USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1093 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 154 CYS SG : rot -84:sc= 0.138 USER MOD Set 1.2: A 155 HIS :FLIP no HD1:sc= -0.146 F(o=-0.65,f=-0.0083) USER MOD Set 2.1: A 146 ASN : amide:sc= 0.771 K(o=0.84,f=-5.7!) USER MOD Set 2.2: A 147 GLN : amide:sc= 0.0651! C(o=0.84!,f=-5.3!) USER MOD Set 3.1: A 36 SER OG : rot -90:sc= 0.725 USER MOD Set 3.2: A 37 GLN : amide:sc= 0.643 K(o=1.4,f=-0.37) USER MOD Set 4.1: A 23 GLN :FLIP amide:sc= 0.0333 F(o=-0.64,f=0.53) USER MOD Set 4.2: A 24 CYS SG : rot -24:sc= 0.498 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -115:sc= 0.112 (180deg=0) USER MOD Single : A 17 HIS : no HD1:sc=-0.00361 X(o=-0.0036,f=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 CYS SG : rot -160:sc= -3.49! USER MOD Single : A 28 GLN : amide:sc= -0.247 K(o=-0.25,f=-4.2!) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 HIS : no HD1:sc= -0.229 X(o=-0.23,f=-0.0091) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 MET CE :methyl 164:sc= 0 (180deg=-0.466) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc=-0.00583 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 SER OG : rot 180:sc= 0.507 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ -145:sc= 1.89 (180deg=1.43) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 179:sc= 0.406 USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.0605 USER MOD Single : A 105 THR OG1 : rot 180:sc=-0.00181 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0.0147 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= 0.752 K(o=0.75,f=0) USER MOD Single : A 117 CYS SG : rot 38:sc= 0.00959 USER MOD Single : A 122 TYR OH : rot 166:sc= 0 USER MOD Single : A 123 THR OG1 : rot -22:sc= 1.24 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= -0.31 X(o=-0.31,f=-0.053) USER MOD Single : A 132 ASN :FLIP amide:sc= -0.0161 F(o=-1.8!,f=-0.016) USER MOD Single : A 138 LYS NZ :NH3+ -160:sc= 1.15 (180deg=-0.318) USER MOD Single : A 140 SER OG : rot 34:sc= 0.448 USER MOD Single : A 142 GLN : amide:sc= 0.079 K(o=0.079,f=-3.4!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 ASN : amide:sc=-0.000814 X(o=-0.00081,f=0) USER MOD Single : A 160 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 72 N ARG A 7 -8.726 -1.099 13.196 1.00 11.82 N ATOM 73 CA ARG A 7 -7.625 -1.634 12.412 1.00 10.55 C ATOM 74 C ARG A 7 -8.120 -2.286 11.128 1.00 10.23 C ATOM 75 O ARG A 7 -8.850 -3.277 11.152 1.00 10.82 O ATOM 76 CB ARG A 7 -6.816 -2.608 13.269 1.00 10.17 C ATOM 77 CG ARG A 7 -6.147 -1.900 14.433 1.00 10.82 C ATOM 78 CD ARG A 7 -5.635 -2.854 15.494 1.00 10.78 C ATOM 79 NE ARG A 7 -5.107 -2.115 16.636 1.00 11.40 N ATOM 80 CZ ARG A 7 -5.144 -2.534 17.895 1.00 11.72 C ATOM 81 NH1 ARG A 7 -5.627 -3.739 18.193 1.00 11.52 N ATOM 82 NH2 ARG A 7 -4.691 -1.735 18.852 1.00 12.40 N ATOM 0 HA ARG A 7 -6.974 -0.814 12.110 1.00 10.55 H new ATOM 0 HB2 ARG A 7 -7.471 -3.393 13.647 1.00 10.17 H new ATOM 0 HB3 ARG A 7 -6.059 -3.094 12.653 1.00 10.17 H new ATOM 0 HG2 ARG A 7 -5.316 -1.303 14.058 1.00 10.82 H new ATOM 0 HG3 ARG A 7 -6.857 -1.209 14.887 1.00 10.82 H new ATOM 0 HD2 ARG A 7 -6.441 -3.511 15.820 1.00 10.78 H new ATOM 0 HD3 ARG A 7 -4.856 -3.490 15.074 1.00 10.78 H new ATOM 0 HE ARG A 7 -4.677 -1.208 16.453 1.00 11.40 H new ATOM 0 HH11 ARG A 7 -5.972 -4.348 17.451 1.00 11.52 H new ATOM 0 HH12 ARG A 7 -5.652 -4.053 19.163 1.00 11.52 H new ATOM 0 HH21 ARG A 7 -4.322 -0.814 18.615 1.00 12.40 H new ATOM 0 HH22 ARG A 7 -4.712 -2.041 19.825 1.00 12.40 H new ATOM 96 N GLU A 8 -7.700 -1.709 10.014 1.00 9.44 N ATOM 97 CA GLU A 8 -8.166 -2.111 8.702 1.00 9.31 C ATOM 98 C GLU A 8 -7.112 -2.964 8.000 1.00 8.14 C ATOM 99 O GLU A 8 -5.913 -2.726 8.143 1.00 7.25 O ATOM 100 CB GLU A 8 -8.444 -0.865 7.859 1.00 9.68 C ATOM 101 CG GLU A 8 -9.309 0.179 8.548 1.00 10.51 C ATOM 102 CD GLU A 8 -10.724 -0.300 8.808 1.00 11.24 C ATOM 103 OE1 GLU A 8 -10.967 -0.890 9.877 1.00 11.58 O ATOM 104 OE2 GLU A 8 -11.592 -0.078 7.936 1.00 11.63 O ATOM 0 H GLU A 8 -7.024 -0.946 9.997 1.00 9.44 H new ATOM 0 HA GLU A 8 -9.078 -2.697 8.818 1.00 9.31 H new ATOM 0 HB2 GLU A 8 -7.494 -0.408 7.584 1.00 9.68 H new ATOM 0 HB3 GLU A 8 -8.931 -1.169 6.933 1.00 9.68 H new ATOM 0 HG2 GLU A 8 -8.846 0.458 9.495 1.00 10.51 H new ATOM 0 HG3 GLU A 8 -9.343 1.078 7.932 1.00 10.51 H new ATOM 111 N THR A 9 -7.557 -3.954 7.248 1.00 8.30 N ATOM 112 CA THR A 9 -6.658 -4.755 6.436 1.00 7.45 C ATOM 113 C THR A 9 -6.794 -4.340 4.976 1.00 7.45 C ATOM 114 O THR A 9 -7.785 -3.708 4.607 1.00 8.33 O ATOM 115 CB THR A 9 -6.965 -6.259 6.591 1.00 7.91 C ATOM 116 OG1 THR A 9 -8.349 -6.516 6.298 1.00 9.15 O ATOM 117 CG2 THR A 9 -6.658 -6.729 8.004 1.00 7.79 C ATOM 0 H THR A 9 -8.539 -4.224 7.182 1.00 8.30 H new ATOM 0 HA THR A 9 -5.635 -4.585 6.772 1.00 7.45 H new ATOM 0 HB THR A 9 -6.335 -6.806 5.889 1.00 7.91 H new ATOM 0 HG1 THR A 9 -8.532 -7.474 6.398 1.00 9.15 H new ATOM 0 HG21 THR A 9 -6.882 -7.792 8.090 1.00 7.79 H new ATOM 0 HG22 THR A 9 -5.603 -6.561 8.222 1.00 7.79 H new ATOM 0 HG23 THR A 9 -7.268 -6.171 8.714 1.00 7.79 H new ATOM 125 N GLY A 10 -5.806 -4.668 4.151 1.00 6.60 N ATOM 126 CA GLY A 10 -5.886 -4.320 2.747 1.00 6.81 C ATOM 127 C GLY A 10 -4.703 -4.800 1.937 1.00 6.40 C ATOM 128 O GLY A 10 -3.739 -5.343 2.472 1.00 5.81 O ATOM 0 H GLY A 10 -4.959 -5.164 4.427 1.00 6.60 H new ATOM 0 HA2 GLY A 10 -6.799 -4.743 2.328 1.00 6.81 H new ATOM 0 HA3 GLY A 10 -5.965 -3.237 2.653 1.00 6.81 H new ATOM 132 N ILE A 11 -4.792 -4.598 0.635 1.00 6.94 N ATOM 133 CA ILE A 11 -3.711 -4.928 -0.280 1.00 7.03 C ATOM 134 C ILE A 11 -3.279 -3.667 -1.007 1.00 6.81 C ATOM 135 O ILE A 11 -4.096 -2.783 -1.226 1.00 7.03 O ATOM 136 CB ILE A 11 -4.134 -5.998 -1.316 1.00 8.34 C ATOM 137 CG1 ILE A 11 -5.438 -5.588 -2.019 1.00 8.85 C ATOM 138 CG2 ILE A 11 -4.286 -7.360 -0.653 1.00 8.74 C ATOM 139 CD1 ILE A 11 -5.896 -6.573 -3.074 1.00 10.17 C ATOM 0 H ILE A 11 -5.614 -4.201 0.181 1.00 6.94 H new ATOM 0 HA ILE A 11 -2.888 -5.340 0.303 1.00 7.03 H new ATOM 0 HB ILE A 11 -3.349 -6.071 -2.069 1.00 8.34 H new ATOM 0 HG12 ILE A 11 -6.224 -5.478 -1.272 1.00 8.85 H new ATOM 0 HG13 ILE A 11 -5.299 -4.611 -2.482 1.00 8.85 H new ATOM 0 HG21 ILE A 11 -4.584 -8.097 -1.399 1.00 8.74 H new ATOM 0 HG22 ILE A 11 -3.336 -7.657 -0.209 1.00 8.74 H new ATOM 0 HG23 ILE A 11 -5.048 -7.303 0.125 1.00 8.74 H new ATOM 0 HD11 ILE A 11 -6.822 -6.217 -3.527 1.00 10.17 H new ATOM 0 HD12 ILE A 11 -5.129 -6.666 -3.842 1.00 10.17 H new ATOM 0 HD13 ILE A 11 -6.068 -7.546 -2.613 1.00 10.17 H new ATOM 151 N ILE A 12 -2.015 -3.560 -1.369 1.00 6.60 N ATOM 152 CA ILE A 12 -1.542 -2.356 -2.049 1.00 6.73 C ATOM 153 C ILE A 12 -1.901 -2.396 -3.536 1.00 7.92 C ATOM 154 O ILE A 12 -1.677 -3.400 -4.212 1.00 8.73 O ATOM 155 CB ILE A 12 -0.019 -2.129 -1.858 1.00 6.65 C ATOM 156 CG1 ILE A 12 0.271 -1.539 -0.471 1.00 5.65 C ATOM 157 CG2 ILE A 12 0.540 -1.216 -2.937 1.00 7.21 C ATOM 158 CD1 ILE A 12 -0.019 -2.480 0.678 1.00 4.75 C ATOM 0 H ILE A 12 -1.304 -4.274 -1.210 1.00 6.60 H new ATOM 0 HA ILE A 12 -2.051 -1.510 -1.588 1.00 6.73 H new ATOM 0 HB ILE A 12 0.472 -3.099 -1.940 1.00 6.65 H new ATOM 0 HG12 ILE A 12 1.319 -1.242 -0.427 1.00 5.65 H new ATOM 0 HG13 ILE A 12 -0.322 -0.634 -0.343 1.00 5.65 H new ATOM 0 HG21 ILE A 12 1.609 -1.075 -2.777 1.00 7.21 H new ATOM 0 HG22 ILE A 12 0.376 -1.667 -3.916 1.00 7.21 H new ATOM 0 HG23 ILE A 12 0.037 -0.250 -2.893 1.00 7.21 H new ATOM 0 HD11 ILE A 12 0.213 -1.985 1.621 1.00 4.75 H new ATOM 0 HD12 ILE A 12 -1.073 -2.758 0.664 1.00 4.75 H new ATOM 0 HD13 ILE A 12 0.594 -3.376 0.578 1.00 4.75 H new ATOM 170 N GLU A 13 -2.472 -1.297 -4.021 1.00 8.09 N ATOM 171 CA GLU A 13 -2.940 -1.199 -5.402 1.00 9.21 C ATOM 172 C GLU A 13 -1.769 -1.045 -6.367 1.00 9.77 C ATOM 173 O GLU A 13 -1.701 -1.729 -7.385 1.00 10.76 O ATOM 174 CB GLU A 13 -3.923 -0.017 -5.530 1.00 9.28 C ATOM 175 CG GLU A 13 -4.465 0.231 -6.937 1.00 10.17 C ATOM 176 CD GLU A 13 -3.595 1.160 -7.767 1.00 10.58 C ATOM 177 OE1 GLU A 13 -3.406 2.328 -7.361 1.00 10.86 O ATOM 178 OE2 GLU A 13 -3.114 0.732 -8.835 1.00 10.79 O ATOM 0 H GLU A 13 -2.623 -0.452 -3.471 1.00 8.09 H new ATOM 0 HA GLU A 13 -3.459 -2.120 -5.666 1.00 9.21 H new ATOM 0 HB2 GLU A 13 -4.765 -0.191 -4.860 1.00 9.28 H new ATOM 0 HB3 GLU A 13 -3.424 0.889 -5.186 1.00 9.28 H new ATOM 0 HG2 GLU A 13 -4.560 -0.724 -7.455 1.00 10.17 H new ATOM 0 HG3 GLU A 13 -5.467 0.654 -6.862 1.00 10.17 H new ATOM 185 N LYS A 14 -0.846 -0.155 -6.040 1.00 9.28 N ATOM 186 CA LYS A 14 0.316 0.071 -6.883 1.00 9.97 C ATOM 187 C LYS A 14 1.449 0.673 -6.059 1.00 9.41 C ATOM 188 O LYS A 14 1.237 1.603 -5.277 1.00 8.54 O ATOM 189 CB LYS A 14 -0.050 0.998 -8.050 1.00 10.66 C ATOM 190 CG LYS A 14 0.672 0.671 -9.352 1.00 11.85 C ATOM 191 CD LYS A 14 2.165 0.943 -9.265 1.00 12.43 C ATOM 192 CE LYS A 14 2.885 0.483 -10.520 1.00 13.38 C ATOM 193 NZ LYS A 14 4.354 0.724 -10.433 1.00 14.06 N ATOM 0 H LYS A 14 -0.879 0.421 -5.199 1.00 9.28 H new ATOM 0 HA LYS A 14 0.650 -0.883 -7.290 1.00 9.97 H new ATOM 0 HB2 LYS A 14 -1.125 0.944 -8.220 1.00 10.66 H new ATOM 0 HB3 LYS A 14 0.177 2.026 -7.769 1.00 10.66 H new ATOM 0 HG2 LYS