USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 747 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 124 LYS NZ :NH3+ -130:sc= -0.246 (180deg=-3.67!) USER MOD Set 1.2: B 126 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 73 GLN : amide:sc= -1.08 K(o=-1.5,f=-4.3!) USER MOD Set 2.2: A 143 MET CE :methyl 151:sc= -0.458 (180deg=-1.91!) USER MOD Set 3.1: A 121 ASN : amide:sc= -0.0597 K(o=-0.13,f=-0.99) USER MOD Set 3.2: A 137 MET CE :methyl -178:sc= -0.0742 (180deg=-0.0821) USER MOD Set 4.1: A 101 HIS : no HD1:sc=-0.000775 X(o=-1.6,f=-1.9) USER MOD Set 4.2: A 106 HIS : no HD1:sc= -1.62 K(o=-1.6,f=-0.89) USER MOD Single : A 76 LYS NZ :NH3+ -112:sc= -0.264 (180deg=-1.07) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.0163 USER MOD Single : A 82 MET CE :methyl -116:sc= -0.0471 (180deg=-3.77!) USER MOD Single : A 87 LYS NZ :NH3+ -161:sc= -0.0107 (180deg=-0.843) USER MOD Single : A 89 ASN : amide:sc=-0.00722 X(o=-0.0072,f=-0.25) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 SER OG : rot 39:sc= 0.414 USER MOD Single : A 94 CYS SG : rot 7:sc= -3.73! USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl -151:sc= -1.92 (180deg=-4.76!) USER MOD Single : A 108 GLN : amide:sc= -1.2 K(o=-1.2,f=-0.31) USER MOD Single : A 110 SER OG : rot 180:sc= 0.00719 USER MOD Single : A 112 HIS : no HE2:sc= -0.0367 X(o=-0.037,f=-0.45) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.863 X(o=-0.86,f=-0.42) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= 0.0244 X(o=0.024,f=0) USER MOD Single : A 128 HIS : no HD1:sc= -0.194 X(o=-0.19,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 GLN : amide:sc= -1.48 X(o=-1.5,f=-1.9) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.00226) USER MOD Single : A 145 SER OG : rot 43:sc= 0.308 USER MOD Single : A 147 LYS NZ :NH3+ 157:sc= 1.08 (180deg=0.472) USER MOD Single : A 151 ASN : amide:sc= 0.147 K(o=0.15,f=-2.7!) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 GLN : amide:sc=-0.00195 X(o=-0.0019,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 69 7.347 13.666 3.102 1.00 0.00 N ATOM 2 CA VAL A 69 7.246 12.250 3.546 1.00 0.00 C ATOM 3 C VAL A 69 6.613 12.148 4.931 1.00 0.00 C ATOM 4 O VAL A 69 7.180 12.611 5.921 1.00 0.00 O ATOM 5 CB VAL A 69 8.631 11.569 3.571 1.00 0.00 C ATOM 6 CG1 VAL A 69 9.547 12.237 4.589 1.00 0.00 C ATOM 7 CG2 VAL A 69 8.489 10.082 3.862 1.00 0.00 C ATOM 0 HA VAL A 69 6.610 11.737 2.824 1.00 0.00 H new ATOM 0 HB VAL A 69 9.086 11.683 2.587 1.00 0.00 H new ATOM 0 HG11 VAL A 69 10.517 11.739 4.588 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.678 13.287 4.327 1.00 0.00 H new ATOM 0 HG13 VAL A 69 9.103 12.163 5.582 1.00 0.00 H new ATOM 0 HG21 VAL A 69 9.475 9.618 3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.010 9.945 4.831 1.00 0.00 H new ATOM 0 HG23 VAL A 69 7.880 9.616 3.087 1.00 0.00 H new ATOM 17 N ARG A 70 5.435 11.539 4.992 1.00 0.00 N ATOM 18 CA ARG A 70 4.724 11.374 6.254 1.00 0.00 C ATOM 19 C ARG A 70 4.495 9.897 6.557 1.00 0.00 C ATOM 20 O ARG A 70 4.271 9.094 5.650 1.00 0.00 O ATOM 21 CB ARG A 70 3.385 12.112 6.212 1.00 0.00 C ATOM 22 CG ARG A 70 2.421 11.565 5.172 1.00 0.00 C ATOM 23 CD ARG A 70 0.987 11.582 5.678 1.00 0.00 C ATOM 24 NE ARG A 70 0.585 12.909 6.139 1.00 0.00 N ATOM 25 CZ ARG A 70 0.219 13.897 5.326 1.00 0.00 C ATOM 26 NH1 ARG A 70 0.204 13.713 4.011 1.00 0.00 N ATOM 27 NH2 ARG A 70 -0.133 15.073 5.828 1.00 0.00 N ATOM 0 H ARG A 70 4.952 11.151 4.182 1.00 0.00 H new ATOM 0 HA ARG A 70 5.338 11.800 7.047 1.00 0.00 H new ATOM 0 HB2 ARG A 70 2.917 12.055 7.195 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.567 13.167 6.007 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.493 12.158 4.260 1.00 0.00 H new ATOM 0 HG3 ARG A 70 2.704 10.545 4.913 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.318 11.257 4.882 1.00 0.00 H new ATOM 0 HD3 ARG A 70 0.882 10.867 6.494 1.00 0.00 H new ATOM 0 HE ARG A 70 0.585 13.089 7.143 1.00 0.00 H new ATOM 0 HH11 ARG A 70 0.474 12.811 3.619 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -0.077 14.474 3.393 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -0.123 15.220 6.837 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -0.413 15.830 5.205 1.00 0.00 H new ATOM 41 N LEU A 71 4.553 9.545 7.837 1.00 0.00 N ATOM 42 CA LEU A 71 4.352 8.165 8.258 1.00 0.00 C ATOM 43 C LEU A 71 2.893 7.911 8.614 1.00 0.00 C ATOM 44 O LEU A 71 2.447 8.229 9.717 1.00 0.00 O ATOM 45 CB LEU A 71 5.245 7.840 9.456 1.00 0.00 C ATOM 46 CG LEU A 71 5.314 6.358 9.830 1.00 0.00 C ATOM 47 CD1 LEU A 71 6.447 5.671 9.082 1.00 0.00 C ATOM 48 CD2 LEU A 71 5.489 6.195 11.332 1.00 0.00 C ATOM 0 H LEU A 71 4.737 10.197 8.600 1.00 0.00 H new ATOM 0 HA LEU A 71 4.622 7.515 7.425 1.00 0.00 H new ATOM 0 HB2 LEU A 71 6.254 8.193 9.244 1.00 0.00 H new ATOM 0 HB3 LEU A 71 4.887 8.401 10.319 1.00 0.00 H new ATOM 0 HG LEU A 71 4.375 5.886 9.540 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.481 4.618 9.361 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.279 5.757 8.008 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.394 6.145 9.340 1.00 0.00 H new ATOM 0 HD21 LEU A 71 5.536 5.135 11.580 1.00 0.00 H new ATOM 0 HD22 LEU A 71 6.412 6.682 11.646 1.00 0.00 H new ATOM 0 HD23 LEU A 71 4.644 6.651 11.848 1.00 0.00 H new ATOM 60 N ILE A 72 2.155 7.326 7.677 1.00 0.00 N ATOM 61 CA ILE A 72 0.749 7.016 7.895 1.00 0.00 C ATOM 62 C ILE A 72 0.601 5.607 8.451 1.00 0.00 C ATOM 63 O ILE A 72 1.378 4.717 8.113 1.00 0.00 O ATOM 64 CB ILE A 72 -0.065 7.135 6.593 1.00 0.00 C ATOM 65 CG1 ILE A 72 0.215 8.475 5.910 1.00 0.00 C ATOM 66 CG2 ILE A 72 -1.551 6.981 6.881 1.00 0.00 C ATOM 67 CD1 ILE A 72 -0.299 8.548 4.488 1.00 0.00 C ATOM 0 H ILE A 72 2.509 7.057 6.759 1.00 0.00 H new ATOM 0 HA ILE A 72 0.362 7.740 8.612 1.00 0.00 H new ATOM 0 HB ILE A 72 0.239 6.335 5.918 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -0.242 9.274 6.494 1.00 0.00 H new ATOM 0 HG13 ILE A 72 1.290 8.655 5.909 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.113 7.068 5.951 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.736 6.004 7.327 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.871 7.761 7.572 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.065 9.526 4.066 1.00 0.00 H new ATOM 0 HD12 ILE A 72 0.177 7.771 3.889 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.379 8.400 4.483 1.00 0.00 H new ATOM 79 N GLN A 73 -0.389 5.406 9.311 1.00 0.00 N ATOM 80 CA GLN A 73 -0.608 4.096 9.908 1.00 0.00 C ATOM 81 C GLN A 73 -2.092 3.800 10.083 1.00 0.00 C ATOM 82 O GLN A 73 -2.825 4.575 10.696 1.00 0.00 O ATOM 83 CB GLN A 73 0.100 4.003 11.262 1.00 0.00 C ATOM 84 CG GLN A 73 1.473 4.654 11.281 1.00 0.00 C ATOM 85 CD GLN A 73 2.132 4.580 12.645 1.00 0.00 C ATOM 86 OE1 GLN A 73 3.270 4.128 12.774 1.00 0.00 O ATOM 87 NE2 GLN A 73 1.418 5.028 13.672 1.00 0.00 N ATOM 0 H GLN A 73 -1.047 6.126 9.608 1.00 0.00 H new ATOM 0 HA GLN A 73 -0.191 3.353 9.228 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -0.525 4.472 12.022 1.00 0.00 H new ATOM 0 HB3 GLN A 73 0.202 2.953 11.537 1.00 0.00 H new ATOM 0 HG2 GLN A 73 2.113 4.167 10.545 1.00 0.00 H new ATOM 0 HG3 GLN A 73 1.381 5.698 10.982 1.00 0.00 H new ATOM 0 HE21 GLN A 73 0.478 5.394 13.519 1.00 0.00 H new ATOM 0 HE22 GLN A 73 1.809 5.006 14.614 1.00 0.00 H new ATOM 96 N PHE A 74 -2.521 2.660 9.552 1.00 0.00 N ATOM 97 CA PHE A 74 -3.913 2.241 9.658 1.00 0.00 C ATOM 98 C PHE A 74 -4.005 0.934 10.436 1.00 0.00 C ATOM 99 O PHE A 74 -3.243 -0.001 10.189 1.00 0.00 O ATOM 100 CB PHE A 74 -4.538 2.074 8.271 1.00 0.00 C ATOM 101 CG PHE A 74 -3.614 1.456 7.260 1.00 0.00 C ATOM 102 CD1 PHE A 74 -3.328 0.101 7.301 1.00 0.00 C ATOM 103 CD2 PHE A 74 -3.033 2.231 6.269 1.00 0.00 C ATOM 104 CE1 PHE A 74 -2.480 -0.471 6.372 1.00 0.00 C ATOM 105 CE2 PHE A 74 -2.184 1.665 5.338 1.00 0.00 C ATOM 106 CZ PHE A 74 -1.907 0.313 5.389 1.00 0.00 C ATOM 0 H PHE A 74 -1.923 2.009 9.043 1.00 0.00 H new ATOM 0 HA PHE A 74 -4.466 3.014 10.191 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -5.432 1.457 8.358 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -4.859 3.050 7.907 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -3.773 -0.515 8.068 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -3.246 3.289 6.224 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -2.266 -1.529 6.414 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -1.737 2.279 4.571 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.243 -0.131 4.662 1.00 0.00 H new ATOM 116 N GLU A 75 -4.930 0.878 11.387 1.00 0.00 N ATOM 117 CA GLU A 75 -5.102 -0.314 12.208 1.00 0.00 C ATOM 118 C GLU A 75 -5.907 -1.382 11.476 1.00 0.00 C ATOM 119 O GLU A 75 -6.943 -1.094 10.877 1.00 0.00 O ATOM 120 CB GLU A 75 -5.789 0.045 13.527 1.00 0.00 C ATOM 121 CG GLU A 75 -7.051 0.874 13.349 1.00 0.00 C ATOM 122 CD GLU A 75 -6.822 2.349 13.616 1.00 0.00 C ATOM 123 OE1 GLU A 75 -5.669 2.806 13.473 1.00 0.00 O ATOM 124 OE2 GLU A 75 -7.796 3.046 13.969 1.00 0.00 O ATOM 0 H GLU A 75 -5.570 1.641 11.608 1.00 0.00 H new ATOM 0 HA GLU A 75 -4.112 -0.720 12.417 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -6.039 -0.873 14.059 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.088 0.596 14.154 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -7.425 0.746 12.333 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -7.823 0.502 14.022 1.00 0.00 H new ATOM 131 N LYS A 76 -5.421 -2.618 11.536 1.00 0.00 N ATOM 132 CA LYS A 76 -6.086 -3.740 10.887 1.00 0.00 C ATOM 133 C LYS A 76 -6.273 -4.893 11.868 1.00 0.00 C ATOM 134 O LYS A 76 -5.305 -5.527 12.287 1.00 0.00 O ATOM 135 CB LYS A 76 -5.278 -4.209 9.676 1.00 0.00 C ATOM 136 CG LYS A 76 -5.683 -3.533 8.375 1.00 0.00 C ATOM 137 CD LYS A 76 -5.692 -4.515 7.213 1.00 0.00 C ATOM 138 CE LYS A 76 -7.108 -4.820 6.751 1.00 0.00 C ATOM 139 NZ LYS A 76 -7.659 -6.037 7.411 1.00 0.00 N ATOM 0 H LYS A 76 -4.564 -2.867 12.030 1.00 0.00 H new ATOM 0 HA LYS A 76 -7.067 -3.407 10.549 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.220 -4.020 9.860 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.395 -5.287 9.567 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -6.673 -3.091 8.487 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.993 -2.718 8.158 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -5.118 -4.103 6.383 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -5.199 -5.440 7.513 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -7.752 -3.967 6.967 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -7.115 -4.959 5.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -7.771 -6.794 6.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -7.007 -6.353 8.