00 O ATOM 0 H GLU A 135 -13.419 4.826 -5.978 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.265 6.199 -3.979 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -14.357 6.817 -5.247 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -15.195 5.423 -4.594 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -15.114 6.397 -2.326 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.185 7.760 -2.918 1.00 0.00 H new ATOM 2053 N GLU A 136 -13.810 3.610 -2.673 1.00 0.00 N ATOM 2054 CA GLU A 136 -13.819 2.867 -1.451 1.00 0.00 C ATOM 2055 C GLU A 136 -12.527 2.305 -0.967 1.00 0.00 C ATOM 2056 O GLU A 136 -12.279 2.185 0.232 1.00 0.00 O ATOM 2057 CB GLU A 136 -14.847 1.725 -1.512 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.299 2.124 -1.787 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.320 1.007 -1.949 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -16.957 -0.192 -1.812 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -18.541 1.193 -2.199 1.00 0.00 O ATOM 0 H GLU A 136 -14.285 3.148 -3.449 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.081 3.635 -0.723 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.533 1.025 -2.287 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -14.815 1.187 -0.565 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.631 2.766 -0.971 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.315 2.728 -2.695 1.00 0.00 H new ATOM 2068 N PHE A 137 -11.691 2.019 -1.981 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.336 1.564 -1.926 1.00 0.00 C ATOM 2070 C PHE A 137 -9.521 2.722 -1.463 1.00 0.00 C ATOM 2071 O PHE A 137 -8.572 2.644 -0.685 1.00 0.00 O ATOM 2072 CB PHE A 137 -9.911 0.918 -3.255 1.00 0.00 C ATOM 2073 CG PHE A 137 -8.618 0.190 -3.119 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -8.487 -1.135 -2.773 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -7.461 0.870 -3.416 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.262 -1.758 -2.800 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.206 0.321 -3.291 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.121 -1.027 -3.034 1.00 0.00 C ATOM 0 H PHE A 137 -12.003 2.119 -2.947 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.187 0.752 -1.214 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -10.685 0.227 -3.589 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -9.818 1.687 -4.021 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.361 -1.695 -2.475 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -7.541 1.889 -3.766 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.196 -2.824 -2.637 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -5.318 0.928 -3.391 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.156 -1.513 -3.016 1.00 0.00 H new ATOM 2088 N VAL A 138 -9.772 3.942 -1.972 1.00 0.00 N ATOM 2089 CA VAL A 138 -8.980 5.086 -1.643 1.00 0.00 C ATOM 2090 C VAL A 138 -9.256 5.398 -0.213 1.00 0.00 C ATOM 2091 O VAL A 138 -8.319 5.635 0.548 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.304 6.249 -2.534 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -8.991 7.609 -1.888 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.554 6.108 -3.869 1.00 0.00 C ATOM 0 H VAL A 138 -10.535 4.137 -2.620 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.920 4.881 -1.794 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.380 6.228 -2.707 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.247 8.409 -2.582 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.575 7.721 -0.974 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.929 7.662 -1.649 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.793 6.955 -4.512 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.480 6.086 -3.683 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -8.856 5.183 -4.360 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.552 5.416 0.149 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.033 5.706 1.464 1.00 0.00 C ATOM 2106 C GLN A 139 -10.491 4.713 2.434 1.00 0.00 C ATOM 2107 O GLN A 139 -9.808 5.057 3.398 