A 14 0.509 -0.377 -9.602 1.00 11.85 H new ATOM 0 HG3 LYS A 14 0.243 1.262 -10.161 1.00 11.85 H new ATOM 0 HD2 LYS A 14 2.334 2.010 -9.117 1.00 12.43 H new ATOM 0 HD3 LYS A 14 2.580 0.431 -8.397 1.00 12.43 H new ATOM 0 HE2 LYS A 14 2.699 -0.579 -10.677 1.00 13.38 H new ATOM 0 HE3 LYS A 14 2.481 1.009 -11.385 1.00 13.38 H new ATOM 0 HZ1 LYS A 14 4.634 1.424 -11.150 1.00 14.06 H new ATOM 0 HZ2 LYS A 14 4.591 1.084 -9.487 1.00 14.06 H new ATOM 0 HZ3 LYS A 14 4.863 -0.167 -10.602 1.00 14.06 H new ATOM 207 N LEU A 15 2.641 0.122 -6.224 1.00 10.08 N ATOM 208 CA LEU A 15 3.824 0.647 -5.560 1.00 9.92 C ATOM 209 C LEU A 15 4.339 1.890 -6.271 1.00 10.73 C ATOM 210 O LEU A 15 4.818 1.822 -7.407 1.00 11.73 O ATOM 211 CB LEU A 15 4.934 -0.404 -5.507 1.00 10.23 C ATOM 212 CG LEU A 15 5.012 -1.240 -4.222 1.00 9.31 C ATOM 213 CD1 LEU A 15 5.250 -0.349 -3.011 1.00 9.56 C ATOM 214 CD2 LEU A 15 3.759 -2.080 -4.041 1.00 8.41 C ATOM 0 H LEU A 15 2.815 -0.691 -6.814 1.00 10.08 H new ATOM 0 HA LEU A 15 3.537 0.912 -4.542 1.00 9.92 H new ATOM 0 HB2 LEU A 15 4.805 -1.082 -6.350 1.00 10.23 H new ATOM 0 HB3 LEU A 15 5.890 0.100 -5.647 1.00 10.23 H new ATOM 0 HG LEU A 15 5.859 -1.920 -4.313 1.00 9.31 H new ATOM 0 HD11 LEU A 15 5.302 -0.963 -2.112 1.00 9.56 H new ATOM 0 HD12 LEU A 15 6.188 0.191 -3.136 1.00 9.56 H new ATOM 0 HD13 LEU A 15 4.431 0.364 -2.917 1.00 9.56 H new ATOM 0 HD21 LEU A 15 3.841 -2.662 -3.123 1.00 8.41 H new ATOM 0 HD22 LEU A 15 2.889 -1.427 -3.980 1.00 8.41 H new ATOM 0 HD23 LEU A 15 3.647 -2.755 -4.890 1.00 8.41 H new ATOM 226 N LEU A 16 4.200 3.021 -5.606 1.00 10.36 N ATOM 227 CA LEU A 16 4.808 4.259 -6.058 1.00 11.12 C ATOM 228 C LEU A 16 5.934 4.606 -5.096 1.00 11.25 C ATOM 229 O LEU A 16 6.165 3.884 -4.127 1.00 10.76 O ATOM 230 CB LEU A 16 3.778 5.398 -6.114 1.00 10.89 C ATOM 231 CG LEU A 16 2.541 5.140 -6.988 1.00 11.08 C ATOM 232 CD1 LEU A 16 1.633 6.357 -7.010 1.00 11.36 C ATOM 233 CD2 LEU A 16 2.931 4.755 -8.407 1.00 11.20 C ATOM 0 H LEU A 16 3.665 3.108 -4.742 1.00 10.36 H new ATOM 0 HA LEU A 16 5.196 4.129 -7.068 1.00 11.12 H new ATOM 0 HB2 LEU A 16 3.444 5.610 -5.098 1.00 10.89 H new ATOM 0 HB3 LEU A 16 4.277 6.296 -6.480 1.00 10.89 H new ATOM 0 HG LEU A 16 2.000 4.304 -6.546 1.00 11.08 H new ATOM 0 HD11 LEU A 16 0.764 6.151 -7.635 1.00 11.36 H new ATOM 0 HD12 LEU A 16 1.305 6.585 -5.996 1.00 11.36 H new ATOM 0 HD13 LEU A 16 2.177 7.210 -7.415 1.00 11.36 H new ATOM 0 HD21 LEU A 16 2.031 4.580 -8.997 1.00 11.20 H new ATOM 0 HD22 LEU A 16 3.509 5.562 -8.857 1.00 11.20 H new ATOM 0 HD23 LEU A 16 3.533 3.847 -8.385 1.00 11.20 H new ATOM 245 N HIS A 17 6.651 5.680 -5.362 1.00 12.03 N ATOM 246 CA HIS A 17 7.749 6.067 -4.493 1.00 12.45 C ATOM 247 C HIS A 17 7.309 7.164 -3.534 1.00 11.97 C ATOM 248 O HIS A 17 6.556 8.064 -3.914 1.00 11.98 O ATOM 249 CB HIS A 17 8.965 6.515 -5.313 1.00 13.69 C ATOM 250 CG HIS A 17 9.548 5.429 -6.171 1.00 14.50 C ATOM 251 ND1 HIS A 17 10.155 5.651 -7.390 1.00 15.26 N ATOM 252 CD2 HIS A 17 9.626 4.090 -5.957 1.00 14.80 C ATOM 253 CE1 HIS A 17 10.566 4.468 -7.868 1.00 15.94 C ATOM 254 NE2 HIS A 17 10.270 3.488 -7.034 1.00 15.71 N ATOM 0 H HIS A 17 6.498 6.294 -6.162 1.00 12.03 H new ATOM 0 HA HIS A 17 8.043 5.196 -3.907 1.00 12.45 H new ATOM 0 HB2 HIS A 17 8.675 7.352 -5.949 1.00 13.69 H new ATOM 0 HB3 HIS A 17 9.735 6.882 -4.634 1.00 13.69 H new ATOM 0 HD2 HIS A 17 9.248 3.573 -5.087 1.00 14.80 H new ATOM 0 HE1 HIS A 17 11.073 4.334 -8.812 1.00 15.94 H new ATOM 0 HE2 HIS A 17 10.472 2.495 -7.154 1.00 15.71 H new ATOM 262 N SER A 18 7.773 7.045 -2.286 1.00 11.65 N ATOM 263 CA SER A 18 7.464 7.987 -1.204 1.00 11.38 C ATOM 264 C SER A 18 6.048 7.755 -0.659 1.00 10.26 C ATOM 265 O SER A 18 5.842 7.694 0.556 1.00 9.97 O ATOM 266 CB SER A 18 7.641 9.438 -1.666 1.00 12.26 C ATOM 267 OG SER A 18 7.668 10.333 -0.570 1.00 13.01 O ATOM 0 H SER A 18 8.383 6.281 -1.994 1.00 11.65 H new ATOM 0 HA SER A 18 8.171 7.805 -0.394 1.00 11.38 H new ATOM 0 HB2 SER A 18 8.567 9.529 -2.234 1.00 12.26 H new ATOM 0 HB3 SER A 18 6.826 9.709 -2.338 1.00 12.26 H new ATOM 0 HG SER A 18 7.784 11.249 -0.898 1.00 13.01 H new ATOM 273 N TYR A 19 5.089 7.606 -1.562 1.00 9.79 N ATOM 274 CA TYR A 19 3.699 7.363 -1.193 1.00 8.84 C ATOM 275 C TYR A 19 3.156 6.166 -1.970 1.00 8.40 C ATOM 276 O TYR A 19 3.650 5.851 -3.051 1.00 9.01 O ATOM 277 CB TYR A 19 2.848 8.612 -1.467 1.00 9.06 C ATOM 278 CG TYR A 19 2.947 9.125 -2.886 1.00 9.82 C ATOM 279 CD1 TYR A 19 2.143 8.609 -3.891 1.00 10.54 C ATOM 280 CD2 TYR A 19 3.843 10.135 -3.215 1.00 9.96 C ATOM 281 CE1 TYR A 19 2.229 9.080 -5.186 1.00 11.35 C ATOM 282 CE2 TYR A 19 3.936 10.611 -4.509 1.00 10.77 C ATOM 283 CZ TYR A 19 3.126 10.083 -5.492 1.00 11.46 C ATOM 284 OH TYR A 19 3.210 10.561 -6.780 1.00 12.34 O ATOM 0 H TYR A 19 5.250 7.650 -2.568 1.00 9.79 H new ATOM 0 HA TYR A 19 3.650 7.141 -0.127 1.00 8.84 H new ATOM 0 HB2 TYR A 19 1.805 8.384 -1.246 1.00 9.06 H new ATOM 0 HB3 TYR A 19 3.153 9.404 -0.783 1.00 9.06 H new ATOM 0 HD1 TYR A 19 1.438 7.825 -3.657 1.00 10.54 H new ATOM 0 HD2 TYR A 19 4.477 10.554 -2.447 1.00 9.96 H new ATOM 0 HE1 TYR A 19 1.596 8.665 -5.957 1.00 11.35 H new ATOM 0 HE2 TYR A 19 4.640 11.394 -4.749 1.00 10.77 H new ATOM 0 HH TYR A 19 3.890 11.266 -6.824 1.00 12.34 H new ATOM 294 N GLY A 20 2.155 5.497 -1.416 1.00 7.52 N ATOM 295 CA GLY A 20 1.551 4.362 -2.093 1.00 7.27 C ATOM 296 C GLY A 20 0.057 4.286 -1.838 1.00 6.77 C ATOM 297 O GLY A 20 -0.443 4.914 -0.906 1.00 6.55 O ATOM 0 H GLY A 20 1.748 5.719 -0.508 1.00 7.52 H new ATOM 0 HA2 GLY A 20 1.734 4.438 -3.165 1.00 7.27 H new ATOM 0 HA3 GLY A 20 2.025 3.441 -1.754 1.00 7.27 H new ATOM 301 N PHE A 21 -0.657 3.513 -2.653 1.00 6.90 N ATOM 302 CA PHE A 21 -2.109 3.406 -2.533 1.00 6.86 C ATOM 303 C PHE A 21 -2.520 2.039 -2.003 1.00 6.50 C ATOM 304 O PHE A 21 -2.022 1.002 -2.452 1.00 6.61 O ATOM 305 CB PHE A 21 -2.785 3.656 -3.882 1.00 7.80 C ATOM 306 CG PHE A 21 -2.683 5.082 -4.358 1.00 8.23 C ATOM 307 CD1 PHE A 21 -1.638 5.487 -5.172 1.00 8.55 C ATOM 308 CD2 PHE A 21 -3.641 6.016 -3.991 1.00 8.48 C ATOM 309 CE1 PHE A 21 -1.551 6.795 -5.614 1.00 9.04 C ATOM 310 CE2 PHE A 21 -3.558 7.325 -4.428 1.00 8.99 C ATOM 311 CZ PHE A 21 -2.511 7.713 -5.242 1.00 9.24 C ATOM 0 H PHE A 21 -0.254 2.952 -3.403 1.00 6.90 H new ATOM 0 HA PHE A 21 -2.434 4.167 -1.824 1.00 6.86 H new ATOM 0 HB2 PHE A 21 -2.338 3.000 -4.629 1.00 7.80 H new ATOM 0 HB3 PHE A 21 -3.837 3.382 -3.807 1.00 7.80 H new ATOM 0 HD1 PHE A 21 -0.882 4.773 -5.465 1.00 8.55 H new ATOM 0 HD2 PHE A 21 -4.462 5.717 -3.356 1.00 8.48 H new ATOM 0 HE1 PHE A 21 -0.732 7.097 -6.250 1.00 9.04 H new ATOM 0 HE2 PHE A 21 -4.310 8.043 -4.134 1.00 8.99 H new ATOM 0 HZ PHE A 21 -2.444 8.734 -5.587 1.00 9.24 H new ATOM 321 N ILE A 22 -3.431 2.048 -1.047 1.00 6.33 N ATOM 322 CA ILE A 22 -3.979 0.828 -0.489 1.00 6.25 C ATOM 323 C ILE A 22 -5.341 0.544 -1.119 1.00 7.28 C ATOM 324 O ILE A 22 -6.221 1.404 -1.119 1.00 7.75 O ATOM 325 CB ILE A 22 -4.127 0.926 1.046 1.00 5.64 C ATOM 326 CG1 ILE A 22 -2.770 1.198 1.696 1.00 4.79 C ATOM 327 CG2 ILE A 22 -4.751 -0.345 1.613 1.00 5.81 C ATOM 328 CD1 ILE A 22 -2.838 1.409 3.196 1.00 4.54 C ATOM 0 H ILE A 22 -3.811 2.901 -0.637 1.00 6.33 H new ATOM 0 HA ILE A 22 -3.289 0.014 -0.711 1.00 6.25 H new ATOM 0 HB ILE A 22 -4.792 1.759 1.274 1.00 5.64 H new ATOM 0 HG12 ILE A 22 -2.104 0.361 1.487 1.00 4.79 H new ATOM 0 HG13 ILE A 22 -2.328 2.081 1.235 1.00 4.79 H new ATOM 0 HG21 ILE A 22 -4.845 -0.253 2.695 1.00 5.81 H new ATOM 0 HG22 ILE A 22 -5.738 -0.493 1.174 1.00 5.81 H new ATOM 0 HG23 ILE A 22 -4.117 -1.199 1.376 1.00 5.81 H new ATOM 0 HD11 ILE A 22 -1.836 1.596 3.583 1.00 4.54 H new ATOM 0 HD12 ILE A 22 -3.477 2.265 3.414 1.00 4.54 H new ATOM 0 HD13 ILE A 22 -3.250 0.518 3.670 1.00 4.54 H new ATOM 340 N GLN A 23 -5.499 -0.652 -1.659 1.00 7.79 N ATOM 341 CA GLN A 23 -6.713 -1.036 -2.351 1.00 8.94 C ATOM 342 C GLN A 23 -7.798 -1.411 -1.348 1.00 9.25 C ATOM 343 O GLN A 23 -7.575 -2.212 -0.440 1.00 8.80 O ATOM 344 CB GLN A 23 -6.420 -2.207 -3.289 1.00 9.58 C ATOM 345 CG GLN A 23 -7.509 -2.492 -4.315 1.00 10.42 C ATOM 346 CD GLN A 23 -7.923 -1.272 -5.120 1.00 11.33 C ATOM 347 OE1 GLN A 23 -8.989 -0.612 -4.695 1.00 11.80 O flip ATOM 348 NE2 GLN A 23 -7.318 -0.951 -6.137 1.00 11.75 N flip ATOM 0 H GLN A 23 -4.788 -1.383 -1.629 1.00 7.79 H new ATOM 0 HA GLN A 23 -7.072 -0.192 -2.940 1.00 8.94 H new ATOM 0 HB2 GLN A 23 -5.487 -2.007 -3.816 1.00 9.58 H new ATOM 0 HB3 GLN A 23 -6.262 -3.103 -2.690 1.00 9.58 H new ATOM 0 HG2 GLN A 23 -7.159 -3.266 -4.998 1.00 10.42 H new ATOM 0 HG3 GLN A 23 -8.384 -2.892 -3.802 1.00 10.42 H new ATOM 0 HE21 GLN A 23 -6.500 -1.484 -6.434 1.00 11.75 H new ATOM 0 HE22 GLN A 23 -7.632 -0.151 -6.686 1.00 11.75 H new ATOM 357 N CYS A 24 -8.973 -0.837 -1.546 1.00 10.15 N ATOM 358 CA CYS A 24 -10.105 -0.975 -0.637 1.00 10.78 C ATOM 359 C CYS A 24 -10.698 -2.392 -0.592 1.00 11.54 C ATOM 360 O CYS A 24 -11.692 -2.601 0.076 1.00 12.25 O ATOM 361 CB CYS A 24 -11.186 0.030 -1.029 1.00 11.55 C ATOM 362 SG CYS A 24 -11.551 0.045 -2.802 1.00 12.34 S ATOM 0 H CYS A 24 -9.173 -0.251 -2.357 1.00 10.15 H new ATOM 0 HA CYS A 24 -9.730 -0.775 