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -8.584 -5.815 7.831 1.00 0.00 H new ATOM 153 N VAL A 77 -7.523 -5.156 12.231 1.00 0.00 N ATOM 154 CA VAL A 77 -7.836 -6.230 13.165 1.00 0.00 C ATOM 155 C VAL A 77 -8.246 -7.499 12.424 1.00 0.00 C ATOM 156 O VAL A 77 -7.969 -8.611 12.875 1.00 0.00 O ATOM 157 CB VAL A 77 -8.959 -5.803 14.146 1.00 0.00 C ATOM 158 CG1 VAL A 77 -10.228 -6.630 13.951 1.00 0.00 C ATOM 159 CG2 VAL A 77 -8.471 -5.899 15.584 1.00 0.00 C ATOM 0 H VAL A 77 -8.336 -4.640 11.893 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.933 -6.439 13.739 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.211 -4.765 13.928 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -10.990 -6.300 14.657 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -10.595 -6.498 12.933 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -10.006 -7.683 14.123 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.270 -5.596 16.260 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.181 -6.927 15.802 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.612 -5.243 15.721 1.00 0.00 H new ATOM 169 N THR A 78 -8.916 -7.323 11.292 1.00 0.00 N ATOM 170 CA THR A 78 -9.375 -8.450 10.493 1.00 0.00 C ATOM 171 C THR A 78 -8.331 -8.854 9.461 1.00 0.00 C ATOM 172 O THR A 78 -7.500 -8.043 9.050 1.00 0.00 O ATOM 173 CB THR A 78 -10.691 -8.106 9.796 1.00 0.00 C ATOM 174 OG1 THR A 78 -11.171 -6.840 10.218 1.00 0.00 O ATOM 175 CG2 THR A 78 -11.780 -9.118 10.057 1.00 0.00 C ATOM 0 H THR A 78 -9.153 -6.409 10.907 1.00 0.00 H new ATOM 0 HA THR A 78 -9.536 -9.293 11.165 1.00 0.00 H new ATOM 0 HB THR A 78 -10.462 -8.103 8.730 1.00 0.00 H new ATOM 0 HG1 THR A 78 -12.013 -6.639 9.758 1.00 0.00 H new ATOM 0 HG21 THR A 78 -12.689 -8.818 9.535 1.00 0.00 H new ATOM 0 HG22 THR A 78 -11.461 -10.096 9.697 1.00 0.00 H new ATOM 0 HG23 THR A 78 -11.978 -9.172 11.128 1.00 0.00 H new ATOM 183 N GLU A 79 -8.385 -10.112 9.037 1.00 0.00 N ATOM 184 CA GLU A 79 -7.449 -10.619 8.045 1.00 0.00 C ATOM 185 C GLU A 79 -8.047 -10.533 6.655 1.00 0.00 C ATOM 186 O GLU A 79 -8.765 -11.429 6.212 1.00 0.00 O ATOM 187 CB GLU A 79 -7.051 -12.062 8.365 1.00 0.00 C ATOM 188 CG GLU A 79 -8.239 -12.980 8.602 1.00 0.00 C ATOM 189 CD GLU A 79 -8.539 -13.177 10.076 1.00 0.00 C ATOM 190 OE1 GLU A 79 -7.588 -13.418 10.848 1.00 0.00 O ATOM 191 OE2 GLU A 79 -9.725 -13.090 10.457 1.00 0.00 O ATOM 0 H GLU A 79 -9.066 -10.797 9.365 1.00 0.00 H new ATOM 0 HA GLU A 79 -6.553 -10.000 8.075 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -6.455 -12.457 7.542 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -6.415 -12.067 9.250 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.118 -12.565 8.108 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -8.042 -13.949 8.142 1.00 0.00 H new ATOM 198 N GLU A 80 -7.759 -9.430 5.980 1.00 0.00 N ATOM 199 CA GLU A 80 -8.276 -9.197 4.647 1.00 0.00 C ATOM 200 C GLU A 80 -7.559 -8.026 3.978 1.00 0.00 C ATOM 201 O GLU A 80 -6.879 -7.244 4.643 1.00 0.00 O ATOM 202 CB GLU A 80 -9.770 -8.921 4.748 1.00 0.00 C ATOM 203 CG GLU A 80 -10.627 -9.960 4.049 1.00 0.00 C ATOM 204 CD GLU A 80 -11.935 -9.388 3.537 1.00 0.00 C ATOM 205 OE1 GLU A 80 -12.856 -9.188 4.357 1.00 0.00 O ATOM 206 OE2 GLU A 80 -12.039 -9.141 2.318 1.00 0.00 O ATOM 0 H GLU A 80 -7.167 -8.681 6.339 1.00 0.00 H new ATOM 0 HA GLU A 80 -8.102 -10.080 4.032 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -10.053 -8.877 5.800 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -9.980 -7.941 4.320 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -10.069 -10.384 3.214 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -10.837 -10.777 4.740 1.00 0.00 H new ATOM 213 N PRO A 81 -7.702 -7.889 2.649 1.00 0.00 N ATOM 214 CA PRO A 81 -7.063 -6.806 1.893 1.00 0.00 C ATOM 215 C PRO A 81 -7.354 -5.433 2.491 1.00 0.00 C ATOM 216 O PRO A 81 -8.466 -5.167 2.947 1.00 0.00 O ATOM 217 CB PRO A 81 -7.687 -6.927 0.502 1.00 0.00 C ATOM 218 CG PRO A 81 -8.095 -8.355 0.392 1.00 0.00 C ATOM 219 CD PRO A 81 -8.495 -8.778 1.778 1.00 0.00 C ATOM 0 HA PRO A 81 -5.976 -6.893 1.895 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -8.543 -6.261 0.393 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -6.973 -6.658 -0.277 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -8.924 -8.472 -0.306 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -7.275 -8.968 0.018 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -9.565 -8.652 1.943 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -8.265 -9.828 1.960 1.00 0.00 H new ATOM 227 N MET A 82 -6.347 -4.565 2.485 1.00 0.00 N ATOM 228 CA MET A 82 -6.494 -3.217 3.026 1.00 0.00 C ATOM 229 C MET A 82 -7.650 -2.484 2.352 1.00 0.00 C ATOM 230 O MET A 82 -8.571 -2.013 3.020 1.00 0.00 O ATOM 231 CB MET A 82 -5.196 -2.427 2.844 1.00 0.00 C ATOM 232 CG MET A 82 -4.344 -2.359 4.102 1.00 0.00 C ATOM 233 SD MET A 82 -2.829 -3.329 3.972 1.00 0.00 S ATOM 234 CE MET A 82 -1.775 -2.192 3.073 1.00 0.00 C ATOM 0 H MET A 82 -5.420 -4.770 2.112 1.00 0.00 H new ATOM 0 HA MET A 82 -6.713 -3.301 4.091 1.00 0.00 H new ATOM 0 HB2 MET A 82 -4.612 -2.882 2.044 1.00 0.00 H new ATOM 0 HB3 MET A 82 -5.439 -1.414 2.524 1.00 0.00 H new ATOM 0 HG2 MET A 82 -4.088 -1.319 4.306 1.00 0.00 H new ATOM 0 HG3 MET A 82 -4.927 -2.716 4.950 1.00 0.00 H new ATOM 0 HE1 MET A 82 -1.523 -2.619 2.102 1.00 0.00 H new ATOM 0 HE2 MET A 82 -2.299 -1.247 2.929 1.00 0.00 H new ATOM 0 HE3 MET A 82 -0.861 -2.017 3.640 1.00 0.00 H new ATOM 244 N GLY A 83 -7.598 -2.390 1.027 1.00 0.00 N ATOM 245 CA GLY A 83 -8.651 -1.713 0.293 1.00 0.00 C ATOM 246 C GLY A 83 -8.148 -1.019 -0.961 1.00 0.00 C ATOM 247 O GLY A 83 -8.937 -0.678 -1.842 1.00 0.00 O ATOM 0 H GLY A 83 -6.847 -2.770 0.450 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -9.418 -2.437 0.018 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -9.125 -0.978 0.943 1.00 0.00 H new ATOM 251 N ILE A 84 -6.838 -0.806 -1.044 1.00 0.00 N ATOM 252 CA ILE A 84 -6.248 -0.145 -2.202 1.00 0.00 C ATOM 253 C ILE A 84 -5.312 -1.084 -2.955 1.00 0.00 C ATOM 254 O ILE A 84 -4.994 -2.173 -2.477 1.00 0.00 O ATOM 255 CB ILE A 84 -5.467 1.118 -1.792 1.00 0.00 C ATOM 256 CG1 ILE A 84 -4.384 0.767 -0.770 1.00 0.00 C ATOM 257 CG2 ILE A 84 -6.415 2.166 -1.228 1.00 0.00 C ATOM 258 CD1 ILE A 84 -3.164 1.659 -0.852 1.00 0.00 C ATOM 0 H ILE A 84 -6.168 -1.081 -0.326 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.073 0.142 -2.854 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.983 1.531 -2.677 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -4.806 0.834 0.233 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -4.078 -0.269 -0.918 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -5.849 3.053 -0.943 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -7.153 2.434 -1.984 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -6.924 1.763 -0.352 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.438 1.353 -0.099 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.717 1.574 -1.843 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.457 2.694 -0.674 1.00 0.00 H new ATOM 270 N CYS A 85 -4.870 -0.653 -4.132 1.00 0.00 N ATOM 271 CA CYS A 85 -3.964 -1.455 -4.946 1.00 0.00 C ATOM 272 C CYS A 85 -2.791 -0.608 -5.425 1.00 0.00 C ATOM 273 O CYS A 85 -2.982 0.515 -5.889 1.00 0.00 O ATOM 274 CB CYS A 85 -4.707 -2.061 -6.141 1.00 0.00 C ATOM 275 SG CYS A 85 -6.363 -2.706 -5.736 1.00 0.00 S ATOM 0 H CYS A 85 -5.124 0.245 -4.543 1.00 0.00 H new ATOM 0 HA CYS A 85 -3.578 -2.269 -4.332 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -4.804 -1.303 -6.918 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -4.106 -2.869 -6.558 1.00 0.00 H new ATOM 280 N LEU A 86 -1.582 -1.151 -5.295 1.00 0.00 N ATOM 281 CA LEU A 86 -0.365 -0.451 -5.695 1.00 0.00 C ATOM 282 C LEU A 86 0.490 -1.310 -6.623 1.00 0.00 C ATOM 283 O LEU A 86 0.355 -2.533 -6.654 1.00 0.00 O ATOM 284 CB LEU A 86 0.453 -0.064 -4.460 1.00 0.00 C ATOM 285 CG LEU A 86 -0.368 0.343 -3.232 1.00 0.00 C ATOM 286 CD1 LEU A 86 -0.628 -0.860 -2.338 1.00 0.00 C ATOM 287 CD2 LEU A 86 0.345 1.442 -2.457 1.00 0.00 C ATOM 0 H LEU A 86 -1.420 -2.082 -4.912 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.662 0.449 -6.234 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.090 -0.906 -4.188 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.113 0.762 -4.726 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.329 0.729 -3.573 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -1.212 -0.550 -1.472 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -1.180 -1.616 -2.897 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.322 -1.277 -2.004 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -0.251 1.720 -1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.320 1.082 -2.128 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.478 2.313 -3.099 1.00 0.00 H new ATOM 299 N LYS A 87 1.375 -0.659 -7.375 1.00 0.00 N ATOM 300 CA LYS A 87 2.258 -1.360 -8.304 1.00 0.00 C ATOM 301 C LYS A 87 3.699 -0.873 -8.161 1.00 0.00 C ATOM 302 O LYS A 87 3.947 0.210 -7.633 1.00 0.00 O ATOM 303 CB LYS A 87 1.780 -1.154 -9.744 1.00 0.00 C ATOM 304 CG LYS A 87 1.976 0.265 -10.256 1.00 0.00 C ATOM 305 CD LYS A 87 1.296 0.470 -11.600 1.00 0.00 C ATOM 306 CE LYS A 87 1.147 1.947 -11.929 1.00 0.00 C ATOM 307 NZ LYS A 87 -0.221 2.449 -11.628 1.00 0.00 N ATOM 0 H LYS A 87 1.500 0.353 -7.359 1.00 0.00 H new ATOM 0 HA LYS A 87 2.228 -2.423 -8.064 1.00 0.00 H new ATOM 0 HB2 LYS A 87 2.315 -1.844 -10.397 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.723 -1.411 -9.807 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.574 0.973 -9.532 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.041 0.475 -10.350 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.876 -0.021 -12.381 1.00 0.00 H new ATOM 0 HD3 LYS A 87 0.314 -0.002 -11.588 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.878 2.521 -11.359 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.368 2.108 -12.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.387 3.336 -12.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -0.923 1.740 -11.