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.563 5.857 1.497 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.092 6.077 2.916 1.00 0.00 C ATOM 2110 CD GLN A 139 -14.500 6.654 2.904 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -14.704 7.728 3.468 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -15.413 5.926 2.207 1.00 0.00 N ATOM 0 H GLN A 139 -11.303 5.218 -0.512 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.660 6.681 1.777 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -12.857 6.697 0.867 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.024 4.964 1.074 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.090 5.131 3.457 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.426 6.752 3.453 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -15.139 5.043 1.775 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -16.372 6.263 2.116 1.00 0.00 H new ATOM 2121 N MET A 140 -10.626 3.390 2.231 1.00 0.00 N ATOM 2122 CA MET A 140 -10.005 2.453 3.115 1.00 0.00 C ATOM 2123 C MET A 140 -8.518 2.438 3.201 1.00 0.00 C ATOM 2124 O MET A 140 -7.971 2.252 4.287 1.00 0.00 O ATOM 2125 CB MET A 140 -10.490 1.083 2.611 1.00 0.00 C ATOM 2126 CG MET A 140 -10.001 -0.081 3.476 1.00 0.00 C ATOM 2127 SD MET A 140 -11.060 -1.558 3.477 1.00 0.00 S ATOM 2128 CE MET A 140 -12.183 -0.946 4.766 1.00 0.00 C ATOM 0 H MET A 140 -11.157 2.973 1.466 1.00 0.00 H new ATOM 0 HA MET A 140 -10.289 2.733 4.129 1.00 0.00 H new ATOM 0 HB2 MET A 140 -11.580 1.077 2.586 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.146 0.937 1.587 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.006 -0.369 3.137 1.00 0.00 H new ATOM 0 HG3 MET A 140 -9.898 0.271 4.502 1.00 0.00 H new ATOM 0 HE1 MET A 140 -12.830 -1.757 5.100 1.00 0.00 H new ATOM 0 HE2 MET A 140 -11.601 -0.575 5.610 1.00 0.00 H new ATOM 0 HE3 MET A 140 -12.793 -0.138 4.363 1.00 0.00 H new ATOM 2138 N MET A 141 -7.726 2.439 2.113 1.00 0.00 N ATOM 2139 CA MET A 141 -6.328 2.179 2.262 1.00 0.00 C ATOM 2140 C MET A 141 -5.378 3.317 2.410 1.00 0.00 C ATOM 2141 O MET A 141 -4.175 3.170 2.621 1.00 0.00 O ATOM 2142 CB MET A 141 -5.971 1.450 0.956 1.00 0.00 C ATOM 2143 CG MET A 141 -6.749 0.208 0.517 1.00 0.00 C ATOM 2144 SD MET A 141 -6.454 -1.306 1.479 1.00 0.00 S ATOM 2145 CE MET A 141 -7.843 -2.250 0.786 1.00 0.00 C ATOM 0 H MET A 141 -8.041 2.614 1.159 1.00 0.00 H new ATOM 0 HA MET A 141 -6.208 1.655 3.210 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.050 2.179 0.150 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.922 1.163 1.025 1.00 0.00 H new ATOM 0 HG2 MET A 141 -7.814 0.438 0.559 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.508 0.004 -0.526 1.00 0.00 H new ATOM 0 HE1 MET A 141 -8.498 -2.579 1.593 1.00 0.00 H new ATOM 0 HE2 MET A 141 -8.405 -1.618 0.098 1.00 0.00 H new ATOM 0 HE3 MET A 141 -7.461 -3.119 0.251 1.00 0.00 H new ATOM 2155 N THR A 142 -5.752 4.576 2.120 1.00 0.00 N ATOM 2156 CA THR A 142 -4.976 5.775 2.192 1.00 0.00 C ATOM 2157 C THR A 142 -4.526 6.037 3.622 1.00 0.00 C ATOM 2158 O THR A 142 -3.286 6.155 3.812 1.00 0.00 O ATOM 2159 CB THR A 142 -5.500 6.974 1.459 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.829 7.269 1.862 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.339 6.702 -0.046 1.00 0.00 C ATOM 0 H THR A 142 -6.701 4.771 1.801 1.00 0.00 H new ATOM 0 HA THR A 142 -4.086 5.576 1.594 1.00 0.00 H new ATOM 0 HB THR A 142 -4.935 7.874 1.700 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.426 6.547 1.575 1.00 0.00 H new ATOM 0 HG21 THR A 142 -5.711 7.556 -0.612 1.00 0.00 H new ATOM 0 HG22 THR A 142 -4.285 6.545 -0.277 1.00 0.00 H new ATOM 0 HG23 THR A 142 -5.906 5.812 -0.318 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -9.185 -0.327 12.859 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.119 -1.586 12.083 1.00 0.00 C ATOM 2172 C ARG B 1 -7.754 -2.135 11.844 1.00 0.00 C ATOM 2173 O ARG B 1 -6.891 -1.361 11.434 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.974 -1.374 10.823 1.00 0.00 C ATOM 2175 CG ARG B 1 -9.595 -0.166 9.964 