0.367 1.00 10.78 H new ATOM 0 HB2 CYS A 24 -12.100 -0.199 -0.480 1.00 11.55 H new ATOM 0 HB3 CYS A 24 -10.871 1.028 -0.723 1.00 11.55 H new ATOM 0 HG CYS A 24 -10.526 -0.409 -3.460 1.00 12.34 H new ATOM 368 N CYS A 25 -10.108 -3.355 -1.298 1.00 11.53 N ATOM 369 CA CYS A 25 -10.707 -4.696 -1.439 1.00 12.39 C ATOM 370 C CYS A 25 -11.094 -5.340 -0.097 1.00 12.38 C ATOM 371 O CYS A 25 -12.005 -6.164 -0.045 1.00 13.33 O ATOM 372 CB CYS A 25 -9.743 -5.625 -2.177 1.00 12.31 C ATOM 373 SG CYS A 25 -9.346 -5.089 -3.853 1.00 13.22 S ATOM 0 H CYS A 25 -9.218 -3.240 -1.783 1.00 11.53 H new ATOM 0 HA CYS A 25 -11.627 -4.558 -2.008 1.00 12.39 H new ATOM 0 HB2 CYS A 25 -8.820 -5.703 -1.603 1.00 12.31 H new ATOM 0 HB3 CYS A 25 -10.178 -6.624 -2.219 1.00 12.31 H new ATOM 0 HG CYS A 25 -8.891 -6.098 -4.535 1.00 13.22 H new ATOM 379 N GLU A 26 -10.422 -4.958 0.981 1.00 11.39 N ATOM 380 CA GLU A 26 -10.685 -5.555 2.287 1.00 11.41 C ATOM 381 C GLU A 26 -11.590 -4.672 3.154 1.00 11.59 C ATOM 382 O GLU A 26 -12.018 -5.089 4.233 1.00 11.90 O ATOM 383 CB GLU A 26 -9.370 -5.821 3.018 1.00 10.37 C ATOM 384 CG GLU A 26 -8.549 -6.960 2.434 1.00 10.23 C ATOM 385 CD GLU A 26 -9.154 -8.319 2.716 1.00 11.09 C ATOM 386 OE1 GLU A 26 -9.370 -8.649 3.901 1.00 11.40 O ATOM 387 OE2 GLU A 26 -9.415 -9.065 1.749 1.00 11.58 O ATOM 0 H GLU A 26 -9.695 -4.242 0.979 1.00 11.39 H new ATOM 0 HA GLU A 26 -11.208 -6.496 2.114 1.00 11.41 H new ATOM 0 HB2 GLU A 26 -8.770 -4.911 3.004 1.00 10.37 H new ATOM 0 HB3 GLU A 26 -9.587 -6.044 4.063 1.00 10.37 H new ATOM 0 HG2 GLU A 26 -8.460 -6.823 1.356 1.00 10.23 H new ATOM 0 HG3 GLU A 26 -7.540 -6.923 2.845 1.00 10.23 H new ATOM 394 N ARG A 27 -11.894 -3.467 2.676 1.00 11.56 N ATOM 395 CA ARG A 27 -12.638 -2.478 3.470 1.00 11.81 C ATOM 396 C ARG A 27 -13.427 -1.532 2.561 1.00 12.61 C ATOM 397 O ARG A 27 -13.727 -1.863 1.421 1.00 12.99 O ATOM 398 CB ARG A 27 -11.681 -1.675 4.362 1.00 10.80 C ATOM 399 CG ARG A 27 -11.196 -2.436 5.588 1.00 10.69 C ATOM 400 CD ARG A 27 -12.342 -2.752 6.542 1.00 10.96 C ATOM 401 NE ARG A 27 -11.910 -3.572 7.675 1.00 11.21 N ATOM 402 CZ ARG A 27 -12.428 -3.484 8.899 1.00 11.82 C ATOM 403 NH1 ARG A 27 -13.365 -2.580 9.165 1.00 12.24 N ATOM 404 NH2 ARG A 27 -11.994 -4.287 9.862 1.00 12.19 N ATOM 0 H ARG A 27 -11.638 -3.147 1.742 1.00 11.56 H new ATOM 0 HA ARG A 27 -13.343 -3.016 4.104 1.00 11.81 H new ATOM 0 HB2 ARG A 27 -10.818 -1.371 3.770 1.00 10.80 H new ATOM 0 HB3 ARG A 27 -12.182 -0.763 4.687 1.00 10.80 H new ATOM 0 HG2 ARG A 27 -10.716 -3.363 5.275 1.00 10.69 H new ATOM 0 HG3 ARG A 27 -10.441 -1.846 6.108 1.00 10.69 H new ATOM 0 HD2 ARG A 27 -12.771 -1.821 6.913 1.00 10.96 H new ATOM 0 HD3 ARG A 27 -13.131 -3.273 5.999 1.00 10.96 H new ATOM 0 HE ARG A 27 -11.167 -4.253 7.518 1.00 11.21 H new ATOM 0 HH11 ARG A 27 -13.690 -1.951 8.431 1.00 12.24 H new ATOM 0 HH12 ARG A 27 -13.760 -2.515 10.103 1.00 12.24 H new ATOM 0 HH21 ARG A 27 -11.264 -4.971 9.665 1.00 12.19 H new ATOM 0 HH22 ARG A 27 -12.390 -4.220 10.799 1.00 12.19 H new ATOM 418 N GLN A 28 -13.802 -0.370 3.081 1.00 12.98 N ATOM 419 CA GLN A 28 -14.513 0.620 2.279 1.00 13.75 C ATOM 420 C GLN A 28 -13.681 1.889 2.132 1.00 13.19 C ATOM 421 O GLN A 28 -14.191 2.944 1.747 1.00 13.79 O ATOM 422 CB GLN A 28 -15.875 0.969 2.898 1.00 14.84 C ATOM 423 CG GLN A 28 -16.852 -0.198 2.967 1.00 15.37 C ATOM 424 CD GLN A 28 -16.806 -0.947 4.288 1.00 16.20 C ATOM 425 OE1 GLN A 28 -15.775 -1.006 4.960 1.00 16.53 O ATOM 426 NE2 GLN A 28 -17.934 -1.522 4.670 1.00 16.66 N ATOM 0 H GLN A 28 -13.628 -0.090 4.046 1.00 12.98 H new ATOM 0 HA GLN A 28 -14.681 0.182 1.295 1.00 13.75 H new ATOM 0 HB2 GLN A 28 -15.715 1.353 3.905 1.00 14.84 H new ATOM 0 HB3 GLN A 28 -16.329 1.773 2.319 1.00 14.84 H new ATOM 0 HG2 GLN A 28 -17.863 0.175 2.804 1.00 15.37 H new ATOM 0 HG3 GLN A 28 -16.634 -0.893 2.156 1.00 15.37 H new ATOM 0 HE21 GLN A 28 -18.767 -1.450 4.085 1.00 16.66 H new ATOM 0 HE22 GLN A 28 -17.971 -2.037 5.549 1.00 16.66 H new ATOM 435 N ALA A 29 -12.396 1.778 2.408 1.00 12.09 N ATOM 436 CA ALA A 29 -11.514 2.934 2.395 1.00 11.54 C ATOM 437 C ALA A 29 -10.268 2.684 1.557 1.00 10.45 C ATOM 438 O ALA A 29 -9.439 1.838 1.893 1.00 9.76 O ATOM 439 CB ALA A 29 -11.125 3.316 3.814 1.00 11.51 C ATOM 0 H ALA A 29 -11.937 0.898 2.645 1.00 12.09 H new ATOM 0 HA ALA A 29 -12.060 3.760 1.938 1.00 11.54 H new ATOM 0 HB1 ALA A 29 -10.465 4.183 3.789 1.00 11.51 H new ATOM 0 HB2 ALA A 29 -12.022 3.559 4.384 1.00 11.51 H new ATOM 0 HB3 ALA A 29 -10.609 2.480 4.287 1.00 11.51 H new ATOM 445 N ARG A 30 -10.158 3.406 0.454 1.00 10.38 N ATOM 446 CA ARG A 30 -8.934 3.421 -0.331 1.00 9.50 C ATOM 447 C ARG A 30 -8.014 4.509 0.219 1.00 8.84 C ATOM 448 O ARG A 30 -8.255 5.698 0.012 1.00 9.27 O ATOM 449 CB ARG A 30 -9.241 3.677 -1.812 1.00 10.02 C ATOM 450 CG ARG A 30 -8.017 3.576 -2.716 1.00 10.55 C ATOM 451 CD ARG A 30 -8.342 3.958 -4.153 1.00 11.11 C ATOM 452 NE ARG A 30 -8.698 5.374 -4.288 1.00 11.48 N ATOM 453 CZ ARG A 30 -8.904 5.985 -5.458 1.00 12.06 C ATOM 454 NH1 ARG A 30 -8.824 5.296 -6.595 1.00 12.33 N ATOM 455 NH2 ARG A 30 -9.198 7.279 -5.490 1.00 12.51 N ATOM 0 H ARG A 30 -10.905 3.992 0.081 1.00 10.38 H new ATOM 0 HA ARG A 30 -8.443 2.451 -0.258 1.00 9.50 H new ATOM 0 HB2 ARG A 30 -9.991 2.961 -2.148 1.00 10.02 H new ATOM 0 HB3 ARG A 30 -9.679 4.670 -1.917 1.00 10.02 H new ATOM 0 HG2 ARG A 30 -7.230 4.227 -2.336 1.00 10.55 H new ATOM 0 HG3 ARG A 30 -7.629 2.558 -2.690 1.00 10.55 H new ATOM 0 HD2 ARG A 30 -7.483 3.740 -4.787 1.00 11.11 H new ATOM 0 HD3 ARG A 30 -9.167 3.343 -4.512 1.00 11.11 H new ATOM 0 HE ARG A 30 -8.794 5.927 -3.436 1.00 11.48 H new ATOM 0 HH11 ARG A 30 -8.605 4.300 -6.573 1.00 12.33 H new ATOM 0 HH12 ARG A 30 -8.982 5.764 -7.487 1.00 12.33 H new ATOM 0 HH21 ARG A 30 -9.267 7.808 -4.621 1.00 12.51 H new ATOM 0 HH22 ARG A 30 -9.355 7.744 -6.384 1.00 12.51 H new ATOM 469 N LEU A 31 -6.984 4.101 0.942 1.00 7.95 N ATOM 470 CA LEU A 31 -6.091 5.050 1.593 1.00 7.50 C ATOM 471 C LEU A 31 -4.758 5.133 0.873 1.00 6.89 C ATOM 472 O LEU A 31 -4.401 4.246 0.100 1.00 6.69 O ATOM 473 CB LEU A 31 -5.854 4.646 3.050 1.00 7.26 C ATOM 474 CG LEU A 31 -7.077 4.736 3.967 1.00 8.06 C ATOM 475 CD1 LEU A 31 -6.737 4.211 5.353 1.00 8.13 C ATOM 476 CD2 LEU A 31 -7.581 6.172 4.050 1.00 8.76 C ATOM 0 H LEU A 31 -6.744 3.121 1.094 1.00 7.95 H new ATOM 0 HA LEU A 31 -6.569 6.029 1.558 1.00 7.50 H new ATOM 0 HB2 LEU A 31 -5.482 3.621 3.069 1.00 7.26 H new ATOM 0 HB3 LEU A 31 -5.067 5.278 3.461 1.00 7.26 H new ATOM 0 HG LEU A 31 -7.870 4.119 3.546 1.00 8.06 H new ATOM 0 HD11 LEU A 31 -7.616 4.281 5.994 1.00 8.13 H new ATOM 0 HD12 LEU A 31 -6.423 3.170 5.281 1.00 8.13 H new ATOM 0 HD13 LEU A 31 -5.929 4.805 5.779 1.00 8.13 H new ATOM 0 HD21 LEU A 31 -8.450 6.215 4.706 1.00 8.76 H new ATOM 0 HD22 LEU A 31 -6.793 6.812 4.449 1.00 8.76 H new ATOM 0 HD23 LEU A 31 -7.860 6.518 3.055 1.00 8.76 H new ATOM 488 N PHE A 32 -4.033 6.207 1.125 1.00 6.90 N ATOM 489 CA PHE A 32 -2.665 6.327 0.664 1.00 6.64 C ATOM 490 C PHE A 32 -1.746 6.271 1.875 1.00 6.41 C ATOM 491 O PHE A 32 -1.969 6.970 2.865 1.00 6.77 O ATOM 492 CB PHE A 32 -2.456 7.623 -0.142 1.00 7.31 C ATOM 493 CG PHE A 32 -2.695 8.896 0.632 1.00 7.84 C ATOM 494 CD1 PHE A 32 -3.984 9.374 0.837 1.00 8.15 C ATOM 495 CD2 PHE A 32 -1.629 9.617 1.154 1.00 8.20 C ATOM 496 CE1 PHE A 32 -4.203 10.541 1.547 1.00 8.79 C ATOM 497 CE2 PHE A 32 -1.844 10.787 1.863 1.00 8.87 C ATOM 498 CZ PHE A 32 -3.130 11.249 2.061 1.00 9.15 C ATOM 0 H PHE A 32 -4.373 7.013 1.650 1.00 6.90 H new ATOM 0 HA PHE A 32 -2.431 5.503 -0.011 1.00 6.64 H new ATOM 0 HB2 PHE A 32 -1.436 7.634 -0.526 1.00 7.31 H new ATOM 0 HB3 PHE A 32 -3.122 7.609 -1.005 1.00 7.31 H new ATOM 0 HD1 PHE A 32 -4.825 8.827 0.437 1.00 8.15 H new ATOM 0 HD2 PHE A 32 -0.620 9.261 1.005 1.00 8.20 H new ATOM 0 HE1 PHE A 32 -5.210 10.899 1.700 1.00 8.79 H new ATOM 0 HE2 PHE A 32 -1.005 11.338 2.261 1.00 8.87 H new ATOM 0 HZ PHE A 32 -3.298 12.160 2.615 1.00 9.15 H new ATOM 508 N PHE A 33 -0.741 5.418 1.820 1.00 6.11 N ATOM 509 CA PHE A 33 0.130 5.225 2.964 1.00 6.17 C ATOM 510 C PHE A 33 1.510 5.788 2.672 1.00 6.72 C ATOM 511 O PHE A 33 2.007 5.704 1.546 1.00 6.85 O ATOM 512 CB PHE A 33 0.210 3.737 3.359 1.00 5.47 C ATOM 513 CG PHE A 33 1.029 2.875 2.438 1.00 5.08 C ATOM 514 CD1 PHE A 33 0.532 2.475 1.207 1.00 5.04 C ATOM 515 CD2 PHE A 33 2.301 2.459 2.810 1.00 5.11 C ATOM 516 CE1 PHE A 33 1.287 1.680 0.365 1.00 5.13 C ATOM 517 CE2 PHE A 33 3.058 1.665 1.972 1.00 5.17 C ATOM 518 CZ PHE A 33 2.552 1.277 0.748 1.00 5.21 C ATOM 0 H PHE A 33 -0.509 4.852 1.004 1.00 6.11 H new ATOM 0 HA PHE A 33 -0.291 5.765 3.812 1.00 6.17 H new ATOM 0 HB2 PHE A 33 0.626 3.666 4.364 1.00 5.47 H new ATOM 0 HB3 PHE A 33 -0.802 3.334 3.404 1.00 5.47 H new ATOM 0 HD1 PHE A 33 -0.456 2.788 0.903 1.00 5.04 H new ATOM 0 HD2 PHE A 33 2.703 2.760 3.766 1.00 5.11 H new ATOM 0 HE1 PHE A 33 0.889 1.374 -0.591 1.00 5.13 H new ATOM 0 HE2 PHE A 33 4.045 1.348 2.274 1.00 5.17 H new ATOM 0 HZ PHE A 33 3.144 0.659 0.090 1.00 5.21 H new ATOM 528 N HIS A 34 2.105 6.397 3.682 1.00 7.34 N ATOM 529 CA HIS A 34 3.451 6.932 3.565 1.00 8.13 C ATOM 530 C HIS