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -0.310 2.623 -10.606 1.00 0.00 H new ATOM 321 N LEU A 88 4.645 -1.678 -8.644 1.00 0.00 N ATOM 322 CA LEU A 88 6.059 -1.328 -8.580 1.00 0.00 C ATOM 323 C LEU A 88 6.530 -0.772 -9.920 1.00 0.00 C ATOM 324 O LEU A 88 6.723 -1.518 -10.879 1.00 0.00 O ATOM 325 CB LEU A 88 6.907 -2.547 -8.196 1.00 0.00 C ATOM 326 CG LEU A 88 6.237 -3.558 -7.256 1.00 0.00 C ATOM 327 CD1 LEU A 88 5.410 -2.851 -6.192 1.00 0.00 C ATOM 328 CD2 LEU A 88 5.375 -4.528 -8.048 1.00 0.00 C ATOM 0 H LEU A 88 4.455 -2.578 -9.084 1.00 0.00 H new ATOM 0 HA LEU A 88 6.182 -0.563 -7.813 1.00 0.00 H new ATOM 0 HB2 LEU A 88 7.197 -3.066 -9.109 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.824 -2.194 -7.725 1.00 0.00 H new ATOM 0 HG LEU A 88 7.021 -4.123 -6.751 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.947 -3.591 -5.540 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.056 -2.201 -5.602 1.00 0.00 H new ATOM 0 HD13 LEU A 88 4.634 -2.254 -6.671 1.00 0.00 H new ATOM 0 HD21 LEU A 88 4.907 -5.238 -7.367 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.603 -3.975 -8.583 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.997 -5.067 -8.763 1.00 0.00 H new ATOM 340 N ASN A 89 6.711 0.543 -9.980 1.00 0.00 N ATOM 341 CA ASN A 89 7.155 1.196 -11.205 1.00 0.00 C ATOM 342 C ASN A 89 8.560 0.741 -11.587 1.00 0.00 C ATOM 343 O ASN A 89 9.196 -0.022 -10.860 1.00 0.00 O ATOM 344 CB ASN A 89 7.128 2.717 -11.035 1.00 0.00 C ATOM 345 CG ASN A 89 5.803 3.322 -11.454 1.00 0.00 C ATOM 346 OD1 ASN A 89 5.306 3.061 -12.549 1.00 0.00 O ATOM 347 ND2 ASN A 89 5.222 4.137 -10.580 1.00 0.00 N ATOM 0 H ASN A 89 6.557 1.176 -9.195 1.00 0.00 H new ATOM 0 HA ASN A 89 6.471 0.914 -12.006 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.325 2.967 -9.992 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.930 3.160 -11.626 1.00 0.00 H new ATOM 0 HD21 ASN A 89 4.328 4.574 -10.806 1.00 0.00 H new ATOM 0 HD22 ASN A 89 5.670 4.326 -9.683 1.00 0.00 H new ATOM 354 N GLU A 90 9.037 1.215 -12.735 1.00 0.00 N ATOM 355 CA GLU A 90 10.367 0.859 -13.219 1.00 0.00 C ATOM 356 C GLU A 90 11.434 1.144 -12.164 1.00 0.00 C ATOM 357 O GLU A 90 12.515 0.555 -12.188 1.00 0.00 O ATOM 358 CB GLU A 90 10.686 1.627 -14.503 1.00 0.00 C ATOM 359 CG GLU A 90 9.741 1.311 -15.650 1.00 0.00 C ATOM 360 CD GLU A 90 9.562 2.480 -16.599 1.00 0.00 C ATOM 361 OE1 GLU A 90 8.698 3.339 -16.326 1.00 0.00 O ATOM 362 OE2 GLU A 90 10.288 2.536 -17.614 1.00 0.00 O ATOM 0 H GLU A 90 8.522 1.847 -13.348 1.00 0.00 H new ATOM 0 HA GLU A 90 10.372 -0.211 -13.429 1.00 0.00 H new ATOM 0 HB2 GLU A 90 10.648 2.696 -14.296 1.00 0.00 H new ATOM 0 HB3 GLU A 90 11.706 1.398 -14.810 1.00 0.00 H new ATOM 0 HG2 GLU A 90 10.123 0.453 -16.204 1.00 0.00 H new ATOM 0 HG3 GLU A 90 8.770 1.023 -15.247 1.00 0.00 H new ATOM 369 N LYS A 91 11.124 2.047 -11.238 1.00 0.00 N ATOM 370 CA LYS A 91 12.061 2.401 -10.175 1.00 0.00 C ATOM 371 C LYS A 91 11.777 1.598 -8.907 1.00 0.00 C ATOM 372 O LYS A 91 12.242 1.952 -7.824 1.00 0.00 O ATOM 373 CB LYS A 91 12.006 3.905 -9.855 1.00 0.00 C ATOM 374 CG LYS A 91 10.981 4.693 -10.663 1.00 0.00 C ATOM 375 CD LYS A 91 11.339 4.730 -12.140 1.00 0.00 C ATOM 376 CE LYS A 91 10.862 6.018 -12.794 1.00 0.00 C ATOM 377 NZ LYS A 91 11.852 6.542 -13.775 1.00 0.00 N ATOM 0 H LYS A 91 10.235 2.546 -11.202 1.00 0.00 H new ATOM 0 HA LYS A 91 13.061 2.158 -10.534 1.00 0.00 H new ATOM 0 HB2 LYS A 91 11.785 4.029 -8.795 1.00 0.00 H new ATOM 0 HB3 LYS A 91 12.993 4.335 -10.027 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.996 4.244 -10.538 1.00 0.00 H new ATOM 0 HG3 LYS A 91 10.918 5.711 -10.278 1.00 0.00 H new ATOM 0 HD2 LYS A 91 12.419 4.639 -12.257 1.00 0.00 H new ATOM 0 HD3 LYS A 91 10.891 3.875 -12.646 1.00 0.00 H new ATOM 0 HE2 LYS A 91 9.912 5.839 -13.297 1.00 0.00 H new ATOM 0 HE3 LYS A 91 10.679 6.769 -12.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.490 7.420 -14.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 12.751 6.737 -13.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.007 5.836 -14.522 1.00 0.00 H new ATOM 391 N GLN A 92 11.009 0.519 -9.043 1.00 0.00 N ATOM 392 CA GLN A 92 10.666 -0.322 -7.900 1.00 0.00 C ATOM 393 C GLN A 92 10.095 0.520 -6.763 1.00 0.00 C ATOM 394 O GLN A 92 10.824 0.943 -5.866 1.00 0.00 O ATOM 395 CB GLN A 92 11.900 -1.085 -7.411 1.00 0.00 C ATOM 396 CG GLN A 92 12.722 -1.700 -8.533 1.00 0.00 C ATOM 397 CD GLN A 92 14.196 -1.359 -8.430 1.00 0.00 C ATOM 398 OE1 GLN A 92 14.849 -1.669 -7.434 1.00 0.00 O ATOM 399 NE2 GLN A 92 14.728 -0.715 -9.463 1.00 0.00 N ATOM 0 H GLN A 92 10.614 0.208 -9.930 1.00 0.00 H new ATOM 0 HA GLN A 92 9.908 -1.037 -8.220 1.00 0.00 H new ATOM 0 HB2 GLN A 92 12.533 -0.407 -6.839 1.00 0.00 H new ATOM 0 HB3 GLN A 92 11.582 -1.875 -6.730 1.00 0.00 H new ATOM 0 HG2 GLN A 92 12.601 -2.783 -8.515 1.00 0.00 H new ATOM 0 HG3 GLN A 92 12.338 -1.352 -9.492 1.00 0.00 H new ATOM 0 HE21 GLN A 92 14.149 -0.478 -10.269 1.00 0.00 H new ATOM 0 HE22 GLN A 92 15.715 -0.458 -9.450 1.00 0.00 H new ATOM 408 N SER A 93 8.790 0.764 -6.809 1.00 0.00 N ATOM 409 CA SER A 93 8.130 1.561 -5.782 1.00 0.00 C ATOM 410 C SER A 93 6.636 1.276 -5.767 1.00 0.00 C ATOM 411 O SER A 93 5.998 1.229 -6.817 1.00 0.00 O ATOM 412 CB SER A 93 8.377 3.051 -6.023 1.00 0.00 C ATOM 413 OG SER A 93 9.505 3.506 -5.297 1.00 0.00 O ATOM 0 H SER A 93 8.170 0.423 -7.544 1.00 0.00 H new ATOM 0 HA SER A 93 8.548 1.288 -4.813 1.00 0.00 H new ATOM 0 HB2 SER A 93 8.530 3.230 -7.087 1.00 0.00 H new ATOM 0 HB3 SER A 93 7.496 3.621 -5.727 1.00 0.00 H new ATOM 0 HG SER A 93 10.202 2.817 -5.310 1.00 0.00 H new ATOM 419 N CYS A 94 6.083 1.080 -4.579 1.00 0.00 N ATOM 420 CA CYS A 94 4.663 0.784 -4.449 1.00 0.00 C ATOM 421 C CYS A 94 3.834 2.060 -4.357 1.00 0.00 C ATOM 422 O CYS A 94 3.946 2.823 -3.400 1.00 0.00 O ATOM 423 CB CYS A 94 4.414 -0.087 -3.217 1.00 0.00 C ATOM 424 SG CYS A 94 4.915 0.680 -1.659 1.00 0.00 S ATOM 0 H CYS A 94 6.592 1.120 -3.696 1.00 0.00 H new ATOM 0 HA CYS A 94 4.354 0.242 -5.343 1.00 0.00 H new ATOM 0 HB2 CYS A 94 3.353 -0.330 -3.165 1.00 0.00 H new ATOM 0 HB3 CYS A 94 4.951 -1.028 -3.336 1.00 0.00 H new ATOM 0 HG CYS A 94 5.269 1.912 -1.876 1.00 0.00 H new ATOM 430 N THR A 95 2.991 2.268 -5.363 1.00 0.00 N ATOM 431 CA THR A 95 2.117 3.431 -5.415 1.00 0.00 C ATOM 432 C THR A 95 0.699 2.969 -5.702 1.00 0.00 C ATOM 433 O THR A 95 0.483 2.174 -6.615 1.00 0.00 O ATOM 434 CB THR A 95 2.581 4.399 -6.502 1.00 0.00 C ATOM 435 OG1 THR A 95 3.987 4.558 -6.467 1.00 0.00 O ATOM 436 CG2 THR A 95 1.960 5.773 -6.390 1.00 0.00 C ATOM 0 H THR A 95 2.896 1.639 -6.160 1.00 0.00 H new ATOM 0 HA THR A 95 2.150 3.951 -4.457 1.00 0.00 H new ATOM 0 HB THR A 95 2.258 3.950 -7.441 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.263 5.180 -7.172 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.334 6.408 -7.193 1.00 0.00 H new ATOM 0 HG22 THR A 95 0.876 5.690 -6.468 1.00 0.00 H new ATOM 0 HG23 THR A 95 2.222 6.213 -5.428 1.00 0.00 H new ATOM 444 N VAL A 96 -0.268 3.440 -4.922 1.00 0.00 N ATOM 445 CA VAL A 96 -1.642 3.019 -5.129 1.00 0.00 C ATOM 446 C VAL A 96 -2.100 3.359 -6.539 1.00 0.00 C ATOM 447 O VAL A 96 -2.356 4.517 -6.868 1.00 0.00 O ATOM 448 CB VAL A 96 -2.607 3.635 -4.090 1.00 0.00 C ATOM 449 CG1 VAL A 96 -2.345 5.116 -3.899 1.00 0.00 C ATOM 450 CG2 VAL A 96 -4.059 3.384 -4.475 1.00 0.00 C ATOM 0 H VAL A 96 -0.128 4.100 -4.157 1.00 0.00 H new ATOM 0 HA VAL A 96 -1.667 1.937 -4.996 1.00 0.00 H new ATOM 0 HB VAL A 96 -2.420 3.141 -3.136 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.041 5.517 -3.162 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.323 5.263 -3.550 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.482 5.635 -4.848 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -4.716 3.828 -3.727 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -4.261 3.833 -5.447 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.241 2.311 -4.527 1.00 0.00 H new ATOM 460 N ALA A 97 -2.195 2.326 -7.367 1.00 0.00 N ATOM 461 CA ALA A 97 -2.618 2.484 -8.746 1.00 0.00 C ATOM 462 C ALA A 97 -4.098 2.829 -8.821 1.00 0.00 C ATOM 463 O ALA A 97 -4.557 3.444 -9.784 1.00 0.00 O ATOM 464 CB ALA A 97 -2.321 1.211 -9.523 1.00 0.00 C ATOM 0 H ALA A 97 -1.982 1.364 -7.101 1.00 0.00 H new ATOM 0 HA ALA A 97 -2.061 3.308 -9.193 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.640 1.334 -10.558 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -1.250 1.009 -9.495 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.860 0.377 -9.074 1.00 0.00 H new ATOM 470 N ARG A 98 -4.843 2.430 -7.794 1.00 0.00 N ATOM 471 CA ARG A 98 -6.273 2.700 -7.741 1.00 0.00 C ATOM 472 C ARG A 98 -6.857 2.284 -6.397 1.00 0.00 C ATOM 473 O ARG A 98 -6.626 1.170 -5.929 1.00 0.00 O ATOM 474 CB ARG A 98 -6.995 1.963 -8.870 1.00 0.00 C ATOM 475 CG ARG A 98 -6.507 0.538 -9.078 1.00 0.00 C ATOM 476 CD ARG A 98 -5.719 0.398 -10.371 1.00 0.00 C ATOM 477 NE ARG A 98 -6.433 0.969 -11.511 1.00 0.00 N ATOM 478 CZ ARG A 98 -7.419 0.349 -12.156 1.00 0.00 C ATOM 479 NH1 ARG A 98 -7.813 -0.860 -11.774 1.00 0.00 N ATOM 480 NH2 ARG A 98 -8.014 0.939 -13.183 1.00 0.00 N ATOM 0 H ARG A 98 -4.479 1.920 -6.989 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.417 3.773 -7.864 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.063 1.944 -8.655 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -6.866 2.521 -9.797 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -5.881 0.241 -8.236 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -7.360 -0.140 -9.096 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -4.754 0.893 -10.263 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -5.517 -0.656 -10.560 1.00 0.00 H new ATOM 0 HE ARG A 98 -6.160 1.898 -11.832 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -7.360 -1.318 -10.983 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -8.569 -1.331 -12.271 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -7.717 1.868 -13.480 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -8.769 0.464 -13.677 1.00 0.00 H new ATOM 494 N ILE A 99 -7.628 3.179 -5.787 1.00 0.00 N ATOM 495 CA ILE A 99 -8.253 2.888 -4.506 1.00 0.00 C ATOM 496 C ILE A 99 -9.580 2.168 -4.720 1.00 0.00 C ATOM 497 O ILE A 99 -10.423 2.623 -5.493 1.00 0.00 O ATOM 498 CB ILE A 99 -8.499 4.169 -3.683 1.00 0.00 C ATOM 499 CG1 ILE A 99 -7.187 4.932 -3.487 1.00 0.00 C ATOM 500 CG2 ILE A 99 -9.125 3.827 -2.335 1.00 0.00 C ATOM 501 CD1 ILE A 99 -7.320 6.152 -2.600 1.00 0.00 C ATOM 0 H ILE A 99 -7.833 4.107 -6.159 1.00 0.00 H new ATOM 0 HA ILE A 99 -7.567 2.250 -3.949 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.193 4.806 -4.231 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -6.446 4.259 -3.055 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -6.808 5.241 -4.461 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -9.291 4.743 -1.768 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -10.077 3.321 -2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -8.455 3.172 -1.778 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.351 6.642 -2.507 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.036 6.846 -3.040 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.669 5.848 -1.613 1.00 0.00 H new ATOM 513 N LEU A 100 -9.756 1.041 -4.044 1.00 0.00 N ATOM 514 CA LEU A 100 -10.981 0.259 -4.176 1.00 0.00 C ATOM 515 C LEU A 100 -12.031 0.703 -3.164 1.00 0.00 C ATOM 516 O LEU A 100 -11.703 1.104 -2.047 1.00 0.00 O ATOM 517 CB LEU A 100 -10.684 -1.232 -4.002 1.00 0.00 C ATOM 518 CG LEU A 100 -9.332 -1.697 -4.553 1.00 0.00 C ATOM 519 CD1 LEU A 100 -9.200 -3.208 -4.434 1.00 0.00 C ATOM 520 CD2 LEU A 100 -9.159 -1.253 -6.002 1.00 0.00 C ATOM 0 H LEU A 100 -9.070 0.647 -3.400 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.378 0.429 -5.177 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -10.728 -1.473 -2.940 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -11.473 -1.803 -4.491 1.00 0.00 H new ATOM 0 HG LEU A 100 -8.542 -1.236 -3.960 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -8.234 -3.521 -4.830 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -9.274 -3.498 -3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -9.997 -3.689 -5.001 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -8.193 -1.593 -6.374 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -9.954 -1.682 -6.612 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -9.207 -0.165 -6.057 1.00 0.00 H new ATOM 532 N HIS A 101 -13.296 0.629 -3.565 1.00 0.00 N ATOM 533 CA HIS A 101 -14.400 1.022 -2.697 1.00 0.00 C ATOM 534 C HIS A 101 -14.724 -0.084 -1.698 1.00 0.00 C ATOM 535 O HIS A 101 -14.593 -1.269 -2.004 1.00 0.00 O ATOM 536 CB HIS A 101 -15.640 1.352 -3.529 1.00 0.00 C ATOM 537 CG HIS A 101 -15.349 2.186 -4.737 1.00 0.00 C ATOM 538 ND1 HIS A 101 -14.418 3.204 -4.742 1.00 0.00 N ATOM 539 CD2 HIS A 101 -15.871 2.151 -5.986 1.00 0.00 C ATOM 540 CE1 HIS A 101 -14.380 3.758 -5.941 1.00 0.00 C ATOM 541 NE2 HIS A 101 -15.252 3.137 -6.713 1.00 0.00 N ATOM 0 H HIS A 101 -13.582 0.300 -4.487 1.00 0.00 H new ATOM 0 HA HIS A 101 -14.096 1.911 -2.144 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -16.112 0.422 -3.846 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -16.359 1.877 -2.900 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.632 1.474 -6.343 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -13.744 4.579 -6.238 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -15.436 3.355 -7.692 1.00 0.00 H new ATOM 550 N GLY A 102 -15.149 0.311 -0.502 1.00 0.00 N ATOM 551 CA GLY A 102 -15.486 -0.658 0.523 1.00 0.00 C ATOM 552 C GLY A 102 -14.338 -0.908 1.481 1.00 0.00 C ATOM 553 O GLY A 102 -14.553 -1.156 2.667 1.00 0.00 O ATOM 0 H GLY A 102 -15.266 1.286 -0.225 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -16.352 -0.305 1.082 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -15.773 -1.598 0.051 1.00 0.00 H new ATOM 557 N GLY A 103 -13.114 -0.843 0.966 1.00 0.00 N ATOM 558 CA GLY A 103 -11.946 -1.065 1.797 1.00 0.00 C ATOM 559 C GLY A 103 -11.866 -0.094 2.959 1.00 0.00 C ATOM 560 O GLY A 103 -12.646 0.854 3.039 1.00 0.00 O ATOM 0 H GLY A 103 -12.911 -0.640 -0.013 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -11.966 -2.085 2.181 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -11.047 -0.972 1.187 1.00 0.00 H new ATOM 564 N MET A 104 -10.921 -0.333 3.862 1.00 0.00 N ATOM 565 CA MET A 104 -10.742 0.527 5.027 1.00 0.00 C ATOM 566 C MET A 104 -10.109 1.858 4.633 1.00 0.00 C ATOM 567 O MET A 104 -10.333 2.878 5.283 1.00 0.00 O ATOM 568 CB MET A 104 -9.876 -0.173 6.075 1.00 0.00 C ATOM 569 CG MET A 104 -10.344 0.056 7.504 1.00 0.00 C ATOM 570 SD MET A 104 -9.393 1.332 8.351 1.00 0.00 S ATOM 571 CE MET A 104 -7.765 0.583 8.375 1.00 0.00 C ATOM 0 H MET A 104 -10.267 -1.114 3.810 1.00 0.00 H new ATOM 0 HA MET A 104 -11.725 0.727 5.452 1.00 0.00 H new ATOM 0 HB2 MET A 104 -9.868 -1.244 5.871 1.00 0.00 H new ATOM 0 HB3 MET A 104 -8.848 0.177 5.978 1.00 0.00 H new ATOM 0 HG2 MET A 104 -11.397 0.338 7.496 1.00 0.00 H new ATOM 0 HG3 MET A 104 -10.268 -0.878 8.061 1.00 0.00 H new ATOM 0 HE1 MET A 104 -7.214 0.938 9.246 1.00 0.00 H new ATOM 0 HE2 MET A 104 -7.864 -0.501 8.426 1.00 0.00 H new ATOM 0 HE3 MET A 104 -7.226 0.856 7.468 1.00 0.00 H new ATOM 581 N ILE A 105 -9.316 1.841 3.564 1.00 0.00 N ATOM 582 CA ILE A 105 -8.651 3.047 3.086 1.00 0.00 C ATOM 583 C ILE A 105 -9.635 3.975 2.383 1.00 0.00 C ATOM 584 O ILE A 105 -9.544 5.196 2.505 1.00 0.00 O ATOM 585 CB ILE A 105 -7.497 2.706 2.123 1.00 0.00 C ATOM 586 CG1 ILE A 105 -6.565 1.670 2.755 1.00 0.00 C ATOM 587 CG2 ILE A 105 -6.723 3.964 1.754 1.00 0.00 C ATOM 588 CD1 ILE A 105 -6.003 2.098 4.094 1.00 0.00 C ATOM 0 H ILE A 105 -9.119 1.005 3.014 1.00 0.00 H new ATOM 0 HA ILE A 105 -8.244 3.554 3.961 1.00 0.00 H new ATOM 0 HB ILE A 105 -7.919 2.282 1.212 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -7.108 0.734 2.881 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -5.740 1.470 2.071 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -5.912 3.706 1.074 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -7.392 4.674 1.268 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -6.310 4.415 2.656 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -5.352 1.315 4.482 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -5.431 3.018 3.971 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -6.821 2.270 4.794 1.00 0.00 H new ATOM 600 N HIS A 106 -10.576 3.390 1.650 1.00 0.00 N ATOM 601 CA HIS A 106 -11.579 4.171 0.933 1.00 0.00 C ATOM 602 C HIS A 106 -12.669 4.648 1.885 1.00 0.00 C ATOM 603 O HIS A 106 -13.016 5.829 1.907 1.00 0.00 O ATOM 604 CB HIS A 106 -12.196 3.344 -0.196 1.00 0.00 C ATOM 605 CG HIS A 106 -13.141 4.124 -1.058 1.00 0.00 C ATOM 606 ND1 HIS A 106 -12.721 5.033 -2.005 1.00 0.00 N ATOM 607 CD2 HIS A 106 -14.494 4.127 -1.109 1.00 0.00 C ATOM 608 CE1 HIS A 106 -13.773 5.562 -2.602 1.00 0.00 C ATOM 609 NE2 HIS A 106 -14.862 5.029 -2.078 1.00 0.00 N ATOM 0 H HIS A 106 -10.666 2.380 1.536 1.00 0.00 H new ATOM 0 HA HIS A 106 -11.086 5.042 0.501 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -11.398 2.940 -0.818 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -12.726 2.494 0.234 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -15.160 3.532 -0.502 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -13.747 6.305 -3.386 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -15.820 5.251 -2.349 1.00 0.00 H new ATOM 618 N ARG A 107 -13.204 3.722 2.675 1.00 0.00 N ATOM 619 CA ARG A 107 -14.252 4.049 3.633 1.00 0.00 C ATOM 620 C ARG A 107 -13.751 5.071 4.648 1.00 0.00 C ATOM 621 O ARG A 107 -14.447 6.034 4.970 1.00 0.00 O ATOM 622 CB ARG A 107 -14.727 2.786 4.354 1.00 0.00 C ATOM 623 CG ARG A 107 -16.225 2.763 4.616 1.00 0.00 C ATOM 624 CD ARG A 107 -16.953 1.851 3.638 1.00 0.00 C ATOM 625 NE ARG A 107 -17.920 2.584 2.825 1.00 0.00 N ATOM 626 CZ ARG A 107 -19.090 3.027 3.281 1.00 0.00 C ATOM 627 NH1 ARG A 107 -19.440 2.815 4.543 1.00 0.00 N ATOM 628 NH2 ARG A 107 -19.910 3.685 2.474 1.00 0.00 N ATOM 0 H ARG A 107 -12.928 2.740 2.670 1.00 0.00 H new ATOM 0 HA ARG A 107 -15.091 4.481 3.088 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -14.457 1.914 3.758 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -14.199 2.699 5.304 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -16.411 2.426 5.636 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -16.624 3.774 4.537 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -16.227 1.364 2.987 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -17.466 1.063 4.190 1.00 0.00 H new ATOM 0 HE ARG A 107 -17.685 2.768 1.850 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -18.812 2.311 5.169 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -20.337 3.156 4.888 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -19.645 3.852 1.503 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -20.806 4.024 2.824 1.00 0.00 H new ATOM 642 N GLN A 108 -12.537 4.856 5.144 1.00 0.00 N ATOM 643 CA GLN A 108 -11.937 5.760 6.119 1.00 0.00 C ATOM 644 C GLN A 108 -11.310 6.962 5.420 1.00 0.00 C ATOM 645 O GLN A 108 -11.514 8.105 5.826 1.00 0.00 O ATOM 646 CB GLN A 108 -10.880 5.028 6.946 1.00 0.00 C ATOM 647 CG GLN A 108 -10.381 5.826 8.138 1.00 0.00 C ATOM 648 CD GLN A 108 -10.131 4.960 9.357 1.00 0.00 C ATOM 649 OE1 GLN A 108 -10.898 4.987 10.321 1.00 0.00 O ATOM 650 NE2 GLN A 108 -9.054 4.185 9.321 1.00 0.00 N ATOM 0 H GLN A 108 -11.949 4.063 4.887 1.00 0.00 H new ATOM 0 HA GLN A 108 -12.724 6.113 6.786 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.296 4.085 7.299 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -10.034 4.782 6.304 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -9.459 6.339 7.866 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -11.112 6.595 8.387 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -8.446 4.194 8.502 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -8.834 3.580 10.112 1.00 0.00 H new ATOM 659 N GLY A 109 -10.545 6.693 4.368 1.00 0.00 N ATOM 660 CA GLY A 109 -9.899 7.761 3.628 1.00 0.00 C ATOM 661 C GLY A 109 -8.578 8.177 4.245 1.00 0.00 C ATOM 662 O GLY A 109 -8.461 9.271 4.797 1.00 0.00 O ATOM 0 H GLY A 109 -10.361 5.754 4.014 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -9.731 7.437 2.601 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -10.564 8.623 3.585 1.00 0.00 H new ATOM 666 N SER A 110 -7.583 7.303 4.151 1.00 0.00 N ATOM 667 CA SER A 110 -6.263 7.584 4.704 1.00 0.00 C ATOM 668 C SER A 110 -5.248 7.832 3.592 1.00 0.00 C ATOM 669 O SER A 110 -4.281 8.571 3.774 1.00 0.00 O ATOM 670 CB SER A 110 -5.799 6.424 5.585 1.00 0.00 C ATOM 671 OG SER A 110 -6.297 5.188 5.106 1.00 0.00 O ATOM 0 H SER A 110 -7.665 6.393 3.697 1.00 0.00 H new ATOM 0 HA SER A 110 -6.336 8.486 5.312 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.710 6.395 5.610 1.00 0.00 H new ATOM 0 HB3 SER A 110 -6.137 6.583 6.609 1.00 0.00 H new ATOM 0 HG SER A 110 -5.984 4.463 5.686 1.00 0.00 H new ATOM 677 N LEU A 111 -5.475 7.209 2.439 1.00 0.00 N ATOM 678 CA LEU A 111 -4.579 7.361 1.300 1.00 0.00 C ATOM 679 C LEU A 111 -5.337 7.854 0.072 1.00 0.00 C ATOM 680 O LEU A 111 -6.565 7.939 0.079 1.00 0.00 O ATOM 681 CB LEU A 111 -3.886 6.033 0.987 1.00 0.00 C ATOM 682 CG LEU A 111 -2.645 5.733 1.829 1.00 0.00 C ATOM 683 CD1 LEU A 111 -1.662 6.893 1.765 1.00 0.00 C ATOM 684 CD2 LEU A 111 -3.038 5.444 3.270 1.00 0.00 C ATOM 0 H LEU A 111 -6.272 6.595 2.270 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.825 8.103 1.561 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.604 5.225 1.126 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.601 6.029 -0.065 1.00 0.00 H new ATOM 0 HG LEU A 111 -2.157 4.848 1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.786 6.661 2.370 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.357 7.055 0.731 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.139 7.795 2.148 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.143 5.232 3.856 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.549 6.311 3.689 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.703 4.581 3.300 1.00 0.00 H new ATOM 696 N HIS A 112 -4.595 8.175 -0.983 1.00 0.00 N ATOM 697 CA HIS A 112 -5.194 8.658 -2.223 1.00 0.00 C ATOM 698 C HIS A 112 -4.566 7.971 -3.431 1.00 0.00 C ATOM 699 O HIS A 112 -3.350 7.789 -3.488 1.00 0.00 O ATOM 700 CB HIS A 112 -5.026 10.175 -2.343 1.00 0.00 C ATOM 701 CG HIS A 112 -5.233 10.908 -1.052 1.00 0.00 C ATOM 702 ND1 HIS A 112 -4.199 11.455 -0.323 1.00 0.00 N ATOM 703 CD2 HIS A 112 -6.366 11.184 -0.362 1.00 0.00 C ATOM 704 CE1 HIS A 112 -4.686 12.034 0.761 1.00 0.00 C ATOM 705 NE2 HIS A 112 -5.997 11.884 0.759 1.00 