1.00 0.00 C ATOM 2176 CD ARG B 1 -10.445 0.069 8.713 1.00 0.00 C ATOM 2177 NE ARG B 1 -9.875 1.281 8.062 1.00 0.00 N ATOM 2178 CZ ARG B 1 -10.602 2.121 7.268 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -11.846 1.820 6.794 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -10.115 3.269 6.711 1.00 0.00 N ATOM 0 H1 ARG B 1 -10.169 0.009 12.893 1.00 0.00 H new ATOM 0 H2 ARG B 1 -8.843 -0.497 13.826 1.00 0.00 H new ATOM 0 H3 ARG B 1 -8.589 0.393 12.403 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.532 -2.399 12.680 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -9.909 -2.271 10.206 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -11.016 -1.270 11.126 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -9.648 0.727 10.587 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -8.556 -0.278 9.656 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -10.404 -0.791 8.044 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -11.492 0.220 8.974 1.00 0.00 H new ATOM 0 HE ARG B 1 -8.890 1.495 8.217 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -12.279 0.927 7.030 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -12.342 2.488 6.204 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -9.148 3.547 6.879 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -10.718 3.848 6.127 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.469 -3.425 12.094 1.00 0.00 N ATOM 2194 CA ARG B 2 -6.169 -4.021 12.110 1.00 0.00 C ATOM 2195 C ARG B 2 -5.880 -4.825 10.890 1.00 0.00 C ATOM 2196 O ARG B 2 -4.865 -4.622 10.225 1.00 0.00 O ATOM 2197 CB ARG B 2 -6.060 -4.896 13.370 1.00 0.00 C ATOM 2198 CG ARG B 2 -6.144 -4.054 14.645 1.00 0.00 C ATOM 2199 CD ARG B 2 -4.877 -3.535 15.327 1.00 0.00 C ATOM 2200 NE ARG B 2 -5.242 -2.769 16.551 1.00 0.00 N ATOM 2201 CZ ARG B 2 -4.664 -1.607 16.974 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.664 -0.968 16.300 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -5.344 -0.841 17.877 1.00 0.00 N ATOM 0 H ARG B 2 -8.204 -4.102 12.300 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.426 -3.223 12.123 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.858 -5.638 13.369 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -5.117 -5.442 13.355 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -6.762 -3.186 14.415 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -6.686 -4.645 15.384 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -4.226 -4.369 15.589 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -4.318 -2.898 14.641 1.00 0.00 H new ATOM 0 HE ARG B 2 -5.994 -3.148 17.127 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -3.308 -1.357 15.427 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -3.273 -0.101 16.669 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -6.257 -1.143 18.216 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -4.939 0.033 18.212 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.795 -5.736 10.514 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.520 -6.706 9.501 1.00 0.00 C ATOM 2219 C LYS B 3 -6.559 -6.089 8.145 1.00 0.00 C ATOM 2220 O LYS B 3 -5.897 -6.456 7.176 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.707 -7.685 9.494 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.870 -8.438 10.816 1.00 0.00 C ATOM 2223 CD LYS B 3 -8.931 -9.540 10.859 1.00 0.00 C ATOM 2224 CE LYS B 3 -9.104 -10.108 12.269 1.00 0.00 C ATOM 2225 NZ LYS B 3 -10.008 -11.278 12.193 1.00 0.00 N ATOM 0 H LYS B 3 -7.731 -5.800 10.915 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.547 -7.154 9.703 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.623 -7.135 9.281 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.572 -8.405 8.687 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.909 -8.882 11.074 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -8.104 -7.711 11.594 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.883 -9.142 10.508 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.650 -10.342 10.176 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.138 -10.401 12.681 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -9.518 -9.351 12.935 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -10.300 -11.554 13.152 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -10.848 -11.031 11.