A 34 4.450 5.837 3.898 1.00 8.14 C ATOM 531 O HIS A 34 4.247 5.082 4.850 1.00 7.68 O ATOM 532 CB HIS A 34 3.646 8.133 4.500 1.00 9.10 C ATOM 533 CG HIS A 34 2.701 9.271 4.241 1.00 9.36 C ATOM 534 ND1 HIS A 34 1.632 9.581 5.053 1.00 9.49 N ATOM 535 CD2 HIS A 34 2.688 10.191 3.239 1.00 9.71 C ATOM 536 CE1 HIS A 34 1.020 10.655 4.538 1.00 9.86 C ATOM 537 NE2 HIS A 34 1.621 11.065 3.437 1.00 9.99 N ATOM 0 H HIS A 34 1.675 6.534 4.597 1.00 7.34 H new ATOM 0 HA HIS A 34 3.610 7.276 2.543 1.00 8.13 H new ATOM 0 HB2 HIS A 34 3.524 7.801 5.531 1.00 9.10 H new ATOM 0 HB3 HIS A 34 4.669 8.495 4.401 1.00 9.10 H new ATOM 0 HD2 HIS A 34 3.392 10.237 2.421 1.00 9.71 H new ATOM 0 HE1 HIS A 34 0.148 11.125 4.968 1.00 9.86 H new ATOM 0 HE2 HIS A 34 1.359 11.858 2.852 1.00 9.99 H new ATOM 545 N PHE A 35 5.521 5.747 3.121 1.00 8.83 N ATOM 546 CA PHE A 35 6.532 4.706 3.325 1.00 9.06 C ATOM 547 C PHE A 35 7.244 4.858 4.667 1.00 9.63 C ATOM 548 O PHE A 35 7.964 3.962 5.102 1.00 9.81 O ATOM 549 CB PHE A 35 7.543 4.712 2.179 1.00 9.93 C ATOM 550 CG PHE A 35 7.051 4.005 0.948 1.00 9.62 C ATOM 551 CD1 PHE A 35 5.879 4.398 0.323 1.00 9.42 C ATOM 552 CD2 PHE A 35 7.763 2.943 0.416 1.00 9.72 C ATOM 553 CE1 PHE A 35 5.427 3.747 -0.806 1.00 9.40 C ATOM 554 CE2 PHE A 35 7.315 2.289 -0.715 1.00 9.72 C ATOM 555 CZ PHE A 35 6.145 2.691 -1.325 1.00 9.60 C ATOM 0 H PHE A 35 5.716 6.378 2.344 1.00 8.83 H new ATOM 0 HA PHE A 35 6.015 3.746 3.337 1.00 9.06 H new ATOM 0 HB2 PHE A 35 7.787 5.743 1.924 1.00 9.93 H new ATOM 0 HB3 PHE A 35 8.466 4.240 2.516 1.00 9.93 H new ATOM 0 HD1 PHE A 35 5.312 5.225 0.725 1.00 9.42 H new ATOM 0 HD2 PHE A 35 8.679 2.623 0.891 1.00 9.72 H new ATOM 0 HE1 PHE A 35 4.511 4.064 -1.283 1.00 9.40 H new ATOM 0 HE2 PHE A 35 7.880 1.463 -1.121 1.00 9.72 H new ATOM 0 HZ PHE A 35 5.792 2.179 -2.208 1.00 9.60 H new ATOM 565 N SER A 36 7.030 5.992 5.320 1.00 10.07 N ATOM 566 CA SER A 36 7.562 6.222 6.654 1.00 10.79 C ATOM 567 C SER A 36 6.806 5.382 7.684 1.00 10.16 C ATOM 568 O SER A 36 7.355 5.003 8.718 1.00 10.74 O ATOM 569 CB SER A 36 7.469 7.711 7.007 1.00 11.63 C ATOM 570 OG SER A 36 7.856 7.953 8.350 1.00 12.28 O ATOM 0 H SER A 36 6.488 6.770 4.944 1.00 10.07 H new ATOM 0 HA SER A 36 8.610 5.922 6.669 1.00 10.79 H new ATOM 0 HB2 SER A 36 8.106 8.286 6.335 1.00 11.63 H new ATOM 0 HB3 SER A 36 6.448 8.059 6.853 1.00 11.63 H new ATOM 0 HG SER A 36 7.070 7.895 8.932 1.00 12.28 H new ATOM 576 N GLN A 37 5.548 5.074 7.380 1.00 9.08 N ATOM 577 CA GLN A 37 4.689 4.352 8.306 1.00 8.51 C ATOM 578 C GLN A 37 4.499 2.903 7.871 1.00 7.58 C ATOM 579 O GLN A 37 3.405 2.362 7.962 1.00 6.88 O ATOM 580 CB GLN A 37 3.325 5.041 8.441 1.00 8.12 C ATOM 581 CG GLN A 37 3.286 6.134 9.503 1.00 9.12 C ATOM 582 CD GLN A 37 3.989 7.413 9.086 1.00 9.81 C ATOM 583 OE1 GLN A 37 5.196 7.565 9.275 1.00 9.75 O ATOM 584 NE2 GLN A 37 3.239 8.350 8.527 1.00 10.62 N ATOM 0 H GLN A 37 5.102 5.316 6.495 1.00 9.08 H new ATOM 0 HA GLN A 37 5.182 4.358 9.278 1.00 8.51 H new ATOM 0 HB2 GLN A 37 3.051 5.473 7.479 1.00 8.12 H new ATOM 0 HB3 GLN A 37 2.572 4.290 8.679 1.00 8.12 H new ATOM 0 HG2 GLN A 37 2.247 6.361 9.740 1.00 9.12 H new ATOM 0 HG3 GLN A 37 3.746 5.758 10.417 1.00 9.12 H new ATOM 0 HE21 GLN A 37 2.242 8.188 8.386 1.00 10.62 H new ATOM 0 HE22 GLN A 37 3.658 9.233 8.237 1.00 10.62 H new ATOM 593 N PHE A 38 5.560 2.277 7.395 1.00 7.73 N ATOM 594 CA PHE A 38 5.515 0.855 7.088 1.00 7.05 C ATOM 595 C PHE A 38 6.441 0.110 8.043 1.00 7.79 C ATOM 596 O PHE A 38 7.602 0.490 8.219 1.00 8.78 O ATOM 597 CB PHE A 38 5.922 0.593 5.632 1.00 6.82 C ATOM 598 CG PHE A 38 5.587 -0.800 5.153 1.00 6.28 C ATOM 599 CD1 PHE A 38 4.474 -1.024 4.356 1.00 5.94 C ATOM 600 CD2 PHE A 38 6.376 -1.884 5.507 1.00 6.34 C ATOM 601 CE1 PHE A 38 4.160 -2.294 3.923 1.00 5.69 C ATOM 602 CE2 PHE A 38 6.065 -3.158 5.073 1.00 6.09 C ATOM 603 CZ PHE A 38 4.956 -3.362 4.281 1.00 5.76 C ATOM 0 H PHE A 38 6.458 2.725 7.213 1.00 7.73 H new ATOM 0 HA PHE A 38 4.494 0.496 7.214 1.00 7.05 H new ATOM 0 HB2 PHE A 38 5.425 1.319 4.988 1.00 6.82 H new ATOM 0 HB3 PHE A 38 6.995 0.756 5.528 1.00 6.82 H new ATOM 0 HD1 PHE A 38 3.846 -0.193 4.071 1.00 5.94 H new ATOM 0 HD2 PHE A 38 7.245 -1.730 6.130 1.00 6.34 H new ATOM 0 HE1 PHE A 38 3.290 -2.453 3.303 1.00 5.69 H new ATOM 0 HE2 PHE A 38 6.690 -3.993 5.354 1.00 6.09 H new ATOM 0 HZ PHE A 38 4.710 -4.357 3.941 1.00 5.76 H new ATOM 613 N SER A 39 5.923 -0.931 8.675 1.00 7.41 N ATOM 614 CA SER A 39 6.702 -1.719 9.618 1.00 8.13 C ATOM 615 C SER A 39 7.015 -3.084 9.019 1.00 7.87 C ATOM 616 O SER A 39 6.111 -3.883 8.757 1.00 7.02 O ATOM 617 CB SER A 39 5.936 -1.875 10.935 1.00 8.18 C ATOM 618 OG SER A 39 6.765 -2.369 11.972 1.00 8.97 O ATOM 0 H SER A 39 4.962 -1.251 8.552 1.00 7.41 H new ATOM 0 HA SER A 39 7.640 -1.203 9.823 1.00 8.13 H new ATOM 0 HB2 SER A 39 5.521 -0.911 11.230 1.00 8.18 H new ATOM 0 HB3 SER A 39 5.095 -2.553 10.788 1.00 8.18 H new ATOM 0 HG SER A 39 6.242 -2.454 12.797 1.00 8.97 H new ATOM 624 N GLY A 40 8.293 -3.339 8.791 1.00 8.75 N ATOM 625 CA GLY A 40 8.706 -4.595 8.207 1.00 8.88 C ATOM 626 C GLY A 40 9.586 -4.386 6.993 1.00 9.53 C ATOM 627 O GLY A 40 10.209 -3.333 6.842 1.00 9.98 O ATOM 0 H GLY A 40 9.055 -2.694 9.001 1.00 8.75 H new ATOM 0 HA2 GLY A 40 9.245 -5.182 8.950 1.00 8.88 H new ATOM 0 HA3 GLY A 40 7.825 -5.171 7.923 1.00 8.88 H new ATOM 631 N ASN A 41 9.645 -5.381 6.123 1.00 9.74 N ATOM 632 CA ASN A 41 10.461 -5.278 4.919 1.00 10.55 C ATOM 633 C ASN A 41 9.632 -4.771 3.753 1.00 9.97 C ATOM 634 O ASN A 41 8.846 -5.516 3.164 1.00 9.38 O ATOM 635 CB ASN A 41 11.093 -6.622 4.550 1.00 11.26 C ATOM 636 CG ASN A 41 12.048 -7.129 5.607 1.00 11.90 C ATOM 637 OD1 ASN A 41 11.654 -7.852 6.519 1.00 12.07 O ATOM 638 ND2 ASN A 41 13.312 -6.756 5.488 1.00 12.43 N ATOM 0 H ASN A 41 9.143 -6.263 6.224 1.00 9.74 H new ATOM 0 HA ASN A 41 11.261 -4.568 5.131 1.00 10.55 H new ATOM 0 HB2 ASN A 41 10.305 -7.359 4.395 1.00 11.26 H new ATOM 0 HB3 ASN A 41 11.625 -6.521 3.604 1.00 11.26 H new ATOM 0 HD21 ASN A 41 14.003 -7.070 6.170 1.00 12.43 H new ATOM 0 HD22 ASN A 41 13.596 -6.155 4.715 1.00 12.43 H new ATOM 645 N ILE A 42 9.813 -3.502 3.423 1.00 10.27 N ATOM 646 CA ILE A 42 9.094 -2.884 2.316 1.00 9.89 C ATOM 647 C ILE A 42 9.532 -3.490 0.978 1.00 10.57 C ATOM 648 O ILE A 42 8.799 -3.445 -0.007 1.00 10.34 O ATOM 649 CB ILE A 42 9.311 -1.350 2.302 1.00 10.25 C ATOM 650 CG1 ILE A 42 8.462 -0.680 1.214 1.00 9.68 C ATOM 651 CG2 ILE A 42 10.784 -1.014 2.113 1.00 11.58 C ATOM 652 CD1 ILE A 42 6.969 -0.810 1.434 1.00 8.64 C ATOM 0 H ILE A 42 10.455 -2.875 3.908 1.00 10.27 H new ATOM 0 HA ILE A 42 8.031 -3.081 2.458 1.00 9.89 H new ATOM 0 HB ILE A 42 8.990 -0.960 3.268 1.00 10.25 H new ATOM 0 HG12 ILE A 42 8.721 0.378 1.164 1.00 9.68 H new ATOM 0 HG13 ILE A 42 8.716 -1.116 0.248 1.00 9.68 H new ATOM 0 HG21 ILE A 42 10.912 0.068 2.106 1.00 11.58 H new ATOM 0 HG22 ILE A 42 11.363 -1.443 2.931 1.00 11.58 H new ATOM 0 HG23 ILE A 42 11.133 -1.427 1.166 1.00 11.58 H new ATOM 0 HD11 ILE A 42 6.437 -0.311 0.624 1.00 8.64 H new ATOM 0 HD12 ILE A 42 6.695 -1.865 1.453 1.00 8.64 H new ATOM 0 HD13 ILE A 42 6.700 -0.348 2.384 1.00 8.64 H new ATOM 664 N ASP A 43 10.722 -4.083 0.964 1.00 11.55 N ATOM 665 CA ASP A 43 11.244 -4.737 -0.236 1.00 12.39 C ATOM 666 C ASP A 43 10.417 -5.977 -0.565 1.00 11.95 C ATOM 667 O ASP A 43 10.402 -6.448 -1.700 1.00 12.51 O ATOM 668 CB ASP A 43 12.707 -5.138 -0.034 1.00 13.51 C ATOM 669 CG ASP A 43 13.565 -3.990 0.455 1.00 14.31 C ATOM 670 OD1 ASP A 43 13.660 -3.785 1.683 1.00 14.63 O ATOM 671 OD2 ASP A 43 14.151 -3.281 -0.393 1.00 14.73 O ATOM 0 H ASP A 43 11.345 -4.125 1.770 1.00 11.55 H new ATOM 0 HA ASP A 43 11.179 -4.032 -1.064 1.00 12.39 H new ATOM 0 HB2 ASP A 43 12.759 -5.957 0.684 1.00 13.51 H new ATOM 0 HB3 ASP A 43 13.110 -5.513 -0.975 1.00 13.51 H new ATOM 676 N HIS A 44 9.723 -6.493 0.444 1.00 11.04 N ATOM 677 CA HIS A 44 8.889 -7.678 0.277 1.00 10.66 C ATOM 678 C HIS A 44 7.430 -7.275 0.104 1.00 9.65 C ATOM 679 O HIS A 44 6.527 -8.112 0.166 1.00 9.24 O ATOM 680 CB HIS A 44 9.031 -8.618 1.481 1.00 10.42 C ATOM 681 CG HIS A 44 10.393 -9.230 1.619 1.00 11.50 C ATOM 682 ND1 HIS A 44 10.625 -10.587 1.722 1.00 11.68 N ATOM 683 CD2 HIS A 44 11.612 -8.642 1.688 1.00 12.53 C ATOM 684 CE1 HIS A 44 11.946 -10.772 1.850 1.00 12.75 C ATOM 685 NE2 HIS A 44 12.590 -9.620 1.836 1.00 13.30 N ATOM 0 H HIS A 44 9.722 -6.108 1.389 1.00 11.04 H new ATOM 0 HA HIS A 44 9.223 -8.206 -0.616 1.00 10.66 H new ATOM 0 HB2 HIS A 44 8.799 -8.064 2.391 1.00 10.42 H new ATOM 0 HB3 HIS A 44 8.293 -9.415 1.396 1.00 10.42 H new ATOM 0 HD2 HIS A 44 11.796 -7.579 1.636 1.00 12.53 H new ATOM 0 HE1 HIS A 44 12.421 -11.737 1.951 1.00 12.75 H new ATOM 0 HE2 HIS A 44 13.597 -9.477 1.917 1.00 13.30 H new ATOM 693 N LEU A 45 7.208 -5.988 -0.108 1.00 9.36 N ATOM 694 CA LEU A 45 5.871 -5.445 -0.290 1.00 8.51 C ATOM 695 C LEU A 45 5.624 -5.212 -1.776 1.00 9.27 C ATOM 696 O LEU A 45 6.301 -4.402 -2.407 1.00 10.07 O ATOM 697 CB LEU A 45 5.742 -4.144 0.517 1.00 7.79 C ATOM 698 CG LEU A 45 4.324 -3.594 0.737 1.00 6.83 C ATOM 699 CD1 LEU A 45 3.775 -2.943 -0.517 1.00 6.41 C ATOM 700 CD2 LEU A 