0.00 N ATOM 0 H HIS A 112 -3.577 8.109 -1.004 1.00 0.00 H new ATOM 0 HA HIS A 112 -6.257 8.419 -2.199 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -4.026 10.392 -2.718 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -5.732 10.553 -3.082 1.00 0.00 H new ATOM 0 HD1 HIS A 112 -3.213 11.419 -0.580 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -7.371 10.905 -0.642 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -4.109 12.543 1.519 1.00 0.00 H new ATOM 714 N VAL A 113 -5.400 7.592 -4.395 1.00 0.00 N ATOM 715 CA VAL A 113 -4.925 6.926 -5.604 1.00 0.00 C ATOM 716 C VAL A 113 -3.761 7.689 -6.231 1.00 0.00 C ATOM 717 O VAL A 113 -3.904 8.846 -6.624 1.00 0.00 O ATOM 718 CB VAL A 113 -6.051 6.780 -6.641 1.00 0.00 C ATOM 719 CG1 VAL A 113 -6.623 8.140 -6.975 1.00 0.00 C ATOM 720 CG2 VAL A 113 -5.548 6.078 -7.895 1.00 0.00 C ATOM 0 H VAL A 113 -6.409 7.735 -4.362 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.585 5.934 -5.308 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.842 6.164 -6.213 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -7.420 8.029 -7.710 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -7.024 8.598 -6.071 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -5.837 8.775 -7.385 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -6.363 5.987 -8.613 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.738 6.659 -8.337 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -5.182 5.085 -7.634 1.00 0.00 H new ATOM 730 N GLY A 114 -2.611 7.031 -6.322 1.00 0.00 N ATOM 731 CA GLY A 114 -1.443 7.666 -6.903 1.00 0.00 C ATOM 732 C GLY A 114 -0.389 8.019 -5.869 1.00 0.00 C ATOM 733 O GLY A 114 0.778 8.211 -6.208 1.00 0.00 O ATOM 0 H GLY A 114 -2.467 6.072 -6.005 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.006 7.001 -7.648 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.750 8.572 -7.426 1.00 0.00 H new ATOM 737 N ASP A 115 -0.797 8.104 -4.604 1.00 0.00 N ATOM 738 CA ASP A 115 0.128 8.433 -3.522 1.00 0.00 C ATOM 739 C ASP A 115 1.367 7.544 -3.583 1.00 0.00 C ATOM 740 O ASP A 115 1.267 6.344 -3.839 1.00 0.00 O ATOM 741 CB ASP A 115 -0.566 8.277 -2.168 1.00 0.00 C ATOM 742 CG ASP A 115 -1.501 9.430 -1.860 1.00 0.00 C ATOM 743 OD1 ASP A 115 -1.798 10.218 -2.783 1.00 0.00 O ATOM 744 OD2 ASP A 115 -1.937 9.546 -0.695 1.00 0.00 O ATOM 0 H ASP A 115 -1.760 7.950 -4.304 1.00 0.00 H new ATOM 0 HA ASP A 115 0.442 9.470 -3.641 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -1.129 7.344 -2.157 1.00 0.00 H new ATOM 0 HB3 ASP A 115 0.187 8.204 -1.383 1.00 0.00 H new ATOM 749 N GLU A 116 2.534 8.139 -3.360 1.00 0.00 N ATOM 750 CA GLU A 116 3.789 7.396 -3.408 1.00 0.00 C ATOM 751 C GLU A 116 4.157 6.821 -2.044 1.00 0.00 C ATOM 752 O GLU A 116 4.516 7.557 -1.126 1.00 0.00 O ATOM 753 CB GLU A 116 4.917 8.297 -3.913 1.00 0.00 C ATOM 754 CG GLU A 116 5.057 8.305 -5.427 1.00 0.00 C ATOM 755 CD GLU A 116 6.500 8.414 -5.878 1.00 0.00 C ATOM 756 OE1 GLU A 116 7.172 7.365 -5.978 1.00 0.00 O ATOM 757 OE2 GLU A 116 6.959 9.548 -6.132 1.00 0.00 O ATOM 0 H GLU A 116 2.637 9.131 -3.145 1.00 0.00 H new ATOM 0 HA GLU A 116 3.652 6.563 -4.097 1.00 0.00 H new ATOM 0 HB2 GLU A 116 4.740 9.315 -3.567 1.00 0.00 H new ATOM 0 HB3 GLU A 116 5.858 7.970 -3.471 1.00 0.00 H new ATOM 0 HG2 GLU A 116 4.621 7.392 -5.833 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.488 9.140 -5.836 1.00 0.00 H new ATOM 764 N ILE A 117 4.082 5.497 -1.925 1.00 0.00 N ATOM 765 CA ILE A 117 4.423 4.818 -0.679 1.00 0.00 C ATOM 766 C ILE A 117 5.876 4.352 -0.710 1.00 0.00 C ATOM 767 O ILE A 117 6.185 3.278 -1.227 1.00 0.00 O ATOM 768 CB ILE A 117 3.496 3.613 -0.415 1.00 0.00 C ATOM 769 CG1 ILE A 117 2.044 4.078 -0.300 1.00 0.00 C ATOM 770 CG2 ILE A 117 3.917 2.876 0.850 1.00 0.00 C ATOM 771 CD1 ILE A 117 1.326 4.154 -1.630 1.00 0.00 C ATOM 0 H ILE A 117 3.788 4.874 -2.677 1.00 0.00 H new ATOM 0 HA ILE A 117 4.287 5.534 0.132 1.00 0.00 H new ATOM 0 HB ILE A 117 3.579 2.925 -1.256 1.00 0.00 H new ATOM 0 HG12 ILE A 117 1.504 3.396 0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 117 2.022 5.060 0.172 1.00 0.00 H new ATOM 0 HG21 ILE A 117 3.250 2.030 1.017 1.00 0.00 H new ATOM 0 HG22 ILE A 117 4.939 2.515 0.738 1.00 0.00 H new ATOM 0 HG23 ILE A 117 3.863 3.554 1.701 1.00 0.00 H new ATOM 0 HD11 ILE A 117 0.301 4.491 -1.472 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.842 4.858 -2.283 1.00 0.00 H new ATOM 0 HD13 ILE A 117 1.316 3.168 -2.095 1.00 0.00 H new ATOM 783 N LEU A 118 6.762 5.178 -0.166 1.00 0.00 N ATOM 784 CA LEU A 118 8.187 4.870 -0.138 1.00 0.00 C ATOM 785 C LEU A 118 8.463 3.511 0.500 1.00 0.00 C ATOM 786 O LEU A 118 9.323 2.765 0.032 1.00 0.00 O ATOM 787 CB LEU A 118 8.949 5.965 0.615 1.00 0.00 C ATOM 788 CG LEU A 118 9.571 7.046 -0.271 1.00 0.00 C ATOM 789 CD1 LEU A 118 10.728 6.475 -1.076 1.00 0.00 C ATOM 790 CD2 LEU A 118 8.522 7.646 -1.195 1.00 0.00 C ATOM 0 H LEU A 118 6.517 6.070 0.264 1.00 0.00 H new ATOM 0 HA LEU A 118 8.534 4.829 -1.171 1.00 0.00 H new ATOM 0 HB2 LEU A 118 8.268 6.442 1.320 1.00 0.00 H new ATOM 0 HB3 LEU A 118 9.740 5.498 1.202 1.00 0.00 H new ATOM 0 HG LEU A 118 9.957 7.838 0.371 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.158 7.258 -1.700 1.00 0.00 H new ATOM 0 HD12 LEU A 118 11.490 6.093 -0.397 1.00 0.00 H new ATOM 0 HD13 LEU A 118 10.366 5.664 -1.709 1.00 0.00 H new ATOM 0 HD21 LEU A 118 8.982 8.413 -1.818 1.00 0.00 H new ATOM 0 HD22 LEU A 118 8.106 6.864 -1.830 1.00 0.00 H new ATOM 0 HD23 LEU A 118 7.725 8.092 -0.600 1.00 0.00 H new ATOM 802 N GLU A 119 7.744 3.192 1.573 1.00 0.00 N ATOM 803 CA GLU A 119 7.945 1.920 2.257 1.00 0.00 C ATOM 804 C GLU A 119 6.627 1.330 2.747 1.00 0.00 C ATOM 805 O GLU A 119 5.611 2.021 2.825 1.00 0.00 O ATOM 806 CB GLU A 119 8.901 2.099 3.438 1.00 0.00 C ATOM 807 CG GLU A 119 10.125 2.939 3.109 1.00 0.00 C ATOM 808 CD GLU A 119 10.883 3.372 4.348 1.00 0.00 C ATOM 809 OE1 GLU A 119 11.376 2.489 5.082 1.00 0.00 O ATOM 810 OE2 GLU A 119 10.987 4.594 4.584 1.00 0.00 O ATOM 0 H GLU A 119 7.026 3.789 1.983 1.00 0.00 H new ATOM 0 HA GLU A 119 8.380 1.226 1.538 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.362 2.565 4.263 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.226 1.118 3.783 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.790 2.368 2.461 1.00 0.00 H new ATOM 0 HG3 GLU A 119 9.816 3.822 2.549 1.00 0.00 H new ATOM 817 N ILE A 120 6.660 0.045 3.083 1.00 0.00 N ATOM 818 CA ILE A 120 5.481 -0.657 3.577 1.00 0.00 C ATOM 819 C ILE A 120 5.820 -1.438 4.841 1.00 0.00 C ATOM 820 O ILE A 120 6.379 -2.533 4.773 1.00 0.00 O ATOM 821 CB ILE A 120 4.905 -1.628 2.524 1.00 0.00 C ATOM 822 CG1 ILE A 120 5.030 -1.037 1.118 1.00 0.00 C ATOM 823 CG2 ILE A 120 3.452 -1.948 2.840 1.00 0.00 C ATOM 824 CD1 ILE A 120 6.363 -1.321 0.463 1.00 0.00 C ATOM 0 H ILE A 120 7.497 -0.535 3.022 1.00 0.00 H new ATOM 0 HA ILE A 120 4.727 0.099 3.796 1.00 0.00 H new ATOM 0 HB ILE A 120 5.480 -2.553 2.557 1.00 0.00 H new ATOM 0 HG12 ILE A 120 4.233 -1.438 0.491 1.00 0.00 H new ATOM 0 HG13 ILE A 120 4.882 0.042 1.171 1.00 0.00 H new ATOM 0 HG21 ILE A 120 3.059 -2.634 2.089 1.00 0.00 H new ATOM 0 HG22 ILE A 120 3.387 -2.412 3.824 1.00 0.00 H new ATOM 0 HG23 ILE A 120 2.867 -1.028 2.833 1.00 0.00 H new ATOM 0 HD11 ILE A 120 6.383 -0.873 -0.531 1.00 0.00 H new ATOM 0 HD12 ILE A 120 7.164 -0.896 1.068 1.00 0.00 H new ATOM 0 HD13 ILE A 120 6.505 -2.398 0.378 1.00 0.00 H new ATOM 836 N ASN A 121 5.489 -0.864 5.993 1.00 0.00 N ATOM 837 CA ASN A 121 5.770 -1.502 7.274 1.00 0.00 C ATOM 838 C ASN A 121 7.272 -1.531 7.551 1.00 0.00 C ATOM 839 O ASN A 121 7.741 -2.289 8.400 1.00 0.00 O ATOM 840 CB ASN A 121 5.205 -2.926 7.301 1.00 0.00 C ATOM 841 CG ASN A 121 4.591 -3.281 8.641 1.00 0.00 C ATOM 842 OD1 ASN A 121 4.912 -2.674 9.664 1.00 0.00 O ATOM 843 ND2 ASN A 121 3.703 -4.268 8.644 1.00 0.00 N ATOM 0 H ASN A 121 5.026 0.042 6.066 1.00 0.00 H new ATOM 0 HA ASN A 121 5.285 -0.915 8.054 1.00 0.00 H new ATOM 0 HB2 ASN A 121 4.451 -3.029 6.521 1.00 0.00 H new ATOM 0 HB3 ASN A 121 6.001 -3.634 7.071 1.00 0.00 H new ATOM 0 HD21 ASN A 121 3.257 -4.550 9.517 1.00 0.00 H new ATOM 0 HD22 ASN A 121 3.466 -4.744 7.773 1.00 0.00 H new ATOM 850 N GLY A 122 8.023 -0.697 6.832 1.00 0.00 N ATOM 851 CA GLY A 122 9.460 -0.643 7.021 1.00 0.00 C ATOM 852 C GLY A 122 10.236 -1.265 5.873 1.00 0.00 C ATOM 853 O GLY A 122 11.466 -1.290 5.896 1.00 0.00 O ATOM 0 H GLY A 122 7.660 -0.060 6.123 1.00 0.00 H new ATOM 0 HA2 GLY A 122 9.766 0.397 7.138 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.718 -1.157 7.947 1.00 0.00 H new ATOM 857 N THR A 123 9.525 -1.774 4.868 1.00 0.00 N ATOM 858 CA THR A 123 10.175 -2.400 3.722 1.00 0.00 C ATOM 859 C THR A 123 9.592 -1.894 2.404 1.00 0.00 C ATOM 860 O THR A 123 8.376 -1.809 2.242 1.00 0.00 O ATOM 861 CB THR A 123 10.036 -3.921 3.809 1.00 0.00 C ATOM 862 OG1 THR A 123 10.964 -4.560 2.949 1.00 0.00 O ATOM 863 CG2 THR A 123 8.654 -4.428 3.452 1.00 0.00 C ATOM 0 H THR A 123 8.506 -1.765 4.825 1.00 0.00 H new ATOM 0 HA THR A 123 11.231 -2.131 3.745 1.00 0.00 H new ATOM 0 HB THR A 123 10.230 -4.163 4.854 1.00 0.00 H new ATOM 0 HG1 THR A 123 10.860 -5.532 3.020 1.00 0.00 H new ATOM 0 HG21 THR A 123 8.632 -5.515 3.536 1.00 0.00 H new ATOM 0 HG22 THR A 123 7.921 -3.996 4.133 1.00 0.00 H new ATOM 0 HG23 THR A 123 8.413 -4.139 2.429 1.00 0.00 H new ATOM 871 N ASN A 124 10.473 -1.570 1.461 1.00 0.00 N ATOM 872 CA ASN A 124 10.052 -1.083 0.151 1.00 0.00 C ATOM 873 C ASN A 124 10.012 -2.227 -0.857 1.00 0.00 C ATOM 874 O ASN A 124 11.014 -2.907 -1.078 1.00 0.00 O ATOM 875 CB ASN A 124 11.001 0.012 -0.339 1.00 0.00 C ATOM 876 CG ASN A 124 12.431 -0.476 -0.466 1.00 0.00 C ATOM 877 OD1 ASN A 124 12.869 -0.876 -1.545 1.00 0.00 O ATOM 878 ND2 ASN A 124 13.167 -0.447 0.640 1.00 0.00 N ATOM 0 H ASN A 124 11.484 -1.636 1.580 1.00 0.00 H new ATOM 0 HA ASN A 124 9.050 -0.665 0.246 1.00 0.00 H new ATOM 0 HB2 ASN A 124 10.658 0.380 -1.306 1.00 0.00 H new ATOM 0 HB3 ASN A 124 10.967 0.854 0.352 1.00 0.00 H new ATOM 0 HD21 ASN A 124 14.136 -0.764 0.616 1.00 0.00 H new ATOM 0 HD22 ASN A 124 12.763 -0.107 1.513 1.00 0.00 H new ATOM 885 N VAL A 125 8.848 -2.437 -1.462 1.00 0.00 N ATOM 886 CA VAL A 125 8.678 -3.503 -2.442 1.00 0.00 C ATOM 887 C VAL A 125 9.645 -3.344 -3.609 1.00 0.00 C ATOM 888 O VAL A 125 10.100 -2.239 -3.907 1.00 0.00 O ATOM 889 CB VAL A 125 7.239 -3.541 -2.988 1.00 0.00 C ATOM 890 CG1 VAL A 125 7.026 -4.782 -3.842 1.00 0.00 C ATOM 891 CG2 VAL A 125 6.232 -3.488 -1.847 1.00 0.00 C ATOM 0 H VAL A 125 8.009 -1.883 -1.291 1.00 0.00 H new ATOM 0 HA VAL A 125 8.890 -4.439 -1.925 1.00 0.00 H new ATOM 0 HB VAL A 125 7.084 -2.664 -3.617 1.00 0.00 H new ATOM 0 HG11 VAL A 125 6.004 -4.793 -4.220 1.00 0.00 H new ATOM 0 HG12 VAL A 125 7.722 -4.771 -4.680 1.00 0.00 H new ATOM 0 HG13 VAL A 125 7.199 -5.673 -3.239 1.00 0.00 H new ATOM 0 HG21 VAL A 125 5.221 -3.516 -2.253 