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.511 -12.072 11.741 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.373 -5.040 7.932 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.268 -4.187 6.788 1.00 0.00 C ATOM 2241 C TRP B 4 -6.148 -3.208 6.708 1.00 0.00 C ATOM 2242 O TRP B 4 -5.733 -2.751 5.643 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.608 -3.444 6.660 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.791 -4.325 6.338 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.917 -4.635 7.044 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.046 -4.850 5.021 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.890 -5.232 6.285 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.352 -5.354 5.025 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.284 -4.859 3.885 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.834 -5.924 3.879 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.786 -5.438 2.743 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.086 -5.884 2.726 1.00 0.00 C ATOM 0 H TRP B 4 -8.123 -4.778 8.571 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.029 -4.862 5.966 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.807 -2.919 7.594 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.515 -2.686 5.882 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.031 -4.430 8.098 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.818 -5.524 6.591 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.299 -4.416 3.885 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.801 -6.405 3.880 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.164 -5.541 1.866 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.526 -6.207 1.794 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.597 -2.830 7.875 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.543 -1.867 7.943 1.00 0.00 C ATOM 2265 C GLN B 5 -3.257 -2.543 7.612 1.00 0.00 C ATOM 2266 O GLN B 5 -2.379 -2.039 6.913 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.328 -1.338 9.372 1.00 0.00 C ATOM 2268 CG GLN B 5 -3.244 -0.270 9.528 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.506 1.066 8.850 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.492 1.755 9.106 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -2.724 1.382 7.783 1.00 0.00 N ATOM 0 H GLN B 5 -5.886 -3.197 8.782 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.816 -1.059 7.264 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.271 -0.928 9.734 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -4.078 -2.180 10.018 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -3.094 -0.089 10.592 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -2.309 -0.673 9.138 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -1.905 0.815 7.565 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -2.957 2.186 7.201 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.062 -3.732 8.209 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.039 -4.656 7.830 1.00 0.00 C ATOM 2282 C LYS B 6 -1.978 -4.997 6.380 1.00 0.00 C ATOM 2283 O LYS B 6 -0.895 -5.015 5.798 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.311 -5.927 8.652 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.201 -6.974 8.539 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.564 -8.260 9.285 1.00 0.00 C ATOM 2287 CE LYS B 6 -2.361 -9.213 8.393 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.485 -10.556 9.003 1.00 0.00 N ATOM 0 H LYS B 6 -3.638 -4.062 8.984 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.072 -4.192 8.026 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.436 -5.653 9.700 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.252 -6.369 8.323 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.019 -7.201 7.488 