45 3.390 -4.691 1.218 1.00 6.22 C ATOM 0 H LEU A 45 7.950 -5.290 -0.159 1.00 9.36 H new ATOM 0 HA LEU A 45 5.118 -6.145 0.073 1.00 8.51 H new ATOM 0 HB2 LEU A 45 6.197 -4.305 1.494 1.00 7.79 H new ATOM 0 HB3 LEU A 45 6.329 -3.375 0.015 1.00 7.79 H new ATOM 0 HG LEU A 45 4.388 -2.826 1.508 1.00 6.83 H new ATOM 0 HD11 LEU A 45 2.771 -2.566 -0.322 1.00 6.41 H new ATOM 0 HD12 LEU A 45 4.422 -2.116 -0.811 1.00 6.41 H new ATOM 0 HD13 LEU A 45 3.737 -3.677 -1.321 1.00 6.41 H new ATOM 0 HD21 LEU A 45 2.392 -4.279 1.367 1.00 6.22 H new ATOM 0 HD22 LEU A 45 3.347 -5.485 0.473 1.00 6.22 H new ATOM 0 HD23 LEU A 45 3.760 -5.097 2.160 1.00 6.22 H new ATOM 712 N LYS A 46 4.670 -5.942 -2.336 1.00 9.19 N ATOM 713 CA LYS A 46 4.403 -5.878 -3.767 1.00 10.10 C ATOM 714 C LYS A 46 2.947 -5.504 -4.040 1.00 9.63 C ATOM 715 O LYS A 46 2.175 -5.257 -3.114 1.00 8.61 O ATOM 716 CB LYS A 46 4.736 -7.220 -4.429 1.00 11.00 C ATOM 717 CG LYS A 46 6.190 -7.647 -4.262 1.00 11.47 C ATOM 718 CD LYS A 46 7.156 -6.649 -4.884 1.00 11.96 C ATOM 719 CE LYS A 46 6.935 -6.514 -6.380 1.00 12.58 C ATOM 720 NZ LYS A 46 7.895 -5.565 -6.997 1.00 13.13 N ATOM 0 H LYS A 46 4.068 -6.585 -1.822 1.00 9.19 H new ATOM 0 HA LYS A 46 5.038 -5.102 -4.194 1.00 10.10 H new ATOM 0 HB2 LYS A 46 4.090 -7.991 -4.009 1.00 11.00 H new ATOM 0 HB3 LYS A 46 4.506 -7.156 -5.493 1.00 11.00 H new ATOM 0 HG2 LYS A 46 6.416 -7.756 -3.201 1.00 11.47 H new ATOM 0 HG3 LYS A 46 6.335 -8.625 -4.721 1.00 11.47 H new ATOM 0 HD2 LYS A 46 7.031 -5.676 -4.408 1.00 11.96 H new ATOM 0 HD3 LYS A 46 8.181 -6.968 -4.694 1.00 11.96 H new ATOM 0 HE2 LYS A 46 7.036 -7.491 -6.852 1.00 12.58 H new ATOM 0 HE3 LYS A 46 5.917 -6.174 -6.567 1.00 12.58 H new ATOM 0 HZ1 LYS A 46 7.711 -5.501 -8.019 1.00 13.13 H new ATOM 0 HZ2 LYS A 46 7.781 -4.626 -6.565 1.00 13.13 H new ATOM 0 HZ3 LYS A 46 8.866 -5.903 -6.840 1.00 13.13 H new ATOM 734 N ILE A 47 2.572 -5.463 -5.312 1.00 10.50 N ATOM 735 CA ILE A 47 1.219 -5.090 -5.702 1.00 10.40 C ATOM 736 C ILE A 47 0.269 -6.259 -5.471 1.00 10.57 C ATOM 737 O ILE A 47 0.420 -7.322 -6.075 1.00 11.42 O ATOM 738 CB ILE A 47 1.139 -4.643 -7.184 1.00 11.43 C ATOM 739 CG1 ILE A 47 1.953 -3.365 -7.431 1.00 11.37 C ATOM 740 CG2 ILE A 47 -0.307 -4.420 -7.595 1.00 11.54 C ATOM 741 CD1 ILE A 47 3.443 -3.590 -7.561 1.00 11.74 C ATOM 0 H ILE A 47 3.189 -5.684 -6.094 1.00 10.50 H new ATOM 0 HA ILE A 47 0.926 -4.242 -5.083 1.00 10.40 H new ATOM 0 HB ILE A 47 1.566 -5.441 -7.791 1.00 11.43 H new ATOM 0 HG12 ILE A 47 1.589 -2.887 -8.340 1.00 11.37 H new ATOM 0 HG13 ILE A 47 1.773 -2.670 -6.611 1.00 11.37 H new ATOM 0 HG21 ILE A 47 -0.345 -4.107 -8.638 1.00 11.54 H new ATOM 0 HG22 ILE A 47 -0.867 -5.348 -7.474 1.00 11.54 H new ATOM 0 HG23 ILE A 47 -0.748 -3.646 -6.967 1.00 11.54 H new ATOM 0 HD11 ILE A 47 3.941 -2.636 -7.734 1.00 11.74 H new ATOM 0 HD12 ILE A 47 3.825 -4.038 -6.644 1.00 11.74 H new ATOM 0 HD13 ILE A 47 3.638 -4.258 -8.400 1.00 11.74 H new ATOM 753 N GLY A 48 -0.703 -6.055 -4.596 1.00 9.87 N ATOM 754 CA GLY A 48 -1.623 -7.118 -4.246 1.00 10.13 C ATOM 755 C GLY A 48 -1.190 -7.845 -2.989 1.00 9.28 C ATOM 756 O GLY A 48 -1.870 -8.764 -2.531 1.00 9.52 O ATOM 0 H GLY A 48 -0.872 -5.169 -4.120 1.00 9.87 H new ATOM 0 HA2 GLY A 48 -2.620 -6.703 -4.101 1.00 10.13 H new ATOM 0 HA3 GLY A 48 -1.690 -7.827 -5.071 1.00 10.13 H new ATOM 760 N ASP A 49 -0.056 -7.432 -2.430 1.00 8.39 N ATOM 761 CA ASP A 49 0.464 -8.036 -1.208 1.00 7.55 C ATOM 762 C ASP A 49 -0.366 -7.581 -0.010 1.00 6.61 C ATOM 763 O ASP A 49 -0.550 -6.380 0.207 1.00 6.10 O ATOM 764 CB ASP A 49 1.937 -7.663 -1.016 1.00 7.20 C ATOM 765 CG ASP A 49 2.606 -8.443 0.098 1.00 7.22 C ATOM 766 OD1 ASP A 49 3.154 -9.532 -0.177 1.00 7.34 O ATOM 767 OD2 ASP A 49 2.619 -7.961 1.245 1.00 7.34 O ATOM 0 H ASP A 49 0.521 -6.680 -2.805 1.00 8.39 H new ATOM 0 HA ASP A 49 0.394 -9.121 -1.290 1.00 7.55 H new ATOM 0 HB2 ASP A 49 2.475 -7.838 -1.948 1.00 7.20 H new ATOM 0 HB3 ASP A 49 2.011 -6.597 -0.801 1.00 7.20 H new ATOM 772 N PRO A 50 -0.896 -8.536 0.764 1.00 6.57 N ATOM 773 CA PRO A 50 -1.809 -8.241 1.865 1.00 6.04 C ATOM 774 C PRO A 50 -1.104 -7.774 3.138 1.00 4.84 C ATOM 775 O PRO A 50 -0.185 -8.430 3.640 1.00 4.58 O ATOM 776 CB PRO A 50 -2.503 -9.578 2.094 1.00 6.83 C ATOM 777 CG PRO A 50 -1.489 -10.602 1.714 1.00 7.21 C ATOM 778 CD PRO A 50 -0.648 -9.984 0.627 1.00 7.28 C ATOM 0 HA PRO A 50 -2.480 -7.418 1.621 1.00 6.04 H new ATOM 0 HB2 PRO A 50 -2.810 -9.692 3.134 1.00 6.83 H new ATOM 0 HB3 PRO A 50 -3.402 -9.667 1.485 1.00 6.83 H new ATOM 0 HG2 PRO A 50 -0.875 -10.877 2.571 1.00 7.21 H new ATOM 0 HG3 PRO A 50 -1.971 -11.514 1.361 1.00 7.21 H new ATOM 0 HD2 PRO A 50 0.408 -10.222 0.755 1.00 7.28 H new ATOM 0 HD3 PRO A 50 -0.939 -10.347 -0.358 1.00 7.28 H new ATOM 786 N VAL A 51 -1.557 -6.642 3.661 1.00 4.35 N ATOM 787 CA VAL A 51 -1.033 -6.092 4.903 1.00 3.49 C ATOM 788 C VAL A 51 -2.174 -5.757 5.858 1.00 3.94 C ATOM 789 O VAL A 51 -3.333 -5.645 5.446 1.00 4.74 O ATOM 790 CB VAL A 51 -0.199 -4.813 4.661 1.00 2.95 C ATOM 791 CG1 VAL A 51 1.038 -5.123 3.835 1.00 3.22 C ATOM 792 CG2 VAL A 51 -1.040 -3.739 3.989 1.00 3.32 C ATOM 0 H VAL A 51 -2.296 -6.081 3.237 1.00 4.35 H new ATOM 0 HA VAL A 51 -0.386 -6.853 5.339 1.00 3.49 H new ATOM 0 HB VAL A 51 0.126 -4.433 5.630 1.00 2.95 H new ATOM 0 HG11 VAL A 51 1.609 -4.208 3.678 1.00 3.22 H new ATOM 0 HG12 VAL A 51 1.655 -5.850 4.363 1.00 3.22 H new ATOM 0 HG13 VAL A 51 0.738 -5.534 2.871 1.00 3.22 H new ATOM 0 HG21 VAL A 51 -0.432 -2.848 3.829 1.00 3.32 H new ATOM 0 HG22 VAL A 51 -1.403 -4.108 3.030 1.00 3.32 H new ATOM 0 HG23 VAL A 51 -1.888 -3.489 4.626 1.00 3.32 H new ATOM 802 N GLU A 52 -1.855 -5.609 7.132 1.00 3.89 N ATOM 803 CA GLU A 52 -2.838 -5.176 8.108 1.00 4.82 C ATOM 804 C GLU A 52 -2.353 -3.910 8.795 1.00 4.91 C ATOM 805 O GLU A 52 -1.228 -3.842 9.298 1.00 4.65 O ATOM 806 CB GLU A 52 -3.159 -6.280 9.128 1.00 5.45 C ATOM 807 CG GLU A 52 -1.949 -6.868 9.832 1.00 5.97 C ATOM 808 CD GLU A 52 -2.338 -7.799 10.968 1.00 6.73 C ATOM 809 OE1 GLU A 52 -3.213 -8.668 10.763 1.00 7.09 O ATOM 810 OE2 GLU A 52 -1.781 -7.656 12.078 1.00 7.09 O ATOM 0 H GLU A 52 -0.925 -5.782 7.514 1.00 3.89 H new ATOM 0 HA GLU A 52 -3.769 -4.959 7.584 1.00 4.82 H new ATOM 0 HB2 GLU A 52 -3.838 -5.875 9.879 1.00 5.45 H new ATOM 0 HB3 GLU A 52 -3.691 -7.083 8.618 1.00 5.45 H new ATOM 0 HG2 GLU A 52 -1.341 -7.414 9.110 1.00 5.97 H new ATOM 0 HG3 GLU A 52 -1.331 -6.060 10.223 1.00 5.97 H new ATOM 817 N PHE A 53 -3.194 -2.895 8.793 1.00 5.61 N ATOM 818 CA PHE A 53 -2.807 -1.595 9.305 1.00 6.01 C ATOM 819 C PHE A 53 -3.861 -1.052 10.257 1.00 7.28 C ATOM 820 O PHE A 53 -4.864 -1.701 10.531 1.00 7.82 O ATOM 821 CB PHE A 53 -2.551 -0.610 8.155 1.00 5.51 C ATOM 822 CG PHE A 53 -3.703 -0.437 7.207 1.00 5.72 C ATOM 823 CD1 PHE A 53 -4.632 0.575 7.399 1.00 6.26 C ATOM 824 CD2 PHE A 53 -3.851 -1.278 6.116 1.00 5.68 C ATOM 825 CE1 PHE A 53 -5.684 0.743 6.522 1.00 6.75 C ATOM 826 CE2 PHE A 53 -4.904 -1.117 5.236 1.00 6.26 C ATOM 827 CZ PHE A 53 -5.820 -0.105 5.440 1.00 6.78 C ATOM 0 H PHE A 53 -4.151 -2.945 8.442 1.00 5.61 H new ATOM 0 HA PHE A 53 -1.878 -1.714 9.862 1.00 6.01 H new ATOM 0 HB2 PHE A 53 -2.297 0.362 8.577 1.00 5.51 H new ATOM 0 HB3 PHE A 53 -1.682 -0.949 7.591 1.00 5.51 H new ATOM 0 HD1 PHE A 53 -4.531 1.239 8.245 1.00 6.26 H new ATOM 0 HD2 PHE A 53 -3.135 -2.069 5.951 1.00 5.68 H new ATOM 0 HE1 PHE A 53 -6.400 1.536 6.681 1.00 6.75 H new ATOM 0 HE2 PHE A 53 -5.010 -1.781 4.391 1.00 6.26 H new ATOM 0 HZ PHE A 53 -6.644 0.024 4.753 1.00 6.78 H new ATOM 837 N GLU A 54 -3.609 0.132 10.766 1.00 7.92 N ATOM 838 CA GLU A 54 -4.477 0.752 11.746 1.00 9.16 C ATOM 839 C GLU A 54 -4.835 2.154 11.273 1.00 9.46 C ATOM 840 O GLU A 54 -3.951 2.930 10.924 1.00 9.27 O ATOM 841 CB GLU A 54 -3.742 0.764 13.084 1.00 9.89 C ATOM 842 CG GLU A 54 -4.532 1.280 14.267 1.00 10.78 C ATOM 843 CD GLU A 54 -3.775 1.041 15.554 1.00 11.28 C ATOM 844 OE1 GLU A 54 -2.622 1.503 15.667 1.00 11.59 O ATOM 845 OE2 GLU A 54 -4.355 0.441 16.481 1.00 11.50 O ATOM 0 H GLU A 54 -2.796 0.694 10.513 1.00 7.92 H new ATOM 0 HA GLU A 54 -5.409 0.200 11.868 1.00 9.16 H new ATOM 0 HB2 GLU A 54 -3.414 -0.252 13.306 1.00 9.89 H new ATOM 0 HB3 GLU A 54 -2.844 1.373 12.978 1.00 9.89 H new ATOM 0 HG2 GLU A 54 -4.726 2.346 14.145 1.00 10.78 H new ATOM 0 HG3 GLU A 54 -5.501 0.782 14.310 1.00 10.78 H new ATOM 852 N MET A 55 -6.120 2.461 11.219 1.00 10.01 N ATOM 853 CA MET A 55 -6.570 3.729 10.661 1.00 10.36 C ATOM 854 C MET A 55 -6.892 4.709 11.774 1.00 11.55 C ATOM 855 O MET A 55 -7.851 4.516 12.519 1.00 12.41 O ATOM 856 CB MET A 55 -7.799 3.523 9.782 1.00 10.51 C ATOM 857 CG MET A 55 -8.242 4.780 9.048 1.00 10.77 C ATOM 858 SD MET A 55 -9.670 4.497 7.983 1.00 10.94 S ATOM 859 CE MET A 55 -9.893 6.126 7.273 1.00 11.29 C ATOM 0 H MET A 55 -6.869 1.854 11.553 1.00 10.01 H new ATOM 0 HA MET A 55 -5.766 4.137 10.049 1.00 10.36 H new ATOM 0 HB2 MET A 55 -7.586 2.742 9.052 1.00 10.51 H new ATOM 0 HB3 MET A 55 -8.622 3.165 10.401 1.00 10.51 H new ATOM 0 HG2 MET A 55 -8.484 5.554 9.776 1.00 10.77 H new ATOM 0 HG3 MET A 55 -7.414 5.156 8.447 1.00 10.77 H new ATOM 0 HE1 MET A 55 -10.538 