1.00 0.00 H new ATOM 0 HG22 VAL A 125 6.383 -4.344 -1.189 1.00 0.00 H new ATOM 0 HG23 VAL A 125 6.371 -2.566 -1.282 1.00 0.00 H new ATOM 901 N THR A 126 9.951 -4.457 -4.267 1.00 0.00 N ATOM 902 CA THR A 126 10.861 -4.447 -5.406 1.00 0.00 C ATOM 903 C THR A 126 10.155 -4.940 -6.664 1.00 0.00 C ATOM 904 O THR A 126 9.029 -5.433 -6.602 1.00 0.00 O ATOM 905 CB THR A 126 12.083 -5.319 -5.117 1.00 0.00 C ATOM 906 OG1 THR A 126 11.693 -6.652 -4.840 1.00 0.00 O ATOM 907 CG2 THR A 126 12.905 -4.828 -3.945 1.00 0.00 C ATOM 0 H THR A 126 9.582 -5.378 -4.031 1.00 0.00 H new ATOM 0 HA THR A 126 11.189 -3.421 -5.571 1.00 0.00 H new ATOM 0 HB THR A 126 12.696 -5.266 -6.017 1.00 0.00 H new ATOM 0 HG1 THR A 126 12.489 -7.195 -4.659 1.00 0.00 H new ATOM 0 HG21 THR A 126 13.756 -5.492 -3.794 1.00 0.00 H new ATOM 0 HG22 THR A 126 13.263 -3.819 -4.149 1.00 0.00 H new ATOM 0 HG23 THR A 126 12.288 -4.819 -3.046 1.00 0.00 H new ATOM 915 N ASN A 127 10.822 -4.804 -7.804 1.00 0.00 N ATOM 916 CA ASN A 127 10.256 -5.239 -9.075 1.00 0.00 C ATOM 917 C ASN A 127 10.189 -6.762 -9.157 1.00 0.00 C ATOM 918 O ASN A 127 9.419 -7.316 -9.941 1.00 0.00 O ATOM 919 CB ASN A 127 11.080 -4.685 -10.239 1.00 0.00 C ATOM 920 CG ASN A 127 10.223 -3.978 -11.271 1.00 0.00 C ATOM 921 OD1 ASN A 127 10.462 -2.818 -11.605 1.00 0.00 O ATOM 922 ND2 ASN A 127 9.216 -4.677 -11.782 1.00 0.00 N ATOM 0 H ASN A 127 11.754 -4.396 -7.874 1.00 0.00 H new ATOM 0 HA ASN A 127 9.240 -4.851 -9.141 1.00 0.00 H new ATOM 0 HB2 ASN A 127 11.826 -3.990 -9.854 1.00 0.00 H new ATOM 0 HB3 ASN A 127 11.621 -5.501 -10.718 1.00 0.00 H new ATOM 0 HD21 ASN A 127 8.604 -4.254 -12.480 1.00 0.00 H new ATOM 0 HD22 ASN A 127 9.054 -5.637 -11.476 1.00 0.00 H new ATOM 929 N HIS A 128 11.000 -7.436 -8.345 1.00 0.00 N ATOM 930 CA HIS A 128 11.027 -8.894 -8.334 1.00 0.00 C ATOM 931 C HIS A 128 9.648 -9.460 -7.981 1.00 0.00 C ATOM 932 O HIS A 128 8.729 -9.407 -8.799 1.00 0.00 O ATOM 933 CB HIS A 128 12.095 -9.396 -7.356 1.00 0.00 C ATOM 934 CG HIS A 128 13.494 -9.076 -7.784 1.00 0.00 C ATOM 935 ND1 HIS A 128 14.460 -10.040 -7.980 1.00 0.00 N ATOM 936 CD2 HIS A 128 14.088 -7.890 -8.056 1.00 0.00 C ATOM 937 CE1 HIS A 128 15.588 -9.462 -8.353 1.00 0.00 C ATOM 938 NE2 HIS A 128 15.388 -8.157 -8.408 1.00 0.00 N ATOM 0 H HIS A 128 11.645 -6.996 -7.688 1.00 0.00 H new ATOM 0 HA HIS A 128 11.285 -9.245 -9.333 1.00 0.00 H new ATOM 0 HB2 HIS A 128 11.914 -8.956 -6.375 1.00 0.00 H new ATOM 0 HB3 HIS A 128 11.996 -10.476 -7.244 1.00 0.00 H new ATOM 0 HD2 HIS A 128 13.625 -6.915 -8.005 1.00 0.00 H new ATOM 0 HE1 HIS A 128 16.515 -9.969 -8.575 1.00 0.00 H new ATOM 0 HE2 HIS A 128 16.086 -7.461 -8.670 1.00 0.00 H new ATOM 947 N SER A 129 9.495 -10.000 -6.770 1.00 0.00 N ATOM 948 CA SER A 129 8.216 -10.559 -6.350 1.00 0.00 C ATOM 949 C SER A 129 7.552 -9.685 -5.291 1.00 0.00 C ATOM 950 O SER A 129 8.195 -9.254 -4.333 1.00 0.00 O ATOM 951 CB SER A 129 8.412 -11.976 -5.807 1.00 0.00 C ATOM 952 OG SER A 129 7.169 -12.645 -5.669 1.00 0.00 O ATOM 0 H SER A 129 10.236 -10.060 -6.071 1.00 0.00 H new ATOM 0 HA SER A 129 7.563 -10.594 -7.222 1.00 0.00 H new ATOM 0 HB2 SER A 129 9.060 -12.540 -6.478 1.00 0.00 H new ATOM 0 HB3 SER A 129 8.915 -11.933 -4.841 1.00 0.00 H new ATOM 0 HG SER A 129 7.321 -13.549 -5.322 1.00 0.00 H new ATOM 958 N VAL A 130 6.259 -9.437 -5.468 1.00 0.00 N ATOM 959 CA VAL A 130 5.494 -8.623 -4.526 1.00 0.00 C ATOM 960 C VAL A 130 4.899 -9.482 -3.418 1.00 0.00 C ATOM 961 O VAL A 130 4.522 -8.977 -2.361 1.00 0.00 O ATOM 962 CB VAL A 130 4.353 -7.856 -5.222 1.00 0.00 C ATOM 963 CG1 VAL A 130 4.118 -6.514 -4.545 1.00 0.00 C ATOM 964 CG2 VAL A 130 4.656 -7.671 -6.698 1.00 0.00 C ATOM 0 H VAL A 130 5.716 -9.788 -6.257 1.00 0.00 H new ATOM 0 HA VAL A 130 6.195 -7.904 -4.101 1.00 0.00 H new ATOM 0 HB VAL A 130 3.440 -8.445 -5.134 1.00 0.00 H new ATOM 0 HG11 VAL A 130 3.309 -5.988 -5.051 1.00 0.00 H new ATOM 0 HG12 VAL A 130 3.849 -6.675 -3.501 1.00 0.00 H new ATOM 0 HG13 VAL A 130 5.028 -5.916 -4.597 1.00 0.00 H new ATOM 0 HG21 VAL A 130 3.839 -7.127 -7.172 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.581 -7.106 -6.811 1.00 0.00 H new ATOM 0 HG23 VAL A 130 4.766 -8.646 -7.172 1.00 0.00 H new ATOM 974 N ASP A 131 4.809 -10.786 -3.673 1.00 0.00 N ATOM 975 CA ASP A 131 4.251 -11.724 -2.705 1.00 0.00 C ATOM 976 C ASP A 131 4.814 -11.483 -1.305 1.00 0.00 C ATOM 977 O ASP A 131 4.177 -11.816 -0.305 1.00 0.00 O ATOM 978 CB ASP A 131 4.533 -13.163 -3.141 1.00 0.00 C ATOM 979 CG ASP A 131 3.309 -14.051 -3.027 1.00 0.00 C ATOM 980 OD1 ASP A 131 2.597 -13.953 -2.005 1.00 0.00 O ATOM 981 OD2 ASP A 131 3.062 -14.845 -3.959 1.00 0.00 O ATOM 0 H ASP A 131 5.117 -11.216 -4.545 1.00 0.00 H new ATOM 0 HA ASP A 131 3.174 -11.563 -2.668 1.00 0.00 H new ATOM 0 HB2 ASP A 131 4.885 -13.165 -4.172 1.00 0.00 H new ATOM 0 HB3 ASP A 131 5.336 -13.575 -2.529 1.00 0.00 H new ATOM 986 N GLN A 132 6.010 -10.904 -1.240 1.00 0.00 N ATOM 987 CA GLN A 132 6.653 -10.620 0.040 1.00 0.00 C ATOM 988 C GLN A 132 5.735 -9.799 0.943 1.00 0.00 C ATOM 989 O GLN A 132 5.437 -10.200 2.068 1.00 0.00 O ATOM 990 CB GLN A 132 7.972 -9.874 -0.184 1.00 0.00 C ATOM 991 CG GLN A 132 9.196 -10.773 -0.124 1.00 0.00 C ATOM 992 CD GLN A 132 9.944 -10.650 1.189 1.00 0.00 C ATOM 993 OE1 GLN A 132 9.576 -11.267 2.188 1.00 0.00 O ATOM 994 NE2 GLN A 132 11.004 -9.849 1.192 1.00 0.00 N ATOM 0 H GLN A 132 6.553 -10.623 -2.057 1.00 0.00 H new ATOM 0 HA GLN A 132 6.859 -11.570 0.534 1.00 0.00 H new ATOM 0 HB2 GLN A 132 7.941 -9.381 -1.156 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.069 -9.091 0.568 1.00 0.00 H new ATOM 0 HG2 GLN A 132 8.889 -11.809 -0.268 1.00 0.00 H new ATOM 0 HG3 GLN A 132 9.867 -10.523 -0.945 1.00 0.00 H new ATOM 0 HE21 GLN A 132 11.273 -9.357 0.340 1.00 0.00 H new ATOM 0 HE22 GLN A 132 11.548 -9.727 2.046 1.00 0.00 H new ATOM 1003 N LEU A 133 5.289 -8.652 0.442 1.00 0.00 N ATOM 1004 CA LEU A 133 4.403 -7.781 1.206 1.00 0.00 C ATOM 1005 C LEU A 133 3.016 -8.401 1.338 1.00 0.00 C ATOM 1006 O LEU A 133 2.404 -8.355 2.403 1.00 0.00 O ATOM 1007 CB LEU A 133 4.299 -6.409 0.539 1.00 0.00 C ATOM 1008 CG LEU A 133 5.558 -5.548 0.632 1.00 0.00 C ATOM 1009 CD1 LEU A 133 5.932 -5.306 2.086 1.00 0.00 C ATOM 1010 CD2 LEU A 133 6.708 -6.205 -0.116 1.00 0.00 C ATOM 0 H LEU A 133 5.526 -8.304 -0.487 1.00 0.00 H new ATOM 0 HA LEU A 133 4.826 -7.659 2.203 1.00 0.00 H new ATOM 0 HB2 LEU A 133 4.051 -6.551 -0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 133 3.470 -5.864 0.991 1.00 0.00 H new ATOM 0 HG LEU A 133 5.353 -4.584 0.167 1.00 0.00 H new ATOM 0 HD11 LEU A 133 6.831 -4.691 2.133 1.00 0.00 H new ATOM 0 HD12 LEU A 133 5.114 -4.792 2.591 1.00 0.00 H new ATOM 0 HD13 LEU A 133 6.119 -6.261 2.577 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.597 -5.579 -0.040 1.00 0.00 H new ATOM 0 HD22 LEU A 133 6.914 -7.182 0.320 1.00 0.00 H new ATOM 0 HD23 LEU A 133 6.438 -6.325 -1.165 1.00 0.00 H new ATOM 1022 N GLN A 134 2.528 -8.983 0.246 1.00 0.00 N ATOM 1023 CA GLN A 134 1.212 -9.618 0.238 1.00 0.00 C ATOM 1024 C GLN A 134 1.065 -10.581 1.413 1.00 0.00 C ATOM 1025 O GLN A 134 0.114 -10.491 2.189 1.00 0.00 O ATOM 1026 CB GLN A 134 0.994 -10.369 -1.077 1.00 0.00 C ATOM 1027 CG GLN A 134 0.362 -9.522 -2.168 1.00 0.00 C ATOM 1028 CD GLN A 134 -1.107 -9.839 -2.374 1.00 0.00 C ATOM 1029 OE1 GLN A 134 -1.810 -10.216 -1.437 1.00 0.00 O ATOM 1030 NE2 GLN A 134 -1.578 -9.686 -3.606 1.00 0.00 N ATOM 0 H GLN A 134 3.023 -9.028 -0.645 1.00 0.00 H new ATOM 0 HA GLN A 134 0.459 -8.836 0.334 1.00 0.00 H new ATOM 0 HB2 GLN A 134 1.953 -10.747 -1.432 1.00 0.00 H new ATOM 0 HB3 GLN A 134 0.360 -11.235 -0.889 1.00 0.00 H new ATOM 0 HG2 GLN A 134 0.470 -8.468 -1.913 1.00 0.00 H new ATOM 0 HG3 GLN A 134 0.899 -9.681 -3.103 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -0.959 -9.371 -4.353 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -2.559 -9.883 -3.805 1.00 0.00 H new ATOM 1039 N LYS A 135 2.018 -11.500 1.536 1.00 0.00 N ATOM 1040 CA LYS A 135 2.002 -12.480 2.615 1.00 0.00 C ATOM 1041 C LYS A 135 2.221 -11.801 3.964 1.00 0.00 C ATOM 1042 O LYS A 135 1.691 -12.241 4.984 1.00 0.00 O ATOM 1043 CB LYS A 135 3.080 -13.541 2.380 1.00 0.00 C ATOM 1044 CG LYS A 135 3.157 -14.588 3.480 1.00 0.00 C ATOM 1045 CD LYS A 135 2.540 -15.907 3.040 1.00 0.00 C ATOM 1046 CE LYS A 135 1.038 -15.781 2.834 1.00 0.00 C ATOM 1047 NZ LYS A 135 0.291 -16.877 3.510 1.00 0.00 N ATOM 0 H LYS A 135 2.811 -11.586 0.901 1.00 0.00 H new ATOM 0 HA LYS A 135 1.025 -12.963 2.626 1.00 0.00 H new ATOM 0 HB2 LYS A 135 2.886 -14.039 1.430 1.00 0.00 H new ATOM 0 HB3 LYS A 135 4.048 -13.049 2.291 1.00 0.00 H new ATOM 0 HG2 LYS A 135 4.198 -14.748 3.759 1.00 0.00 H new ATOM 0 HG3 LYS A 135 2.641 -14.222 4.368 1.00 0.00 H new ATOM 0 HD2 LYS A 135 3.009 -16.237 2.113 1.00 0.00 H new ATOM 0 HD3 LYS A 135 2.742 -16.672 3.790 1.00 0.00 H new ATOM 0 HE2 LYS A 135 0.698 -14.819 3.218 1.00 0.00 H new ATOM 0 HE3 LYS A 135 0.816 -15.794 1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -0.729 -16.755 3.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 0.596 -17.794 3.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 0.483 -16.849 4.532 1.00 0.00 H new ATOM 1061 N ALA A 136 3.006 -10.729 3.959 1.00 0.00 N ATOM 1062 CA ALA A 136 3.296 -9.988 5.181 1.00 0.00 C ATOM 1063 C ALA A 136 2.087 -9.176 5.634 1.00 0.00 C ATOM 1064 O ALA A 136 1.921 -8.906 6.824 1.00 0.00 O ATOM 1065 CB ALA A 136 4.497 -9.078 4.969 1.00 0.00 C ATOM 0 H ALA A 136 3.453 -10.354 3.122 1.00 0.00 H new ATOM 0 HA ALA A 136 3.530 -10.707 5.967 1.00 0.00 H new ATOM 0 HB1 ALA A 136 4.705 -8.530 5.888 1.00 0.00 H new ATOM 0 HB2 ALA A 136 5.366 -9.679 4.701 1.00 0.00 H new ATOM 0 HB3 ALA A 136 4.282 -8.373 4.166 1.00 0.00 H new ATOM 1071 N MET A 137 1.247 -8.788 4.681 1.00 0.00 N ATOM 1072 CA MET A 137 0.053 -8.006 4.983 1.00 0.00 C ATOM 1073 C MET A 137 -1.053 -8.895 5.542 1.00 0.00 C ATOM 1074 O MET A 137 -1.854 -8.461 6.370 1.00 0.00 O ATOM 1075 CB MET A 137 -0.440 -7.283 3.728 1.00 0.00 C ATOM 1076 CG MET A 137 -0.043 -5.817 3.675 1.00 0.00 C ATOM 1077 SD MET A 137 1.740 -5.574 3.783 1.00 0.00 S ATOM 1078 CE MET A 137 1.874 -4.747 5.366 1.00 0.00 C ATOM 0 H MET A 137 1.371 -9.002 3.691 1.00 0.00 H new ATOM 0 HA MET A 137 0.315 -7.266 5.739 1.00 0.00 H new ATOM 0 HB2 MET A 137 -0.045 -7.790 2.848 1.00 0.00 H new ATOM 0 HB3 MET A 137 -1.526 -7.359 3.678 1.00 0.00 H new ATOM 0 HG2 MET A 137 -0.410 -5.379 2.747 1.00 0.00 H new ATOM 0 HG3 MET A 137 -0.528 -5.284 4.492 1.00 0.00 H new ATOM 0 HE1 MET A 137 2.917 -4.498 5.559 1.00 0.00 H new ATOM 0 HE2 MET A 137 1.279 -3.834 5.351 1.00 0.00 H new ATOM 0 HE3 MET A 137 1.507 -5.406 6.153 1.00 0.00 H new ATOM 1088 N LYS A 138 -1.090 -10.142 5.085 1.00 0.00 N ATOM 1089 CA LYS A 138 -2.097 -11.093 5.538 1.00 0.00 C ATOM 1090 C LYS A 138 -1.635 -11.819 6.798 1.00 0.00 C ATOM 1091 O LYS A 138 -2.451 -12.227 7.626 1.00 0.00 O ATOM 1092 CB LYS A 138 -2.404 -12.108 4.436 1.00 0.00 C ATOM 1093 CG LYS A 138 -3.810 -12.680 4.509 1.00 0.00 C ATOM 1094 CD LYS A 138 -4.218 -13.326 3.194 1.00 0.00 C ATOM 1095 CE LYS A 138 -4.567 -12.283 2.143 1.00 0.00 C ATOM 1096 NZ LYS A 138 -5.955 -12.452 1.633 1.00 0.00 N ATOM 0 H LYS A 138 -0.433 -10.517 4.401 1.00 0.00 H new ATOM 0 HA LYS A 138 -3.004 -10.536 5.773 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -2.265 -11.631 3.466 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -1.685 -12.925 4.496 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -3.863 -13.418 5.310 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -4.514 -11.887 4.760 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -3.405 -13.954 2.829 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -5.075 -13.978 3.359 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -4.456 -11.286 2.570 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -3.864 -12.355 1.