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.274 -6.568 8.943 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.654 -8.754 9.627 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.147 -8.016 10.173 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.354 -8.801 8.215 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -1.873 -9.298 7.422 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.293 -11.283 8.284 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.800 -10.649 9.780 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -3.449 -10.681 9.374 1.00 0.00 H new ATOM 2302 N THR B 7 -3.119 -5.320 5.745 1.00 0.00 N ATOM 2303 CA THR B 7 -3.389 -5.565 4.363 1.00 0.00 C ATOM 2304 C THR B 7 -3.030 -4.330 3.611 1.00 0.00 C ATOM 2305 O THR B 7 -2.343 -4.284 2.591 1.00 0.00 O ATOM 2306 CB THR B 7 -4.807 -5.900 4.005 1.00 0.00 C ATOM 2307 OG1 THR B 7 -5.241 -7.077 4.671 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.991 -6.225 2.513 1.00 0.00 C ATOM 0 H THR B 7 -3.976 -5.423 6.289 1.00 0.00 H new ATOM 0 HA THR B 7 -2.803 -6.448 4.109 1.00 0.00 H new ATOM 0 HB THR B 7 -5.372 -5.013 4.290 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.269 -6.915 5.637 1.00 0.00 H new ATOM 0 HG21 THR B 7 -6.038 -6.459 2.318 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.694 -5.364 1.914 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.372 -7.082 2.248 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.499 -3.149 4.052 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.184 -1.890 3.451 1.00 0.00 C ATOM 2318 C GLY B 8 -1.752 -1.564 3.202 1.00 0.00 C ATOM 2319 O GLY B 8 -1.290 -1.075 2.172 1.00 0.00 O ATOM 0 H GLY B 8 -4.120 -3.068 4.857 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.708 -1.837 2.496 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.598 -1.106 4.085 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.900 -1.788 4.218 1.00 0.00 N ATOM 2324 CA HIS B 9 0.500 -1.540 4.368 1.00 0.00 C ATOM 2325 C HIS B 9 1.241 -2.479 3.478 1.00 0.00 C ATOM 2326 O HIS B 9 2.128 -2.105 2.713 1.00 0.00 O ATOM 2327 CB HIS B 9 1.064 -1.838 5.768 1.00 0.00 C ATOM 2328 CG HIS B 9 0.827 -0.836 6.859 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.804 0.530 6.661 1.00 0.00 N ATOM 2330 CD2 HIS B 9 0.601 -1.054 8.182 1.00 0.00 C ATOM 2331 CE1 HIS B 9 0.689 1.045 7.914 1.00 0.00 C ATOM 2332 NE2 HIS B 9 0.448 0.145 8.849 1.00 0.00 N ATOM 0 H HIS B 9 -1.262 -2.214 5.071 1.00 0.00 H new ATOM 0 HA HIS B 9 0.623 -0.480 4.147 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.650 -2.791 6.097 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.141 -1.974 5.670 1.00 0.00 H new ATOM 0 HD2 HIS B 9 0.549 -2.028 8.646 1.00 0.00 H new ATOM 0 HE1 HIS B 9 0.786 2.099 8.126 1.00 0.00 H new ATOM 0 HE2 HIS B 9 0.207 0.298 9.828 1.00 0.00 H new ATOM 2340 N ALA B 10 0.909 -3.781 3.537 1.00 0.00 N ATOM 2341 CA ALA B 10 1.324 -4.802 2.626 1.00 0.00 C ATOM 2342 C ALA B 10 1.017 -4.496 1.200 1.00 0.00 C ATOM 2343 O ALA B 10 1.919 -4.668 0.381 1.00 0.00 O ATOM 2344 CB ALA B 10 0.608 -6.132 2.915 1.00 0.00 C ATOM 0 H ALA B 10 0.307 -4.145 4.275 1.00 0.00 H new ATOM 0 HA ALA B 10 2.402 -4.863 2.774 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.945 -6.888 2.206 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.840 -6.457 3.929 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.469 -5.995 2.815 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.214 -4.134 0.797 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.581 -4.011 -0.580 1.00 0.00 C ATOM 2352 C VAL B 11 -0.055 -2.788 -1.250 1.00 0.00 C ATOM 2353 O VAL B 11 0.323 -2.777 -2.420 1.00 0.00 O ATOM 2354 CB VAL B 11 -2.018 -4.401 -0.761 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -3.029 -3.286 -0.444 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.273 -4.819 -2.219 1.00 0.00 C ATOM 0 H VAL B 11 -0.973 -3.921 1.444 1.00 0.00 H new ATOM 0 HA VAL B 11 -0.044 -4.742 -1.185 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.172 -5.215 -0.052 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -4.042 -3.657 -0.602 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.915 -2.976 0.595 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.848 -2.434 -1.099 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.319 -5.100 -2.339 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -2.043 -3.985 -2.882 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.638 -5.668 -2.470 1.00 0.00 H new ATOM 2366 N ARG B 12 0.142 -1.691 -0.497 1.00 0.00 N ATOM 2367 CA ARG B 12 0.666 -0.429 -0.921 1.00 0.00 C ATOM 2368 C ARG B 12 2.146 -0.600 -0.903 1.00 0.00 C ATOM 2369 O ARG B 12 2.851 0.152 -1.574 1.00 0.00 O ATOM 2370 CB ARG B 12 0.283 0.713 0.036 1.00 0.00 C ATOM 2371 CG ARG B 12 -1.189 1.129 0.002 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.599 2.243 0.967 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.663 3.400 0.891 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.714 4.452 1.758 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.660 4.355 2.738 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.064 5.566 1.627 1.00 0.00 N ATOM 0 H ARG B 12 -0.086 -1.689 0.497 1.00 0.00 H new ATOM 0 HA ARG B 12 0.268 -0.161 -1.900 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.535 0.413 1.053 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.895 1.583 -0.200 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -1.432 1.448 -1.012 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.798 0.250 0.214 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.610 2.575 0.733 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.619 1.855 1.986 1.00 0.00 H new ATOM 0 HE ARG B 12 0.047 3.406 0.159 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.266 3.536 2.783 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.761 5.102 3.425 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.723 5.640 0.852 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.014 6.325 2.304 1.00 0.00 H new ATOM 2390 N ALA B 13 2.748 -1.588 -0.219 1.00 0.00 N ATOM 2391 CA ALA B 13 4.104 -1.949 -0.496 1.00 0.00 C ATOM 2392 C ALA B 13 4.217 -2.712 -1.771 1.00 0.00 C ATOM 2393 O ALA B 13 5.130 -2.358 -2.516 1.00 0.00 O ATOM 2394 CB ALA B 13 4.652 -2.876 0.601 1.00 0.00 C ATOM 0 H ALA B 13 2.302 -2.133 0.519 1.00 0.00 H new ATOM 0 HA ALA B 13 4.663 -1.015 -0.552 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.685 -3.140 0.372 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.612 -2.365 1.563 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.048 -3.782 0.647 1.00 0.00 H new ATOM 2400 N ILE B 14 3.299 -3.648 -2.072 1.00 0.00 N ATOM 2401 CA ILE B 14 3.270 -4.286 -3.352 1.00 0.00 C ATOM 2402 C ILE B 14 3.191 -3.258 -4.428 1.00 0.00 C ATOM 2403 O ILE B 14 3.887 -3.303 -5.441 1.00 0.00 O ATOM 2404 CB ILE B 14 2.209 -5.334 -3.505 1.00 0.00 C ATOM 2405 CG1 ILE B 14 2.396 -6.490 -2.508 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.060 -5.868 -4.940 1.00 0.00 C ATOM 2407 CD1 ILE B 14 1.189 -7.409 -2.327 1.00 0.00 C ATOM 0 H ILE B 14 2.575 -3.964 -1.427 1.00 0.00 H new ATOM 0 HA ILE B 14 4.206 -4.838 -3.441 1.00 0.00 H new ATOM 0 HB ILE B 14 1.274 -4.824 -3.272 1.00 0.00 H new ATOM 0 HG12 ILE B 14 3.243 -7.093 -2.834 1.00 0.00 H new ATOM 0 HG13 ILE B 14 2.658 -6.070 -1.537 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.273 -6.622 -4.968 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.800 -5.047 -5.608 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.001 -6.314 -5.262 1.00 0.00 H new ATOM 0 HD11 ILE B 14 1.430 -8.188 -1.603 1.00 0.00 H new ATOM 0 HD12 ILE B 14 0.340 -6.828 -1.966 1.00 0.00 H new ATOM 0 HD13 ILE B 14 0.934 -7.868 -3.282 1.00 0.00 H new ATOM 2419 N GLY B 15 2.360 -2.210 -4.285 1.00 0.00 N ATOM 2420 CA GLY B 15 2.064 -1.200 -5.253 1.00 0.00 C ATOM 2421 C GLY B 15 3.108 -0.144 -5.378 1.00 0.00 C ATOM 2422 O GLY B 15 3.079 0.571 -6.378 1.00 0.00 O ATOM 0 H GLY B 15 1.851 -2.058 -3.414 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.926 -1.674 -6.225 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.117 -0.729 -4.991 1.00 0.00 H new