6.056 6.397 1.00 11.29 H new ATOM 0 HE2 MET A 55 -10.352 6.784 8.010 1.00 11.29 H new ATOM 0 HE3 MET A 55 -8.924 6.530 6.979 1.00 11.29 H new ATOM 869 N THR A 56 -6.099 5.755 11.879 1.00 11.69 N ATOM 870 CA THR A 56 -6.247 6.701 12.967 1.00 12.87 C ATOM 871 C THR A 56 -6.250 8.140 12.456 1.00 13.16 C ATOM 872 O THR A 56 -5.978 8.395 11.276 1.00 12.45 O ATOM 873 CB THR A 56 -5.120 6.507 14.002 1.00 13.14 C ATOM 874 OG1 THR A 56 -3.841 6.603 13.361 1.00 12.50 O ATOM 875 CG2 THR A 56 -5.246 5.150 14.680 1.00 13.17 C ATOM 0 H THR A 56 -5.346 5.972 11.226 1.00 11.69 H new ATOM 0 HA THR A 56 -7.208 6.512 13.446 1.00 12.87 H new ATOM 0 HB THR A 56 -5.208 7.290 14.755 1.00 13.14 H new ATOM 0 HG1 THR A 56 -3.132 6.480 14.026 1.00 12.50 H new ATOM 0 HG21 THR A 56 -4.443 5.030 15.407 1.00 13.17 H new ATOM 0 HG22 THR A 56 -6.208 5.085 15.188 1.00 13.17 H new ATOM 0 HG23 THR A 56 -5.178 4.361 13.931 1.00 13.17 H new ATOM 883 N TYR A 57 -6.570 9.077 13.337 1.00 14.25 N ATOM 884 CA TYR A 57 -6.585 10.486 12.974 1.00 14.69 C ATOM 885 C TYR A 57 -5.524 11.234 13.767 1.00 15.30 C ATOM 886 O TYR A 57 -5.662 11.435 14.976 1.00 16.21 O ATOM 887 CB TYR A 57 -7.964 11.100 13.227 1.00 15.60 C ATOM 888 CG TYR A 57 -9.091 10.410 12.492 1.00 15.24 C ATOM 889 CD1 TYR A 57 -9.442 10.787 11.202 1.00 15.03 C ATOM 890 CD2 TYR A 57 -9.811 9.385 13.094 1.00 15.27 C ATOM 891 CE1 TYR A 57 -10.475 10.161 10.533 1.00 14.87 C ATOM 892 CE2 TYR A 57 -10.844 8.753 12.430 1.00 15.13 C ATOM 893 CZ TYR A 57 -11.172 9.145 11.152 1.00 14.94 C ATOM 894 OH TYR A 57 -12.201 8.523 10.490 1.00 14.95 O ATOM 0 H TYR A 57 -6.822 8.887 14.307 1.00 14.25 H new ATOM 0 HA TYR A 57 -6.365 10.572 11.910 1.00 14.69 H new ATOM 0 HB2 TYR A 57 -8.172 11.072 14.297 1.00 15.60 H new ATOM 0 HB3 TYR A 57 -7.942 12.150 12.934 1.00 15.60 H new ATOM 0 HD1 TYR A 57 -8.898 11.583 10.714 1.00 15.03 H new ATOM 0 HD2 TYR A 57 -9.558 9.077 14.098 1.00 15.27 H new ATOM 0 HE1 TYR A 57 -10.736 10.466 9.530 1.00 14.87 H new ATOM 0 HE2 TYR A 57 -11.391 7.956 12.911 1.00 15.13 H new ATOM 0 HH TYR A 57 -12.587 7.829 11.064 1.00 14.95 H new ATOM 904 N ASP A 58 -4.474 11.656 13.082 1.00 14.91 N ATOM 905 CA ASP A 58 -3.351 12.291 13.746 1.00 15.60 C ATOM 906 C ASP A 58 -3.681 13.730 14.125 1.00 16.64 C ATOM 907 O ASP A 58 -4.038 14.545 13.271 1.00 16.54 O ATOM 908 CB ASP A 58 -2.114 12.250 12.856 1.00 14.95 C ATOM 909 CG ASP A 58 -0.921 12.915 13.504 1.00 15.83 C ATOM 910 OD1 ASP A 58 -0.326 12.319 14.422 1.00 16.40 O ATOM 911 OD2 ASP A 58 -0.571 14.037 13.098 1.00 16.05 O ATOM 0 H ASP A 58 -4.377 11.570 12.070 1.00 14.91 H new ATOM 0 HA ASP A 58 -3.144 11.737 14.662 1.00 15.60 H new ATOM 0 HB2 ASP A 58 -1.869 11.213 12.625 1.00 14.95 H new ATOM 0 HB3 ASP A 58 -2.333 12.744 11.909 1.00 14.95 H new ATOM 916 N ARG A 59 -3.562 14.033 15.414 1.00 17.69 N ATOM 917 CA ARG A 59 -3.888 15.356 15.939 1.00 18.76 C ATOM 918 C ARG A 59 -2.756 16.352 15.682 1.00 19.12 C ATOM 919 O ARG A 59 -2.938 17.563 15.820 1.00 19.91 O ATOM 920 CB ARG A 59 -4.173 15.276 17.444 1.00 19.80 C ATOM 921 CG ARG A 59 -5.286 14.302 17.805 1.00 20.05 C ATOM 922 CD ARG A 59 -5.484 14.204 19.313 1.00 21.00 C ATOM 923 NE ARG A 59 -6.005 15.446 19.893 1.00 21.45 N ATOM 924 CZ ARG A 59 -5.663 15.910 21.096 1.00 22.16 C ATOM 925 NH1 ARG A 59 -4.769 15.264 21.831 1.00 22.49 N ATOM 926 NH2 ARG A 59 -6.218 17.020 21.561 1.00 22.64 N ATOM 0 H ARG A 59 -3.239 13.373 16.121 1.00 17.69 H new ATOM 0 HA ARG A 59 -4.779 15.708 15.419 1.00 18.76 H new ATOM 0 HB2 ARG A 59 -3.261 14.980 17.962 1.00 19.80 H new ATOM 0 HB3 ARG A 59 -4.439 16.269 17.808 1.00 19.80 H new ATOM 0 HG2 ARG A 59 -6.216 14.623 17.336 1.00 20.05 H new ATOM 0 HG3 ARG A 59 -5.051 13.316 17.404 1.00 20.05 H new ATOM 0 HD2 ARG A 59 -6.172 13.387 19.534 1.00 21.00 H new ATOM 0 HD3 ARG A 59 -4.533 13.957 19.786 1.00 21.00 H new ATOM 0 HE ARG A 59 -6.670 15.989 19.342 1.00 21.45 H new ATOM 0 HH11 ARG A 59 -4.340 14.409 21.477 1.00 22.49 H new ATOM 0 HH12 ARG A 59 -4.510 15.622 22.750 1.00 22.49 H new ATOM 0 HH21 ARG A 59 -6.907 17.520 20.999 1.00 22.64 H new ATOM 0 HH22 ARG A 59 -5.956 17.374 22.481 1.00 22.64 H new ATOM 940 N ARG A 60 -1.592 15.837 15.300 1.00 18.61 N ATOM 941 CA ARG A 60 -0.418 16.672 15.085 1.00 19.03 C ATOM 942 C ARG A 60 -0.495 17.384 13.739 1.00 18.53 C ATOM 943 O ARG A 60 -0.535 18.613 13.676 1.00 19.19 O ATOM 944 CB ARG A 60 0.860 15.828 15.159 1.00 18.79 C ATOM 945 CG ARG A 60 2.135 16.633 14.961 1.00 19.36 C ATOM 946 CD ARG A 60 3.361 15.737 14.888 1.00 19.69 C ATOM 947 NE ARG A 60 3.486 14.871 16.060 1.00 20.31 N ATOM 948 CZ ARG A 60 4.580 14.789 16.820 1.00 20.80 C ATOM 949 NH1 ARG A 60 5.634 15.563 16.577 1.00 20.76 N ATOM 950 NH2 ARG A 60 4.615 13.931 17.828 1.00 21.43 N ATOM 0 H ARG A 60 -1.437 14.843 15.133 1.00 18.61 H new ATOM 0 HA ARG A 60 -0.392 17.425 15.873 1.00 19.03 H new ATOM 0 HB2 ARG A 60 0.901 15.331 16.128 1.00 18.79 H new ATOM 0 HB3 ARG A 60 0.813 15.046 14.401 1.00 18.79 H new ATOM 0 HG2 ARG A 60 2.057 17.218 14.045 1.00 19.36 H new ATOM 0 HG3 ARG A 60 2.250 17.340 15.782 1.00 19.36 H new ATOM 0 HD2 ARG A 60 3.306 15.123 13.989 1.00 19.69 H new ATOM 0 HD3 ARG A 60 4.255 16.354 14.798 1.00 19.69 H new ATOM 0 HE ARG A 60 2.685 14.292 16.313 1.00 20.31 H new ATOM 0 HH11 ARG A 60 5.611 16.227 15.803 1.00 20.76 H new ATOM 0 HH12 ARG A 60 6.465 15.492 17.164 1.00 20.76 H new ATOM 0 HH21 ARG A 60 3.808 13.337 18.020 1.00 21.43 H new ATOM 0 HH22 ARG A 60 5.449 13.864 18.412 1.00 21.43 H new ATOM 964 N THR A 61 -0.518 16.610 12.667 1.00 17.40 N ATOM 965 CA THR A 61 -0.551 17.171 11.326 1.00 16.89 C ATOM 966 C THR A 61 -1.998 17.411 10.877 1.00 16.77 C ATOM 967 O THR A 61 -2.261 18.244 10.011 1.00 16.88 O ATOM 968 CB THR A 61 0.195 16.268 10.317 1.00 15.78 C ATOM 969 OG1 THR A 61 0.303 16.914 9.042 1.00 15.10 O ATOM 970 CG2 THR A 61 -0.515 14.944 10.156 1.00 15.70 C ATOM 0 H THR A 61 -0.514 15.591 12.699 1.00 17.40 H new ATOM 0 HA THR A 61 -0.034 18.130 11.353 1.00 16.89 H new ATOM 0 HB THR A 61 1.196 16.087 10.709 1.00 15.78 H new ATOM 0 HG1 THR A 61 0.779 16.328 8.418 1.00 15.10 H new ATOM 0 HG21 THR A 61 0.027 14.325 9.442 1.00 15.70 H new ATOM 0 HG22 THR A 61 -0.558 14.435 11.119 1.00 15.70 H new ATOM 0 HG23 THR A 61 -1.528 15.116 9.791 1.00 15.70 H new ATOM 978 N GLY A 62 -2.936 16.694 11.492 1.00 16.65 N ATOM 979 CA GLY A 62 -4.344 16.904 11.198 1.00 16.70 C ATOM 980 C GLY A 62 -4.846 16.067 10.032 1.00 15.62 C ATOM 981 O GLY A 62 -5.901 16.354 9.465 1.00 15.64 O ATOM 0 H GLY A 62 -2.747 15.972 12.188 1.00 16.65 H new ATOM 0 HA2 GLY A 62 -4.932 16.669 12.085 1.00 16.70 H new ATOM 0 HA3 GLY A 62 -4.509 17.959 10.977 1.00 16.70 H new ATOM 985 N LYS A 63 -4.098 15.031 9.680 1.00 14.73 N ATOM 986 CA LYS A 63 -4.460 14.164 8.564 1.00 13.68 C ATOM 987 C LYS A 63 -5.017 12.838 9.074 1.00 13.16 C ATOM 988 O LYS A 63 -4.538 12.306 10.077 1.00 13.37 O ATOM 989 CB LYS A 63 -3.232 13.855 7.698 1.00 13.04 C ATOM 990 CG LYS A 63 -2.548 15.067 7.088 1.00 13.44 C ATOM 991 CD LYS A 63 -1.193 14.674 6.511 1.00 13.24 C ATOM 992 CE LYS A 63 -0.436 15.867 5.950 1.00 13.68 C ATOM 993 NZ LYS A 63 -0.939 16.281 4.612 1.00 13.70 N ATOM 0 H LYS A 63 -3.233 14.768 10.152 1.00 14.73 H new ATOM 0 HA LYS A 63 -5.213 14.688 7.975 1.00 13.68 H new ATOM 0 HB2 LYS A 63 -2.505 13.315 8.306 1.00 13.04 H new ATOM 0 HB3 LYS A 63 -3.534 13.185 6.893 1.00 13.04 H new ATOM 0 HG2 LYS A 63 -3.176 15.491 6.304 1.00 13.44 H new ATOM 0 HG3 LYS A 63 -2.418 15.840 7.846 1.00 13.44 H new ATOM 0 HD2 LYS A 63 -0.594 14.199 7.288 1.00 13.24 H new ATOM 0 HD3 LYS A 63 -1.337 13.935 5.723 1.00 13.24 H new ATOM 0 HE2 LYS A 63 -0.520 16.705 6.642 1.00 13.68 H new ATOM 0 HE3 LYS A 63 0.623 15.620 5.876 1.00 13.68 H new ATOM 0 HZ1 LYS A 63 -0.391 17.097 4.273 1.00 13.70 H new ATOM 0 HZ2 LYS A 63 -0.835 15.492 3.943 1.00 13.70 H new ATOM 0 HZ3 LYS A 63 -1.943 16.544 4.684 1.00 13.70 H new ATOM 1007 N PRO A 64 -6.042 12.291 8.405 1.00 12.60 N ATOM 1008 CA PRO A 64 -6.444 10.909 8.628 1.00 12.06 C ATOM 1009 C PRO A 64 -5.453 9.979 7.941 1.00 11.02 C ATOM 1010 O PRO A 64 -5.224 10.090 6.734 1.00 10.42 O ATOM 1011 CB PRO A 64 -7.815 10.825 7.963 1.00 12.00 C ATOM 1012 CG PRO A 64 -7.799 11.876 6.907 1.00 12.09 C ATOM 1013 CD PRO A 64 -6.886 12.967 7.401 1.00 12.59 C ATOM 0 HA PRO A 64 -6.473 10.623 9.679 1.00 12.06 H new ATOM 0 HB2 PRO A 64 -7.985 9.838 7.534 1.00 12.00 H new ATOM 0 HB3 PRO A 64 -8.614 11.002 8.683 1.00 12.00 H new ATOM 0 HG2 PRO A 64 -7.441 11.470 5.961 1.00 12.09 H new ATOM 0 HG3 PRO A 64 -8.803 12.262 6.729 1.00 12.09 H new ATOM 0 HD2 PRO A 64 -6.288 13.385 6.592 1.00 12.59 H new ATOM 0 HD3 PRO A 64 -7.448 13.791 7.840 1.00 12.59 H new ATOM 1021 N ILE A 65 -4.864 9.062 8.686 1.00 10.90 N ATOM 1022 CA ILE A 65 -3.745 8.306 8.160 1.00 10.04 C ATOM 1023 C ILE A 65 -3.779 6.853 8.586 1.00 9.53 C ATOM 1024 O ILE A 65 -4.597 6.448 9.414 1.00 10.01 O ATOM 1025 CB ILE A 65 -2.393 8.929 8.594 1.00 10.58 C ATOM 1026 CG1 ILE A 65 -2.374 9.263 10.095 1.00 11.66 C ATOM 1027 CG2 ILE A 65 -2.077 10.174 7.779 1.00 10.92 C ATOM 1028 CD1 ILE A 65 -2.014 8.098 10.991 1.00 11.73 C ATOM 0 H ILE A 65 -5.136 8.826 