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -6.154 -11.722 0.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -6.055 -13.394 1.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -6.628 -12.358 2.420 1.00 0.00 H new ATOM 1110 N GLU A 139 -0.323 -11.977 6.938 1.00 0.00 N ATOM 1111 CA GLU A 139 0.246 -12.654 8.098 1.00 0.00 C ATOM 1112 C GLU A 139 0.346 -11.706 9.288 1.00 0.00 C ATOM 1113 O GLU A 139 0.254 -12.129 10.440 1.00 0.00 O ATOM 1114 CB GLU A 139 1.628 -13.215 7.759 1.00 0.00 C ATOM 1115 CG GLU A 139 2.279 -13.964 8.909 1.00 0.00 C ATOM 1116 CD GLU A 139 3.606 -14.586 8.522 1.00 0.00 C ATOM 1117 OE1 GLU A 139 4.506 -13.840 8.081 1.00 0.00 O ATOM 1118 OE2 GLU A 139 3.747 -15.820 8.662 1.00 0.00 O ATOM 0 H GLU A 139 0.366 -11.646 6.263 1.00 0.00 H new ATOM 0 HA GLU A 139 -0.416 -13.476 8.368 1.00 0.00 H new ATOM 0 HB2 GLU A 139 1.539 -13.885 6.904 1.00 0.00 H new ATOM 0 HB3 GLU A 139 2.279 -12.395 7.455 1.00 0.00 H new ATOM 0 HG2 GLU A 139 2.432 -13.279 9.743 1.00 0.00 H new ATOM 0 HG3 GLU A 139 1.604 -14.745 9.258 1.00 0.00 H new ATOM 1125 N THR A 140 0.538 -10.422 9.002 1.00 0.00 N ATOM 1126 CA THR A 140 0.653 -9.416 10.051 1.00 0.00 C ATOM 1127 C THR A 140 -0.696 -9.167 10.720 1.00 0.00 C ATOM 1128 O THR A 140 -1.745 -9.286 10.088 1.00 0.00 O ATOM 1129 CB THR A 140 1.199 -8.108 9.474 1.00 0.00 C ATOM 1130 OG1 THR A 140 1.436 -7.166 10.505 1.00 0.00 O ATOM 1131 CG2 THR A 140 0.269 -7.463 8.469 1.00 0.00 C ATOM 0 H THR A 140 0.617 -10.054 8.054 1.00 0.00 H new ATOM 0 HA THR A 140 1.346 -9.791 10.804 1.00 0.00 H new ATOM 0 HB THR A 140 2.124 -8.380 8.966 1.00 0.00 H new ATOM 0 HG1 THR A 140 1.786 -6.337 10.117 1.00 0.00 H new ATOM 0 HG21 THR A 140 0.716 -6.540 8.099 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.104 -8.146 7.635 1.00 0.00 H new ATOM 0 HG23 THR A 140 -0.684 -7.238 8.948 1.00 0.00 H new ATOM 1139 N LYS A 141 -0.658 -8.820 12.002 1.00 0.00 N ATOM 1140 CA LYS A 141 -1.875 -8.552 12.759 1.00 0.00 C ATOM 1141 C LYS A 141 -1.677 -7.365 13.696 1.00 0.00 C ATOM 1142 O LYS A 141 -0.750 -7.349 14.505 1.00 0.00 O ATOM 1143 CB LYS A 141 -2.287 -9.788 13.559 1.00 0.00 C ATOM 1144 CG LYS A 141 -3.055 -10.813 12.741 1.00 0.00 C ATOM 1145 CD LYS A 141 -4.021 -11.607 13.607 1.00 0.00 C ATOM 1146 CE LYS A 141 -4.162 -13.039 13.116 1.00 0.00 C ATOM 1147 NZ LYS A 141 -2.986 -13.873 13.486 1.00 0.00 N ATOM 0 H LYS A 141 0.203 -8.718 12.539 1.00 0.00 H new ATOM 0 HA LYS A 141 -2.669 -8.308 12.053 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -1.394 -10.259 13.970 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -2.901 -9.476 14.404 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -3.607 -10.308 11.948 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -2.354 -11.494 12.258 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -3.670 -11.608 14.639 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.997 -11.122 13.603 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -5.066 -13.479 13.537 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -4.281 -13.041 12.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -2.918 -14.684 12.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -2.120 -13.302 13.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -3.097 -14.217 14.461 1.00 0.00 H new ATOM 1161 N GLY A 142 -2.552 -6.372 13.580 1.00 0.00 N ATOM 1162 CA GLY A 142 -2.453 -5.194 14.423 1.00 0.00 C ATOM 1163 C GLY A 142 -2.460 -3.909 13.620 1.00 0.00 C ATOM 1164 O GLY A 142 -3.246 -3.759 12.686 1.00 0.00 O ATOM 0 H GLY A 142 -3.328 -6.361 12.918 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -3.284 -5.184 15.128 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -1.537 -5.247 15.011 1.00 0.00 H new ATOM 1168 N MET A 143 -1.583 -2.979 13.985 1.00 0.00 N ATOM 1169 CA MET A 143 -1.498 -1.700 13.289 1.00 0.00 C ATOM 1170 C MET A 143 -0.339 -1.692 12.296 1.00 0.00 C ATOM 1171 O MET A 143 0.757 -2.162 12.601 1.00 0.00 O ATOM 1172 CB MET A 143 -1.332 -0.558 14.292 1.00 0.00 C ATOM 1173 CG MET A 143 -0.019 -0.604 15.060 1.00 0.00 C ATOM 1174 SD MET A 143 0.981 0.879 14.824 1.00 0.00 S ATOM 1175 CE MET A 143 -0.243 2.159 15.082 1.00 0.00 C ATOM 0 H MET A 143 -0.924 -3.086 14.756 1.00 0.00 H new ATOM 0 HA MET A 143 -2.426 -1.557 12.736 1.00 0.00 H new ATOM 0 HB2 MET A 143 -1.399 0.392 13.762 1.00 0.00 H new ATOM 0 HB3 MET A 143 -2.159 -0.586 15.002 1.00 0.00 H new ATOM 0 HG2 MET A 143 -0.229 -0.730 16.122 1.00 0.00 H new ATOM 0 HG3 MET A 143 0.552 -1.476 14.742 1.00 0.00 H new ATOM 0 HE1 MET A 143 0.242 3.052 15.476 1.00 0.00 H new ATOM 0 HE2 MET A 143 -0.726 2.397 14.134 1.00 0.00 H new ATOM 0 HE3 MET A 143 -0.991 1.809 15.793 1.00 0.00 H new ATOM 1185 N ILE A 144 -0.592 -1.152 11.108 1.00 0.00 N ATOM 1186 CA ILE A 144 0.431 -1.078 10.070 1.00 0.00 C ATOM 1187 C ILE A 144 0.896 0.359 9.856 1.00 0.00 C ATOM 1188 O ILE A 144 0.097 1.293 9.914 1.00 0.00 O ATOM 1189 CB ILE A 144 -0.084 -1.634 8.726 1.00 0.00 C ATOM 1190 CG1 ILE A 144 -0.706 -3.018 8.919 1.00 0.00 C ATOM 1191 CG2 ILE A 144 1.047 -1.693 7.708 1.00 0.00 C ATOM 1192 CD1 ILE A 144 -1.245 -3.620 7.638 1.00 0.00 C ATOM 0 H ILE A 144 -1.495 -0.760 10.840 1.00 0.00 H new ATOM 0 HA ILE A 144 1.267 -1.686 10.414 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.855 -0.963 8.348 1.00 0.00 H new ATOM 0 HG12 ILE A 144 0.043 -3.689 9.340 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -1.515 -2.946 9.646 1.00 0.00 H new ATOM 0 HG21 ILE A 144 0.668 -2.087 6.765 1.00 0.00 H new ATOM 0 HG22 ILE A 144 1.445 -0.691 7.548 1.00 0.00 H new ATOM 0 HG23 ILE A 144 1.839 -2.343 8.081 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -1.671 -4.601 7.848 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -2.017 -2.969 7.227 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -0.435 -3.724 6.916 1.00 0.00 H new ATOM 1204 N SER A 145 2.189 0.526 9.596 1.00 0.00 N ATOM 1205 CA SER A 145 2.756 1.849 9.359 1.00 0.00 C ATOM 1206 C SER A 145 3.403 1.912 7.981 1.00 0.00 C ATOM 1207 O SER A 145 4.397 1.236 7.719 1.00 0.00 O ATOM 1208 CB SER A 145 3.786 2.198 10.435 1.00 0.00 C ATOM 1209 OG SER A 145 4.748 1.167 10.573 1.00 0.00 O ATOM 0 H SER A 145 2.863 -0.238 9.544 1.00 0.00 H new ATOM 0 HA SER A 145 1.946 2.577 9.403 1.00 0.00 H new ATOM 0 HB2 SER A 145 4.284 3.132 10.177 1.00 0.00 H new ATOM 0 HB3 SER A 145 3.281 2.359 11.388 1.00 0.00 H new ATOM 0 HG SER A 145 5.015 0.848 9.686 1.00 0.00 H new ATOM 1215 N LEU A 146 2.826 2.722 7.101 1.00 0.00 N ATOM 1216 CA LEU A 146 3.341 2.866 5.745 1.00 0.00 C ATOM 1217 C LEU A 146 3.909 4.260 5.513 1.00 0.00 C ATOM 1218 O LEU A 146 3.366 5.254 5.995 1.00 0.00 O ATOM 1219 CB LEU A 146 2.229 2.588 4.729 1.00 0.00 C ATOM 1220 CG LEU A 146 2.074 1.125 4.310 1.00 0.00 C ATOM 1221 CD1 LEU A 146 2.129 0.209 5.522 1.00 0.00 C ATOM 1222 CD2 LEU A 146 0.771 0.925 3.551 1.00 0.00 C ATOM 0 H LEU A 146 2.002 3.289 7.302 1.00 0.00 H new ATOM 0 HA LEU A 146 4.146 2.143 5.614 1.00 0.00 H new ATOM 0 HB2 LEU A 146 1.283 2.930 5.148 1.00 0.00 H new ATOM 0 HB3 LEU A 146 2.417 3.186 3.837 1.00 0.00 H new ATOM 0 HG LEU A 146 2.903 0.869 3.650 1.00 0.00 H new ATOM 0 HD11 LEU A 146 2.017 -0.827 5.201 1.00 0.00 H new ATOM 0 HD12 LEU A 146 3.087 0.331 6.027 1.00 0.00 H new ATOM 0 HD13 LEU A 146 1.322 0.465 6.209 1.00 0.00 H new ATOM 0 HD21 LEU A 146 0.676 -0.121 3.260 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -0.068 1.202 4.189 1.00 0.00 H new ATOM 0 HD23 LEU A 146 0.770 1.551 2.659 1.00 0.00 H new ATOM 1234 N LYS A 147 4.996 4.321 4.756 1.00 0.00 N ATOM 1235 CA LYS A 147 5.637 5.590 4.433 1.00 0.00 C ATOM 1236 C LYS A 147 5.141 6.079 3.079 1.00 0.00 C ATOM 1237 O LYS A 147 5.472 5.496 2.044 1.00 0.00 O ATOM 1238 CB LYS A 147 7.159 5.434 4.417 1.00 0.00 C ATOM 1239 CG LYS A 147 7.846 6.043 5.631 1.00 0.00 C ATOM 1240 CD LYS A 147 8.896 7.068 5.226 1.00 0.00 C ATOM 1241 CE LYS A 147 10.160 6.931 6.059 1.00 0.00 C ATOM 1242 NZ LYS A 147 11.388 7.152 5.247 1.00 0.00 N ATOM 0 H LYS A 147 5.454 3.504 4.353 1.00 0.00 H new ATOM 0 HA LYS A 147 5.379 6.323 5.197 1.00 0.00 H new ATOM 0 HB2 LYS A 147 7.407 4.374 4.363 1.00 0.00 H new ATOM 0 HB3 LYS A 147 7.554 5.900 3.514 1.00 0.00 H new ATOM 0 HG2 LYS A 147 7.102 6.517 6.271 1.00 0.00 H new ATOM 0 HG3 LYS A 147 8.315 5.254 6.218 1.00 0.00 H new ATOM 0 HD2 LYS A 147 9.139 6.943 4.171 1.00 0.00 H new ATOM 0 HD3 LYS A 147 8.489 8.072 5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 147 10.133 7.648 6.879 1.00 0.00 H new ATOM 0 HE3 LYS A 147 10.194 5.937 6.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 12.170 7.436 5.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 11.641 6.272 4.