ATOM 2426 N ARG B 16 4.047 -0.017 -4.422 1.00 0.00 N ATOM 2427 CA ARG B 16 5.252 0.746 -4.524 1.00 0.00 C ATOM 2428 C ARG B 16 6.266 -0.022 -5.299 1.00 0.00 C ATOM 2429 O ARG B 16 7.104 0.436 -6.074 1.00 0.00 O ATOM 2430 CB ARG B 16 5.744 1.312 -3.181 1.00 0.00 C ATOM 2431 CG ARG B 16 4.900 2.468 -2.643 1.00 0.00 C ATOM 2432 CD ARG B 16 5.662 3.685 -2.114 1.00 0.00 C ATOM 2433 NE ARG B 16 6.396 4.243 -3.285 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.785 4.704 -4.415 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.446 4.954 -4.491 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.501 4.915 -5.558 1.00 0.00 N ATOM 0 H ARG B 16 3.957 -0.479 -3.517 1.00 0.00 H new ATOM 0 HA ARG B 16 5.042 1.654 -5.089 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.754 0.510 -2.443 1.00 0.00 H new ATOM 0 HB3 ARG B 16 6.773 1.651 -3.297 1.00 0.00 H new ATOM 0 HG2 ARG B 16 4.234 2.802 -3.438 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.270 2.085 -1.840 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.978 4.422 -1.693 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.352 3.400 -1.320 1.00 0.00 H new ATOM 0 HE ARG B 16 7.414 4.283 -3.239 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.851 4.797 -3.678 1.00 0.00 H new ATOM 0 HH12 ARG B 16 4.040 5.298 -5.361 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.504 4.728 -5.574 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.033 5.260 -6.396 1.00 0.00 H new ATOM 2450 N LEU B 17 6.307 -1.326 -4.971 1.00 0.00 N ATOM 2451 CA LEU B 17 7.306 -2.188 -5.519 1.00 0.00 C ATOM 2452 C LEU B 17 7.143 -2.437 -6.979 1.00 0.00 C ATOM 2453 O LEU B 17 8.068 -2.682 -7.752 1.00 0.00 O ATOM 2454 CB LEU B 17 7.251 -3.547 -4.801 1.00 0.00 C ATOM 2455 CG LEU B 17 7.878 -3.588 -3.397 1.00 0.00 C ATOM 2456 CD1 LEU B 17 7.381 -4.849 -2.671 1.00 0.00 C ATOM 2457 CD2 LEU B 17 9.411 -3.569 -3.517 1.00 0.00 C ATOM 0 H LEU B 17 5.654 -1.780 -4.332 1.00 0.00 H new ATOM 0 HA LEU B 17 8.260 -1.682 -5.373 1.00 0.00 H new ATOM 0 HB2 LEU B 17 6.208 -3.853 -4.722 1.00 0.00 H new ATOM 0 HB3 LEU B 17 7.753 -4.287 -5.424 1.00 0.00 H new ATOM 0 HG LEU B 17 7.580 -2.714 -2.817 1.00 0.00 H new ATOM 0 HD11 LEU B 17 7.818 -4.891 -1.673 1.00 0.00 H new ATOM 0 HD12 LEU B 17 6.294 -4.818 -2.590 1.00 0.00 H new ATOM 0 HD13 LEU B 17 7.677 -5.734 -3.234 1.00 0.00 H new ATOM 0 HD21 LEU B 17 9.854 -3.598 -2.522 1.00 0.00 H new ATOM 0 HD22 LEU B 17 9.742 -4.437 -4.087 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.725 -2.658 -4.027 1.00 0.00 H new ATOM 2469 N SER B 18 5.917 -2.268 -7.504 1.00 0.00 N ATOM 2470 CA SER B 18 5.624 -2.508 -8.883 1.00 0.00 C ATOM 2471 C SER B 18 6.205 -1.477 -9.788 1.00 0.00 C ATOM 2472 O SER B 18 5.649 -0.395 -9.969 1.00 0.00 O ATOM 2473 CB SER B 18 4.122 -2.791 -9.054 1.00 0.00 C ATOM 2474 OG SER B 18 3.889 -3.376 -10.326 1.00 0.00 O ATOM 0 H SER B 18 5.112 -1.958 -6.959 1.00 0.00 H new ATOM 0 HA SER B 18 6.135 -3.413 -9.212 1.00 0.00 H new ATOM 0 HB2 SER B 18 3.776 -3.460 -8.266 1.00 0.00 H new ATOM 0 HB3 SER B 18 3.554 -1.865 -8.959 1.00 0.00 H new ATOM 0 HG SER B 18 3.025 -3.070 -10.673 1.00 0.00 H new ATOM 2480 N SER B 19 7.352 -1.802 -10.412 1.00 0.00 N ATOM 2481 CA SER B 19 7.868 -1.228 -11.616 1.00 0.00 C ATOM 2482 C SER B 19 7.029 -1.576 -12.837 1.00 0.00 C ATOM 2483 O SER B 19 6.913 -2.803 -13.097 1.00 0.00 O ATOM 2484 CB SER B 19 9.331 -1.636 -11.858 1.00 0.00 C ATOM 2485 OG SER B 19 10.145 -0.992 -10.889 1.00 0.00 O ATOM 2486 OXT SER B 19 6.495 -0.675 -13.538 1.00 0.00 O ATOM 0 H SER B 19 7.968 -2.526 -10.042 1.00 0.00 H new ATOM 0 HA SER B 19 7.821 -0.148 -11.474 1.00 0.00 H new ATOM 0 HB2 SER B 19 9.439 -2.718 -11.785 1.00 0.00 H new ATOM 0 HB3 SER B 19 9.642 -1.352 -12.863 1.00 0.00 H new ATOM 0 HG SER B 19 11.082 -1.244 -11.029 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 13.367 -13.905 5.620 1.00 0.00 CA HETATM 2494 CA CA A 152 19.043 -3.851 2.846 1.00 0.00 CA HETATM 2495 CA CA A 153 -12.936 -7.844 -10.855 1.00 0.00 CA HETATM 2496 CA CA A 154 -19.162 -1.358 -2.173 1.00 0.00 CA