9.640 1.00 10.90 H new ATOM 0 HA ILE A 65 -3.836 8.348 7.075 1.00 10.04 H new ATOM 0 HB ILE A 65 -1.623 8.181 8.405 1.00 10.58 H new ATOM 0 HG12 ILE A 65 -1.662 10.070 10.266 1.00 11.66 H new ATOM 0 HG13 ILE A 65 -3.356 9.638 10.384 1.00 11.66 H new ATOM 0 HG21 ILE A 65 -1.124 10.590 8.105 1.00 10.92 H new ATOM 0 HG22 ILE A 65 -2.017 9.912 6.723 1.00 10.92 H new ATOM 0 HG23 ILE A 65 -2.864 10.914 7.925 1.00 10.92 H new ATOM 0 HD11 ILE A 65 -2.025 8.422 12.032 1.00 11.73 H new ATOM 0 HD12 ILE A 65 -2.739 7.296 10.854 1.00 11.73 H new ATOM 0 HD13 ILE A 65 -1.019 7.735 10.734 1.00 11.73 H new ATOM 1040 N ALA A 66 -2.885 6.079 7.997 1.00 8.66 N ATOM 1041 CA ALA A 66 -2.661 4.716 8.412 1.00 8.16 C ATOM 1042 C ALA A 66 -1.463 4.673 9.349 1.00 8.50 C ATOM 1043 O ALA A 66 -0.511 5.437 9.181 1.00 8.91 O ATOM 1044 CB ALA A 66 -2.429 3.817 7.210 1.00 6.95 C ATOM 0 H ALA A 66 -2.298 6.382 7.220 1.00 8.66 H new ATOM 0 HA ALA A 66 -3.545 4.350 8.934 1.00 8.16 H new ATOM 0 HB1 ALA A 66 -2.262 2.794 7.548 1.00 6.95 H new ATOM 0 HB2 ALA A 66 -3.303 3.847 6.559 1.00 6.95 H new ATOM 0 HB3 ALA A 66 -1.555 4.164 6.659 1.00 6.95 H new ATOM 1050 N SER A 67 -1.531 3.812 10.349 1.00 8.53 N ATOM 1051 CA SER A 67 -0.443 3.639 11.296 1.00 8.97 C ATOM 1052 C SER A 67 0.759 2.964 10.616 1.00 8.17 C ATOM 1053 O SER A 67 0.906 3.020 9.397 1.00 7.46 O ATOM 1054 CB SER A 67 -0.943 2.806 12.485 1.00 9.32 C ATOM 1055 OG SER A 67 -0.013 2.792 13.557 1.00 9.83 O ATOM 0 H SER A 67 -2.339 3.215 10.527 1.00 8.53 H new ATOM 0 HA SER A 67 -0.113 4.613 11.657 1.00 8.97 H new ATOM 0 HB2 SER A 67 -1.893 3.209 12.835 1.00 9.32 H new ATOM 0 HB3 SER A 67 -1.132 1.784 12.157 1.00 9.32 H new ATOM 0 HG SER A 67 -0.370 2.253 14.293 1.00 9.83 H new ATOM 1061 N GLN A 68 1.592 2.306 11.410 1.00 8.44 N ATOM 1062 CA GLN A 68 2.857 1.746 10.939 1.00 8.10 C ATOM 1063 C GLN A 68 2.685 0.464 10.105 1.00 6.83 C ATOM 1064 O GLN A 68 3.563 -0.384 10.130 1.00 6.68 O ATOM 1065 CB GLN A 68 3.801 1.517 12.124 1.00 8.99 C ATOM 1066 CG GLN A 68 3.193 0.718 13.265 1.00 9.78 C ATOM 1067 CD GLN A 68 4.119 0.645 14.461 1.00 10.75 C ATOM 1068 OE1 GLN A 68 4.934 -0.266 14.575 1.00 11.15 O ATOM 1069 NE2 GLN A 68 4.003 1.611 15.359 1.00 11.32 N ATOM 0 H GLN A 68 1.412 2.144 12.401 1.00 8.44 H new ATOM 0 HA GLN A 68 3.298 2.478 10.263 1.00 8.10 H new ATOM 0 HB2 GLN A 68 4.692 1.000 11.768 1.00 8.99 H new ATOM 0 HB3 GLN A 68 4.126 2.485 12.507 1.00 8.99 H new ATOM 0 HG2 GLN A 68 2.249 1.174 13.564 1.00 9.78 H new ATOM 0 HG3 GLN A 68 2.965 -0.291 12.920 1.00 9.78 H new ATOM 0 HE21 GLN A 68 3.313 2.350 15.227 1.00 11.32 H new ATOM 0 HE22 GLN A 68 4.604 1.616 16.183 1.00 11.32 H new ATOM 1078 N VAL A 69 1.536 0.341 9.412 1.00 6.11 N ATOM 1079 CA VAL A 69 1.255 -0.713 8.399 1.00 4.91 C ATOM 1080 C VAL A 69 2.154 -1.950 8.506 1.00 4.68 C ATOM 1081 O VAL A 69 3.305 -1.938 8.065 1.00 4.79 O ATOM 1082 CB VAL A 69 1.374 -0.149 6.963 1.00 4.37 C ATOM 1083 CG1 VAL A 69 0.977 -1.192 5.929 1.00 3.38 C ATOM 1084 CG2 VAL A 69 0.531 1.106 6.796 1.00 4.76 C ATOM 0 H VAL A 69 0.754 0.984 9.539 1.00 6.11 H new ATOM 0 HA VAL A 69 0.234 -1.031 8.612 1.00 4.91 H new ATOM 0 HB VAL A 69 2.419 0.115 6.801 1.00 4.37 H new ATOM 0 HG11 VAL A 69 1.070 -0.767 4.929 1.00 3.38 H new ATOM 0 HG12 VAL A 69 1.631 -2.059 6.017 1.00 3.38 H new ATOM 0 HG13 VAL A 69 -0.056 -1.498 6.098 1.00 3.38 H new ATOM 0 HG21 VAL A 69 0.634 1.481 5.778 1.00 4.76 H new ATOM 0 HG22 VAL A 69 -0.515 0.870 6.992 1.00 4.76 H new ATOM 0 HG23 VAL A 69 0.869 1.868 7.499 1.00 4.76 H new ATOM 1094 N SER A 70 1.616 -3.028 9.053 1.00 4.67 N ATOM 1095 CA SER A 70 2.404 -4.225 9.288 1.00 4.67 C ATOM 1096 C SER A 70 2.133 -5.293 8.229 1.00 3.78 C ATOM 1097 O SER A 70 1.001 -5.457 7.764 1.00 3.43 O ATOM 1098 CB SER A 70 2.084 -4.780 10.673 1.00 5.45 C ATOM 1099 OG SER A 70 2.143 -3.756 11.652 1.00 6.12 O ATOM 0 H SER A 70 0.640 -3.098 9.341 1.00 4.67 H new ATOM 0 HA SER A 70 3.458 -3.955 9.228 1.00 4.67 H new ATOM 0 HB2 SER A 70 1.091 -5.229 10.669 1.00 5.45 H new ATOM 0 HB3 SER A 70 2.790 -5.571 10.925 1.00 5.45 H new ATOM 0 HG SER A 70 1.933 -4.132 12.532 1.00 6.12 H new ATOM 1105 N LYS A 71 3.186 -6.009 7.855 1.00 3.89 N ATOM 1106 CA LYS A 71 3.078 -7.135 6.934 1.00 3.64 C ATOM 1107 C LYS A 71 2.357 -8.303 7.591 1.00 3.79 C ATOM 1108 O LYS A 71 2.593 -8.603 8.762 1.00 4.24 O ATOM 1109 CB LYS A 71 4.472 -7.589 6.499 1.00 4.40 C ATOM 1110 CG LYS A 71 5.113 -6.703 5.447 1.00 4.63 C ATOM 1111 CD LYS A 71 4.672 -7.081 4.036 1.00 5.13 C ATOM 1112 CE LYS A 71 5.133 -8.485 3.665 1.00 5.68 C ATOM 1113 NZ LYS A 71 4.835 -8.826 2.250 1.00 6.30 N ATOM 0 H LYS A 71 4.136 -5.827 8.180 1.00 3.89 H new ATOM 0 HA LYS A 71 2.507 -6.809 6.065 1.00 3.64 H new ATOM 0 HB2 LYS A 71 5.121 -7.623 7.374 1.00 4.40 H new ATOM 0 HB3 LYS A 71 4.407 -8.606 6.111 1.00 4.40 H new ATOM 0 HG2 LYS A 71 4.853 -5.663 5.642 1.00 4.63 H new ATOM 0 HG3 LYS A 71 6.198 -6.779 5.521 1.00 4.63 H new ATOM 0 HD2 LYS A 71 3.586 -7.023 3.965 1.00 5.13 H new ATOM 0 HD3 LYS A 71 5.077 -6.363 3.322 1.00 5.13 H new ATOM 0 HE2 LYS A 71 6.206 -8.569 3.837 1.00 5.68 H new ATOM 0 HE3 LYS A 71 4.647 -9.208 4.320 1.00 5.68 H new ATOM 0 HZ1 LYS A 71 4.595 -9.835 2.179 1.00 6.30 H new ATOM 0 HZ2 LYS A 71 4.032 -8.255 1.917 1.00 6.30 H new ATOM 0 HZ3 LYS A 71 5.669 -8.627 1.662 1.00 6.30 H new ATOM 1127 N ILE A 72 1.482 -8.964 6.847 1.00 3.80 N ATOM 1128 CA ILE A 72 0.836 -10.166 7.349 1.00 4.33 C ATOM 1129 C ILE A 72 1.775 -11.354 7.170 1.00 4.69 C ATOM 1130 O ILE A 72 1.929 -11.885 6.068 1.00 5.16 O ATOM 1131 CB ILE A 72 -0.511 -10.443 6.648 1.00 4.89 C ATOM 1132 CG1 ILE A 72 -1.452 -9.247 6.821 1.00 4.86 C ATOM 1133 CG2 ILE A 72 -1.156 -11.704 7.209 1.00 5.69 C ATOM 1134 CD1 ILE A 72 -2.807 -9.431 6.171 1.00 5.77 C ATOM 0 H ILE A 72 1.206 -8.692 5.904 1.00 3.80 H new ATOM 0 HA ILE A 72 0.620 -10.014 8.406 1.00 4.33 H new ATOM 0 HB ILE A 72 -0.323 -10.594 5.585 1.00 4.89 H new ATOM 0 HG12 ILE A 72 -1.593 -9.060 7.885 1.00 4.86 H new ATOM 0 HG13 ILE A 72 -0.977 -8.360 6.402 1.00 4.86 H new ATOM 0 HG21 ILE A 72 -2.105 -11.883 6.703 1.00 5.69 H new ATOM 0 HG22 ILE A 72 -0.493 -12.554 7.049 1.00 5.69 H new ATOM 0 HG23 ILE A 72 -1.333 -11.578 8.277 1.00 5.69 H new ATOM 0 HD11 ILE A 72 -3.414 -8.542 6.338 1.00 5.77 H new ATOM 0 HD12 ILE A 72 -2.679 -9.587 5.100 1.00 5.77 H new ATOM 0 HD13 ILE A 72 -3.305 -10.297 6.606 1.00 5.77 H new ATOM 1185 N VAL A 76 0.162 -20.786 8.874 1.00 6.09 N ATOM 1186 CA VAL A 76 0.385 -22.200 9.131 1.00 5.92 C ATOM 1187 C VAL A 76 1.480 -22.749 8.219 1.00 6.00 C ATOM 1188 O VAL A 76 1.704 -22.237 7.119 1.00 6.19 O ATOM 1189 CB VAL A 76 -0.920 -23.013 8.931 1.00 5.81 C ATOM 1190 CG1 VAL A 76 -1.346 -23.026 7.469 1.00 5.88 C ATOM 1191 CG2 VAL A 76 -0.772 -24.422 9.475 1.00 5.83 C ATOM 0 HA VAL A 76 0.704 -22.302 10.168 1.00 5.92 H new ATOM 0 HB VAL A 76 -1.710 -22.519 9.497 1.00 5.81 H new ATOM 0 HG11 VAL A 76 -2.264 -23.604 7.363 1.00 5.88 H new ATOM 0 HG12 VAL A 76 -1.519 -22.004 7.131 1.00 5.88 H new ATOM 0 HG13 VAL A 76 -0.560 -23.479 6.865 1.00 5.88 H new ATOM 0 HG21 VAL A 76 -1.701 -24.971 9.322 1.00 5.83 H new ATOM 0 HG22 VAL A 76 0.039 -24.930 8.954 1.00 5.83 H new ATOM 0 HG23 VAL A 76 -0.547 -24.379 10.541 1.00 5.83 H new ATOM 1201 N VAL A 77 2.176 -23.777 8.686 1.00 5.91 N ATOM 1202 CA VAL A 77 3.172 -24.443 7.864 1.00 6.02 C ATOM 1203 C VAL A 77 2.492 -25.419 6.923 1.00 5.80 C ATOM 1204 O VAL A 77 2.177 -26.547 7.292 1.00 5.51 O ATOM 1205 CB VAL A 77 4.231 -25.190 8.701 1.00 6.07 C ATOM 1206 CG1 VAL A 77 5.294 -25.806 7.791 1.00 6.22 C ATOM 1207 CG2 VAL A 77 4.869 -24.258 9.722 1.00 6.26 C ATOM 0 H VAL A 77 2.069 -24.164 9.624 1.00 5.91 H new ATOM 0 HA VAL A 77 3.690 -23.668 7.299 1.00 6.02 H new ATOM 0 HB VAL A 77 3.734 -25.995 9.243 1.00 6.07 H new ATOM 0 HG11 VAL A 77 6.033 -26.329 8.397 1.00 6.22 H new ATOM 0 HG12 VAL A 77 4.823 -26.511 7.106 1.00 6.22 H new ATOM 0 HG13 VAL A 77 5.785 -25.018 7.220 1.00 6.22 H new ATOM 0 HG21 VAL A 77 5.612 -24.806 10.301 1.00 6.26 H new ATOM 0 HG22 VAL A 77 5.351 -23.428 9.206 1.00 6.26 H new ATOM 0 HG23 VAL A 77 4.101 -23.872 10.392 1.00 6.26 H new ATOM 1217 N LEU A 78 2.242 -24.951 5.717 1.00 6.00 N ATOM 1218 CA LEU A 78 1.560 -25.737 4.704 1.00 5.89 C ATOM 1219 C LEU A 78 2.561 -26.356 3.737 1.00 5.95 C ATOM 1220 O LEU A 78 2.294 -27.394 3.130 1.00 5.83 O ATOM 1221 CB LEU A 78 0.558 -24.829 3.968 1.00 6.05 C ATOM 1222 CG LEU A 78 -0.203 -25.446 2.788 1.00 5.82 C ATOM 1223 CD1 LEU A 78 -1.566 -24.795 2.647 1.00 5.77 C ATOM 1224 CD2 LEU A 78 0.574 -25.275 1.489 1.00 5.92 C ATOM 0 H LEU A 78 2.505 -24.015 5.410 1.00 6.00 H new ATOM 0 HA LEU A 78 1.020 -26.559 5.175 1.00 5.89 H new ATOM 0 HB2 LEU A 78 -0.173 -24.473 4.694 1.00 6.05 H new ATOM 0 HB3 LEU A 78 1.097 -23.955 3.604 1.00 6.05 H new ATOM 0 HG LEU A 78 -0.325 -26.511 2.987 1.00 5.82 H new ATOM 0 HD11 LEU A 78 -2.097 -25.241 1.806 1.00 5.77 H new ATOM 0 HD12 LEU A 78 -2.139 -24.949 3.561 1.00 5.77 H new ATOM 0 HD13 LEU A 78 -1.442 -23.726 2.472 1.00 5.77 H new ATOM 0 HD21 LEU A 78 0.013 -25.721 0.668 1.00 5.92 H new ATOM 0 HD22 LEU A 78 0.724 -24.214 1.292 1.00 5.92 H new ATOM 0 HD23 LEU A 78 