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 11.212 7.903 4.549 1.00 0.00 H new ATOM 1256 N VAL A 148 4.326 7.130 3.088 1.00 0.00 N ATOM 1257 CA VAL A 148 3.767 7.662 1.851 1.00 0.00 C ATOM 1258 C VAL A 148 4.061 9.146 1.676 1.00 0.00 C ATOM 1259 O VAL A 148 4.328 9.862 2.640 1.00 0.00 O ATOM 1260 CB VAL A 148 2.242 7.448 1.788 1.00 0.00 C ATOM 1261 CG1 VAL A 148 1.750 7.551 0.354 1.00 0.00 C ATOM 1262 CG2 VAL A 148 1.856 6.107 2.398 1.00 0.00 C ATOM 0 H VAL A 148 4.040 7.626 3.932 1.00 0.00 H new ATOM 0 HA VAL A 148 4.249 7.113 1.042 1.00 0.00 H new ATOM 0 HB VAL A 148 1.762 8.233 2.373 1.00 0.00 H new ATOM 0 HG11 VAL A 148 0.671 7.397 0.328 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.986 8.539 -0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 148 2.240 6.791 -0.254 1.00 0.00 H new ATOM 0 HG21 VAL A 148 0.775 5.979 2.342 1.00 0.00 H new ATOM 0 HG22 VAL A 148 2.345 5.303 1.848 1.00 0.00 H new ATOM 0 HG23 VAL A 148 2.171 6.078 3.441 1.00 0.00 H new ATOM 1272 N ILE A 149 3.996 9.595 0.426 1.00 0.00 N ATOM 1273 CA ILE A 149 4.240 10.992 0.090 1.00 0.00 C ATOM 1274 C ILE A 149 3.142 11.518 -0.835 1.00 0.00 C ATOM 1275 O ILE A 149 2.990 11.039 -1.960 1.00 0.00 O ATOM 1276 CB ILE A 149 5.605 11.179 -0.599 1.00 0.00 C ATOM 1277 CG1 ILE A 149 6.689 10.378 0.127 1.00 0.00 C ATOM 1278 CG2 ILE A 149 5.975 12.654 -0.651 1.00 0.00 C ATOM 1279 CD1 ILE A 149 8.063 10.521 -0.487 1.00 0.00 C ATOM 0 H ILE A 149 3.774 9.005 -0.376 1.00 0.00 H new ATOM 0 HA ILE A 149 4.239 11.553 1.025 1.00 0.00 H new ATOM 0 HB ILE A 149 5.530 10.805 -1.620 1.00 0.00 H new ATOM 0 HG12 ILE A 149 6.730 10.699 1.168 1.00 0.00 H new ATOM 0 HG13 ILE A 149 6.410 9.324 0.130 1.00 0.00 H new ATOM 0 HG21 ILE A 149 6.942 12.770 -1.141 1.00 0.00 H new ATOM 0 HG22 ILE A 149 5.217 13.200 -1.212 1.00 0.00 H new ATOM 0 HG23 ILE A 149 6.032 13.051 0.363 1.00 0.00 H new ATOM 0 HD11 ILE A 149 8.779 9.926 0.080 1.00 0.00 H new ATOM 0 HD12 ILE A 149 8.038 10.172 -1.519 1.00 0.00 H new ATOM 0 HD13 ILE A 149 8.364 11.568 -0.465 1.00 0.00 H new ATOM 1291 N PRO A 150 2.352 12.506 -0.373 1.00 0.00 N ATOM 1292 CA PRO A 150 1.263 13.081 -1.171 1.00 0.00 C ATOM 1293 C PRO A 150 1.741 13.585 -2.528 1.00 0.00 C ATOM 1294 O PRO A 150 2.601 14.462 -2.609 1.00 0.00 O ATOM 1295 CB PRO A 150 0.766 14.248 -0.313 1.00 0.00 C ATOM 1296 CG PRO A 150 1.160 13.892 1.078 1.00 0.00 C ATOM 1297 CD PRO A 150 2.451 13.132 0.959 1.00 0.00 C ATOM 0 HA PRO A 150 0.493 12.343 -1.396 1.00 0.00 H new ATOM 0 HB2 PRO A 150 1.220 15.189 -0.624 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -0.314 14.371 -0.399 1.00 0.00 H new ATOM 0 HG2 PRO A 150 1.288 14.786 1.689 1.00 0.00 H new ATOM 0 HG3 PRO A 150 0.392 13.285 1.558 1.00 0.00 H new ATOM 0 HD2 PRO A 150 3.315 13.793 1.030 1.00 0.00 H new ATOM 0 HD3 PRO A 150 2.554 12.387 1.748 1.00 0.00 H new ATOM 1305 N ASN A 151 1.175 13.026 -3.595 1.00 0.00 N ATOM 1306 CA ASN A 151 1.543 13.420 -4.949 1.00 0.00 C ATOM 1307 C ASN A 151 0.846 14.718 -5.345 1.00 0.00 C ATOM 1308 O ASN A 151 0.079 15.285 -4.566 1.00 0.00 O ATOM 1309 CB ASN A 151 1.184 12.312 -5.942 1.00 0.00 C ATOM 1310 CG ASN A 151 -0.304 12.027 -5.977 1.00 0.00 C ATOM 1311 OD1 ASN A 151 -0.870 11.500 -5.019 1.00 0.00 O ATOM 1312 ND2 ASN A 151 -0.948 12.376 -7.086 1.00 0.00 N ATOM 0 H ASN A 151 0.461 12.300 -3.546 1.00 0.00 H new ATOM 0 HA ASN A 151 2.620 13.584 -4.973 1.00 0.00 H new ATOM 0 HB2 ASN A 151 1.520 12.598 -6.939 1.00 0.00 H new ATOM 0 HB3 ASN A 151 1.719 11.401 -5.675 1.00 0.00 H new ATOM 0 HD21 ASN A 151 -1.951 12.209 -7.167 1.00 0.00 H new ATOM 0 HD22 ASN A 151 -0.439 12.810 -7.856 1.00 0.00 H new ATOM 1319 N GLN A 152 1.117 15.185 -6.560 1.00 0.00 N ATOM 1320 CA GLN A 152 0.514 16.416 -7.058 1.00 0.00 C ATOM 1321 C GLN A 152 0.366 16.378 -8.575 1.00 0.00 C ATOM 1322 O GLN A 152 1.337 16.566 -9.307 1.00 0.00 O ATOM 1323 CB GLN A 152 1.356 17.625 -6.646 1.00 0.00 C ATOM 1324 CG GLN A 152 2.838 17.464 -6.943 1.00 0.00 C ATOM 1325 CD GLN A 152 3.503 18.776 -7.314 1.00 0.00 C ATOM 1326 OE1 GLN A 152 3.386 19.247 -8.445 1.00 0.00 O ATOM 1327 NE2 GLN A 152 4.207 19.373 -6.359 1.00 0.00 N ATOM 0 H GLN A 152 1.750 14.730 -7.217 1.00 0.00 H new ATOM 0 HA GLN A 152 -0.479 16.506 -6.618 1.00 0.00 H new ATOM 0 HB2 GLN A 152 0.984 18.509 -7.163 1.00 0.00 H new ATOM 0 HB3 GLN A 152 1.225 17.802 -5.578 1.00 0.00 H new ATOM 0 HG2 GLN A 152 3.336 17.042 -6.070 1.00 0.00 H new ATOM 0 HG3 GLN A 152 2.966 16.752 -7.758 1.00 0.00 H new ATOM 0 HE21 GLN A 152 4.277 18.947 -5.435 1.00 0.00 H new ATOM 0 HE22 GLN A 152 4.677 20.258 -6.550 1.00 0.00 H new ATOM 1336 N GLN A 153 -0.854 16.131 -9.040 1.00 0.00 N ATOM 1337 CA GLN A 153 -1.129 16.069 -10.471 1.00 0.00 C ATOM 1338 C GLN A 153 -1.003 17.449 -11.109 1.00 0.00 C ATOM 1339 O GLN A 153 -0.132 17.617 -11.988 1.00 0.00 O ATOM 1340 CB GLN A 153 -2.529 15.503 -10.718 1.00 0.00 C ATOM 1341 CG GLN A 153 -2.537 14.018 -11.041 1.00 0.00 C ATOM 1342 CD GLN A 153 -3.594 13.649 -12.063 1.00 0.00 C ATOM 1343 OE1 GLN A 153 -3.663 14.237 -13.142 1.00 0.00 O ATOM 1344 NE2 GLN A 153 -4.426 12.671 -11.727 1.00 0.00 N ATOM 1345 OXT GLN A 153 -1.779 18.350 -10.725 1.00 0.00 O ATOM 0 H GLN A 153 -1.668 15.970 -8.447 1.00 0.00 H new ATOM 0 HA GLN A 153 -0.393 15.409 -10.930 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -3.143 15.677 -9.835 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -2.992 16.048 -11.541 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -1.556 13.726 -11.417 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -2.709 13.452 -10.126 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -4.333 12.211 -10.822 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -5.159 12.380 -12.374 1.00 0.00 H new TER 1354 GLN A 153 ATOM 1355 N ARG B 123 0.675 -2.392 -17.807 1.00 0.00 N ATOM 1356 CA ARG B 123 1.337 -2.273 -16.481 1.00 0.00 C ATOM 1357 C ARG B 123 0.738 -3.251 -15.477 1.00 0.00 C ATOM 1358 O ARG B 123 -0.315 -3.839 -15.720 1.00 0.00 O ATOM 1359 CB ARG B 123 1.174 -0.836 -15.982 1.00 0.00 C ATOM 1360 CG ARG B 123 1.829 0.199 -16.883 1.00 0.00 C ATOM 1361 CD ARG B 123 3.341 0.033 -16.917 1.00 0.00 C ATOM 1362 NE ARG B 123 3.863 0.042 -18.281 1.00 0.00 N ATOM 1363 CZ ARG B 123 3.836 1.108 -19.079 1.00 0.00 C ATOM 1364 NH1 ARG B 123 3.311 2.250 -18.653 1.00 0.00 N ATOM 1365 NH2 ARG B 123 4.335 1.031 -20.304 1.00 0.00 N ATOM 0 HA ARG B 123 2.394 -2.517 -16.585 1.00 0.00 H new ATOM 0 HB2 ARG B 123 0.112 -0.609 -15.894 1.00 0.00 H new ATOM 0 HB3 ARG B 123 1.600 -0.757 -14.982 1.00 0.00 H new ATOM 0 HG2 ARG B 123 1.429 0.108 -17.893 1.00 0.00 H new ATOM 0 HG3 ARG B 123 1.580 1.200 -16.530 1.00 0.00 H new ATOM 0 HD2 ARG B 123 3.807 0.836 -16.346 1.00 0.00 H new ATOM 0 HD3 ARG B 123 3.614 -0.904 -16.431 1.00 0.00 H new ATOM 0 HE ARG B 123 4.272 -0.819 -18.644 1.00 0.00 H new ATOM 0 HH11 ARG B 123 2.926 2.314 -17.711 1.00 0.00 H new ATOM 0 HH12 ARG B 123 3.293 3.064 -19.268 1.00 0.00 H new ATOM 0 HH21 ARG B 123 4.740 0.155 -20.636 1.00 0.00 H new ATOM 0 HH22 ARG B 123 4.314 1.847 -20.915 1.00 0.00 H new ATOM 1379 N LYS B 124 1.418 -3.421 -14.347 1.00 0.00 N ATOM 1380 CA LYS B 124 0.953 -4.329 -13.306 1.00 0.00 C ATOM 1381 C LYS B 124 0.395 -3.554 -12.116 1.00 0.00 C ATOM 1382 O LYS B 124 0.687 -2.372 -11.940 1.00 0.00 O ATOM 1383 CB LYS B 124 2.092 -5.242 -12.851 1.00 0.00 C ATOM 1384 CG LYS B 124 3.261 -4.492 -12.235 1.00 0.00 C ATOM 1385 CD LYS B 124 3.625 -5.050 -10.871 1.00 0.00 C ATOM 1386 CE LYS B 124 4.827 -5.977 -10.952 1.00 0.00 C ATOM 1387 NZ LYS B 124 4.837 -6.975 -9.847 1.00 0.00 N ATOM 0 H LYS B 124 2.292 -2.942 -14.130 1.00 0.00 H new ATOM 0 HA LYS B 124 0.153 -4.941 -13.722 1.00 0.00 H new ATOM 0 HB2 LYS B 124 1.706 -5.957 -12.124 1.00 0.00 H new ATOM 0 HB3 LYS B 124 2.449 -5.817 -13.705 1.00 0.00 H new ATOM 0 HG2 LYS B 124 4.124 -4.555 -12.897 1.00 0.00 H new ATOM 0 HG3 LYS B 124 3.008 -3.436 -12.141 1.00 0.00 H new ATOM 0 HD2 LYS B 124 3.842 -4.230 -10.187 1.00 0.00 H new ATOM 0 HD3 LYS B 124 2.773 -5.592 -10.459 1.00 0.00 H new ATOM 0 HE2 LYS B 124 4.820 -6.497 -11.910 1.00 0.00 H new ATOM 0 HE3 LYS B 124 5.743 -5.387 -10.916 1.00 0.00 H new ATOM 0 HZ1 LYS B 124 5.770 -6.976 -9.388 1.00 0.00 H new ATOM 0 HZ2 LYS B 124 4.108 -6.726 -9.148 1.00 0.00 H new ATOM 0 HZ3 LYS B 124 4.639 -7.921 -10.232 1.00 0.00 H new ATOM 1401 N GLU B 125 -0.407 -4.232 -11.304 1.00 0.00 N ATOM 1402 CA GLU B 125 -1.008 -3.627 -10.136 1.00 0.00 C ATOM 1403 C GLU B 125 -1.404 -4.698 -9.136 1.00 0.00 C ATOM 1404 O GLU B 125 -1.958 -5.736 -9.499 1.00 0.00 O ATOM 1405 CB GLU B 125 -2.223 -2.796 -10.539 1.00 0.00 C ATOM 1406 CG GLU B 125 -3.474 -3.617 -10.817 1.00 0.00 C ATOM 1407 CD GLU B 125 -4.591 -2.791 -11.423 1.00 0.00 C ATOM 1408 OE1 GLU B 125 -4.328 -2.071 -12.410 1.00 0.00 O ATOM 1409 OE2 GLU B 125 -5.727 -2.861 -10.910 1.00 0.00 O ATOM 0 H GLU B 125 -0.654 -5.212 -11.441 1.00 0.00 H new ATOM 0 HA GLU B 125 -0.278 -2.968 -9.666 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -2.440 -2.081 -9.745 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -1.975 -2.218 -11.430 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -3.224 -4.435 -11.493 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -3.823 -4.067 -9.887 1.00 0.00 H new ATOM 1416 N TYR B 126 -1.104 -4.440 -7.880 1.00 0.00 N ATOM 1417 CA TYR B 126 -1.408 -5.375 -6.814 1.00 0.00 C ATOM 1418 C TYR B 126 -2.416 -4.795 -5.842 1.00 0.00 C ATOM 1419 O TYR B 126 -2.319 -3.633 -5.452 1.00 0.00 O ATOM 1420 CB TYR B 126 -0.137 -5.740 -6.058 1.00 0.00 C ATOM 1421 CG TYR B 126 0.689 -6.781 -6.758 1.00 0.00 C ATOM 1422 CD1 TYR B 126 1.302 -6.502 -7.969 1.00 0.00 C ATOM 1423 CD2 TYR B 126 0.855 -8.041 -6.209 1.00 0.00 C ATOM 1424 CE1 TYR B 126 2.060 -7.453 -8.620 1.00 0.00 C ATOM 1425 CE2 TYR B 126 1.612 -9.001 -6.847 1.00 0.00 C ATOM 1426 CZ TYR B 126 2.214 -8.704 -8.055 1.00 0.00 C ATOM 1427 OH TYR B 126 2.970 -9.657 -8.697 1.00 0.00 O ATOM 0 H TYR B 126 -0.646 -3.583 -7.570 1.00 0.00 H new ATOM 0 HA TYR B 126 -1.837 -6.267 -7.270 1.00 0.00 H new ATOM 0 HB2 TYR B 126 0.465 -4.842 -5.917 1.00 0.00 H new ATOM 0 HB3 TYR B 126 -0.404 -6.104 -5.066 1.00 0.00 H new ATOM 0 HD1 TYR B 126 1.184 -5.523 -8.411 1.00 0.00 H new ATOM 0 HD2 TYR B 126 0.384 -8.276 -5.266 1.00 0.00 H new ATOM 0 HE1 TYR B 126 2.530 -7.221 -9.565 1.00 0.00 H new ATOM 0 HE2 TYR B 126 1.734 -9.979 -6.405 1.00 0.00 H new ATOM 0 HH TYR B 126 2.978 -10.481 -8.166 1.00 0.00 H new ATOM 1437 N CYS B 127 -3.362 -5.621 -5.426 1.00 0.00 N ATOM 1438 CA CYS B 127 -4.360 -5.193 -4.466 1.00 0.00 C ATOM 1439 C CYS B 127 -4.049 -5.832 -3.125 1.00 0.00 C ATOM 1440 O CYS B 127 -4.053 -7.055 -2.988 1.00 0.00 O ATOM 1441 CB CYS B 127 -5.762 -5.575 -4.941 1.00 0.00 C ATOM 1442 SG CYS B 127 -6.327 -4.628 -6.392 1.00 0.00 S ATOM 0 H CYS B 127 -3.458 -6.587 -5.738 1.00 0.00 H new ATOM 0 HA CYS B 127 -4.333 -4.108 -4.366 1.00 0.00 H new ATOM 0 HB2 CYS B 127 -5.777 -6.638 -5.183 1.00 0.00 H new ATOM 0 HB3 CYS B 127 -6.467 -5.425 -4.123 1.00 0.00 H new ATOM 1447 N ILE B 128 -3.739 -4.996 -2.148 1.00 0.00 N ATOM 1448 CA ILE B 128 -3.376 -5.472 -0.827 1.00 0.00 C ATOM 1449 C ILE B 128 -3.878 -4.531 0.262 1.00 0.00 C ATOM 1450 O ILE B 128 -3.318 -4.567 1.377 1.00 0.00 O ATOM 1451 CB ILE B 128 -1.846 -5.607 -0.719 1.00 0.00 C ATOM 1452 CG1 ILE B 128 -1.174 -4.270 -1.039 1.00 0.00 C ATOM 1453 CG2 ILE B 128 -1.343 -6.702 -1.654 1.00 0.00 C ATOM 1454 CD1 ILE B 128 -1.162 -3.941 -2.512 1.00 0.00 C ATOM 1455 OXT ILE B 128 -4.828 -3.766 -0.009 1.00 0.00 O ATOM 0 H ILE B 128 -3.732 -3.981 -2.247 1.00 0.00 H new ATOM 0 HA ILE B 128 -3.846 -6.445 -0.684 1.00 0.00 H new ATOM 0 HB ILE B 128 -1.589 -5.886 0.303 1.00 0.00 H new ATOM 0 HG12 ILE B 128 -1.690 -3.475 -0.501 1.00 0.00 H new ATOM 0 HG13 ILE B 128 -0.148 -4.290 -0.671 1.00 0.00 H new ATOM 0 HG21 ILE B 128 -0.260 -6.786 -1.567 1.00 0.00 H new ATOM 0 HG22 ILE B 128 -1.803 -7.652 -1.383 1.00 0.00 H new ATOM 0 HG23 ILE B 128 -1.606 -6.452 -2.682 1.00 0.00 H new ATOM 0 HD11 ILE B 128 -0.671 -2.980 -2.666 1.00 0.00 H new ATOM 0 HD12 ILE B 128 -0.620 -4.717 -3.054 1.00 0.00 H new ATOM 0 HD13 ILE B 128 -2.186 -3.888 -2.881 1.00 0.00 H new TER 1467 ILE B 128