1.542 -25.768 1.577 1.00 5.92 H new ATOM 1236 N SER A 79 3.727 -25.739 3.616 1.00 6.26 N ATOM 1237 CA SER A 79 4.664 -26.131 2.583 1.00 6.41 C ATOM 1238 C SER A 79 5.788 -27.007 3.130 1.00 6.39 C ATOM 1239 O SER A 79 6.710 -26.528 3.790 1.00 6.80 O ATOM 1240 CB SER A 79 5.239 -24.897 1.888 1.00 6.91 C ATOM 1241 OG SER A 79 5.924 -25.256 0.697 1.00 7.02 O ATOM 0 H SER A 79 4.041 -24.975 4.214 1.00 6.26 H new ATOM 0 HA SER A 79 4.114 -26.726 1.854 1.00 6.41 H new ATOM 0 HB2 SER A 79 4.435 -24.200 1.653 1.00 6.91 H new ATOM 0 HB3 SER A 79 5.922 -24.380 2.563 1.00 6.91 H new ATOM 0 HG SER A 79 6.281 -24.450 0.269 1.00 7.02 H new ATOM 1247 N GLU A 80 5.674 -28.297 2.868 1.00 6.08 N ATOM 1248 CA GLU A 80 6.751 -29.249 3.101 1.00 6.20 C ATOM 1249 C GLU A 80 6.948 -30.064 1.829 1.00 5.98 C ATOM 1250 O GLU A 80 7.986 -29.985 1.169 1.00 6.34 O ATOM 1251 CB GLU A 80 6.422 -30.178 4.278 1.00 6.25 C ATOM 1252 CG GLU A 80 6.794 -29.620 5.642 1.00 6.44 C ATOM 1253 CD GLU A 80 8.292 -29.468 5.807 1.00 6.77 C ATOM 1254 OE1 GLU A 80 8.990 -30.493 5.911 1.00 7.07 O ATOM 1255 OE2 GLU A 80 8.778 -28.313 5.837 1.00 6.96 O ATOM 0 H GLU A 80 4.828 -28.718 2.485 1.00 6.08 H new ATOM 0 HA GLU A 80 7.664 -28.710 3.354 1.00 6.20 H new ATOM 0 HB2 GLU A 80 5.354 -30.394 4.267 1.00 6.25 H new ATOM 0 HB3 GLU A 80 6.941 -31.126 4.133 1.00 6.25 H new ATOM 0 HG2 GLU A 80 6.315 -28.651 5.780 1.00 6.44 H new ATOM 0 HG3 GLU A 80 6.409 -30.279 6.420 1.00 6.44 H new ATOM 1262 N GLU A 81 5.908 -30.811 1.482 1.00 5.56 N ATOM 1263 CA GLU A 81 5.857 -31.583 0.254 1.00 5.36 C ATOM 1264 C GLU A 81 4.429 -32.076 0.055 1.00 4.92 C ATOM 1265 O GLU A 81 3.715 -32.324 1.031 1.00 4.81 O ATOM 1266 CB GLU A 81 6.834 -32.761 0.315 1.00 5.50 C ATOM 1267 CG GLU A 81 6.943 -33.532 -0.987 1.00 5.90 C ATOM 1268 CD GLU A 81 7.984 -34.627 -0.922 1.00 6.33 C ATOM 1269 OE1 GLU A 81 7.662 -35.734 -0.443 1.00 6.52 O ATOM 1270 OE2 GLU A 81 9.132 -34.388 -1.356 1.00 6.68 O ATOM 0 H GLU A 81 5.068 -30.897 2.054 1.00 5.56 H new ATOM 0 HA GLU A 81 6.152 -30.957 -0.589 1.00 5.36 H new ATOM 0 HB2 GLU A 81 7.821 -32.389 0.590 1.00 5.50 H new ATOM 0 HB3 GLU A 81 6.519 -33.442 1.105 1.00 5.50 H new ATOM 0 HG2 GLU A 81 5.974 -33.969 -1.230 1.00 5.90 H new ATOM 0 HG3 GLU A 81 7.193 -32.844 -1.794 1.00 5.90 H new ATOM 1277 N ARG A 82 3.993 -32.189 -1.190 1.00 4.75 N ATOM 1278 CA ARG A 82 2.636 -32.639 -1.469 1.00 4.39 C ATOM 1279 C ARG A 82 2.551 -34.150 -1.289 1.00 4.06 C ATOM 1280 O ARG A 82 2.949 -34.910 -2.172 1.00 4.20 O ATOM 1281 CB ARG A 82 2.203 -32.265 -2.890 1.00 4.57 C ATOM 1282 CG ARG A 82 0.744 -32.588 -3.162 1.00 4.70 C ATOM 1283 CD ARG A 82 0.354 -32.315 -4.605 1.00 5.11 C ATOM 1284 NE ARG A 82 1.064 -33.187 -5.538 1.00 5.37 N ATOM 1285 CZ ARG A 82 0.550 -34.299 -6.061 1.00 5.87 C ATOM 1286 NH1 ARG A 82 -0.656 -34.725 -5.691 1.00 6.14 N ATOM 1287 NH2 ARG A 82 1.267 -35.004 -6.925 1.00 6.43 N ATOM 0 H ARG A 82 4.552 -31.978 -2.017 1.00 4.75 H new ATOM 0 HA ARG A 82 1.964 -32.142 -0.769 1.00 4.39 H new ATOM 0 HB2 ARG A 82 2.371 -31.200 -3.048 1.00 4.57 H new ATOM 0 HB3 ARG A 82 2.828 -32.796 -3.608 1.00 4.57 H new ATOM 0 HG2 ARG A 82 0.556 -33.636 -2.929 1.00 4.70 H new ATOM 0 HG3 ARG A 82 0.113 -31.996 -2.499 1.00 4.70 H new ATOM 0 HD2 ARG A 82 -0.720 -32.456 -4.723 1.00 5.11 H new ATOM 0 HD3 ARG A 82 0.568 -31.274 -4.848 1.00 5.11 H new ATOM 0 HE ARG A 82 2.013 -32.928 -5.806 1.00 5.37 H new ATOM 0 HH11 ARG A 82 -1.194 -34.199 -5.002 1.00 6.14 H new ATOM 0 HH12 ARG A 82 -1.042 -35.578 -6.096 1.00 6.14 H new ATOM 0 HH21 ARG A 82 2.203 -34.693 -7.184 1.00 6.43 H new ATOM 0 HH22 ARG A 82 0.882 -35.857 -7.331 1.00 6.43 H new ATOM 1301 N VAL A 83 2.065 -34.578 -0.134 1.00 3.70 N ATOM 1302 CA VAL A 83 1.968 -35.998 0.170 1.00 3.45 C ATOM 1303 C VAL A 83 0.720 -36.619 -0.448 1.00 3.20 C ATOM 1304 O VAL A 83 -0.260 -35.928 -0.757 1.00 3.17 O ATOM 1305 CB VAL A 83 1.971 -36.262 1.693 1.00 3.37 C ATOM 1306 CG1 VAL A 83 3.307 -35.865 2.302 1.00 3.69 C ATOM 1307 CG2 VAL A 83 0.837 -35.515 2.377 1.00 3.25 C ATOM 0 H VAL A 83 1.732 -33.963 0.608 1.00 3.70 H new ATOM 0 HA VAL A 83 2.850 -36.466 -0.267 1.00 3.45 H new ATOM 0 HB VAL A 83 1.820 -37.330 1.849 1.00 3.37 H new ATOM 0 HG11 VAL A 83 3.290 -36.058 3.375 1.00 3.69 H new ATOM 0 HG12 VAL A 83 4.104 -36.448 1.841 1.00 3.69 H new ATOM 0 HG13 VAL A 83 3.486 -34.804 2.127 1.00 3.69 H new ATOM 0 HG21 VAL A 83 0.861 -35.718 3.448 1.00 3.25 H new ATOM 0 HG22 VAL A 83 0.952 -34.444 2.208 1.00 3.25 H new ATOM 0 HG23 VAL A 83 -0.117 -35.847 1.967 1.00 3.25 H new ATOM 1317 N THR A 84 0.767 -37.924 -0.639 1.00 3.11 N ATOM 1318 CA THR A 84 -0.369 -38.666 -1.148 1.00 2.97 C ATOM 1319 C THR A 84 -0.708 -39.788 -0.182 1.00 2.74 C ATOM 1320 O THR A 84 0.177 -40.334 0.474 1.00 2.82 O ATOM 1321 CB THR A 84 -0.092 -39.242 -2.553 1.00 3.22 C ATOM 1322 OG1 THR A 84 1.085 -40.062 -2.542 1.00 3.37 O ATOM 1323 CG2 THR A 84 0.076 -38.118 -3.562 1.00 3.49 C ATOM 0 H THR A 84 1.589 -38.496 -0.447 1.00 3.11 H new ATOM 0 HA THR A 84 -1.213 -37.982 -1.236 1.00 2.97 H new ATOM 0 HB THR A 84 -0.945 -39.856 -2.841 1.00 3.22 H new ATOM 0 HG1 THR A 84 1.243 -40.419 -3.441 1.00 3.37 H new ATOM 0 HG21 THR A 84 0.271 -38.540 -4.548 1.00 3.49 H new ATOM 0 HG22 THR A 84 -0.835 -37.521 -3.597 1.00 3.49 H new ATOM 0 HG23 THR A 84 0.913 -37.486 -3.266 1.00 3.49 H new ATOM 1331 N GLY A 85 -1.978 -40.117 -0.070 1.00 2.54 N ATOM 1332 CA GLY A 85 -2.384 -41.144 0.858 1.00 2.41 C ATOM 1333 C GLY A 85 -3.483 -42.011 0.298 1.00 2.47 C ATOM 1334 O GLY A 85 -3.844 -41.890 -0.876 1.00 2.58 O ATOM 0 H GLY A 85 -2.736 -39.693 -0.604 1.00 2.54 H new ATOM 0 HA2 GLY A 85 -1.525 -41.766 1.109 1.00 2.41 H new ATOM 0 HA3 GLY A 85 -2.724 -40.681 1.784 1.00 2.41 H new ATOM 1338 N THR A 86 -4.007 -42.886 1.129 1.00 2.52 N ATOM 1339 CA THR A 86 -5.083 -43.770 0.729 1.00 2.69 C ATOM 1340 C THR A 86 -6.202 -43.730 1.762 1.00 2.50 C ATOM 1341 O THR A 86 -5.947 -43.824 2.962 1.00 2.42 O ATOM 1342 CB THR A 86 -4.569 -45.220 0.580 1.00 3.07 C ATOM 1343 OG1 THR A 86 -3.412 -45.241 -0.271 1.00 3.23 O ATOM 1344 CG2 THR A 86 -5.638 -46.135 0.001 1.00 3.34 C ATOM 0 H THR A 86 -3.702 -43.005 2.095 1.00 2.52 H new ATOM 0 HA THR A 86 -5.465 -43.431 -0.234 1.00 2.69 H new ATOM 0 HB THR A 86 -4.309 -45.585 1.573 1.00 3.07 H new ATOM 0 HG1 THR A 86 -3.089 -46.162 -0.361 1.00 3.23 H new ATOM 0 HG21 THR A 86 -5.241 -47.146 -0.090 1.00 3.34 H new ATOM 0 HG22 THR A 86 -6.506 -46.143 0.660 1.00 3.34 H new ATOM 0 HG23 THR A 86 -5.934 -45.772 -0.983 1.00 3.34 H new ATOM 1352 N VAL A 87 -7.433 -43.557 1.296 1.00 2.49 N ATOM 1353 CA VAL A 87 -8.588 -43.567 2.177 1.00 2.39 C ATOM 1354 C VAL A 87 -8.751 -44.936 2.819 1.00 2.75 C ATOM 1355 O VAL A 87 -8.717 -45.957 2.132 1.00 3.14 O ATOM 1356 CB VAL A 87 -9.883 -43.217 1.419 1.00 2.46 C ATOM 1357 CG1 VAL A 87 -11.089 -43.297 2.335 1.00 2.38 C ATOM 1358 CG2 VAL A 87 -9.789 -41.845 0.810 1.00 2.36 C ATOM 0 H VAL A 87 -7.654 -43.408 0.311 1.00 2.49 H new ATOM 0 HA VAL A 87 -8.415 -42.812 2.944 1.00 2.39 H new ATOM 0 HB VAL A 87 -10.008 -43.948 0.620 1.00 2.46 H new ATOM 0 HG11 VAL A 87 -11.989 -43.045 1.774 1.00 2.38 H new ATOM 0 HG12 VAL A 87 -11.179 -44.309 2.731 1.00 2.38 H new ATOM 0 HG13 VAL A 87 -10.967 -42.595 3.160 1.00 2.38 H new ATOM 0 HG21 VAL A 87 -10.714 -41.618 0.280 1.00 2.36 H new ATOM 0 HG22 VAL A 87 -9.632 -41.108 1.597 1.00 2.36 H new ATOM 0 HG23 VAL A 87 -8.953 -41.814 0.111 1.00 2.36 H new ATOM 1368 N THR A 88 -8.903 -44.960 4.130 1.00 2.69 N ATOM 1369 CA THR A 88 -9.142 -46.203 4.832 1.00 3.12 C ATOM 1370 C THR A 88 -10.537 -46.214 5.451 1.00 3.17 C ATOM 1371 O THR A 88 -11.002 -47.239 5.945 1.00 3.61 O ATOM 1372 CB THR A 88 -8.084 -46.445 5.925 1.00 3.21 C ATOM 1373 OG1 THR A 88 -7.931 -45.268 6.728 1.00 2.80 O ATOM 1374 CG2 THR A 88 -6.742 -46.828 5.313 1.00 3.44 C ATOM 0 H THR A 88 -8.865 -44.134 4.727 1.00 2.69 H new ATOM 0 HA THR A 88 -9.070 -47.008 4.101 1.00 3.12 H new ATOM 0 HB THR A 88 -8.425 -47.270 6.550 1.00 3.21 H new ATOM 0 HG1 THR A 88 -7.272 -45.437 7.434 1.00 2.80 H new ATOM 0 HG21 THR A 88 -6.014 -46.993 6.107 1.00 3.44 H new ATOM 0 HG22 THR A 88 -6.856 -47.742 4.729 1.00 3.44 H new ATOM 0 HG23 THR A 88 -6.395 -46.024 4.664 1.00 3.44 H new ATOM 1382 N THR A 89 -11.196 -45.062 5.434 1.00 2.77 N ATOM 1383 CA THR A 89 -12.560 -44.950 5.930 1.00 2.82 C ATOM 1384 C THR A 89 -13.290 -43.817 5.214 1.00 2.54 C ATOM 1385 O THR A 89 -12.782 -42.698 5.138 1.00 2.15 O ATOM 1386 CB THR A 89 -12.591 -44.700 7.455 1.00 2.79 C ATOM 1387 OG1 THR A 89 -11.834 -45.710 8.133 1.00 3.12 O ATOM 1388 CG2 THR A 89 -14.017 -44.704 7.985 1.00 2.93 C ATOM 0 H THR A 89 -10.805 -44.189 5.080 1.00 2.77 H new ATOM 0 HA THR A 89 -13.062 -45.896 5.728 1.00 2.82 H new ATOM 0 HB THR A 89 -12.152 -43.720 7.641 1.00 2.79 H new ATOM 0 HG1 THR A 89 -11.857 -45.543 9.098 1.00 3.12 H new ATOM 0 HG21 THR A 89 -14.006 -44.526 9.060 1.00 2.93 H new ATOM 0 HG22 THR A 89 -14.590 -43.918 7.493 1.00 2.93 H new ATOM 0 HG23 THR A 89 -14.478 -45.671 7.782 1.00 2.93 H new ATOM 1396 N GLU A 90 -14.470 -44.123 4.687 1.00 2.83 N ATOM 1397 CA GLU A 90 -15.268 -43.149 3.952 1.00 2.75 C ATOM 1398 C GLU A 90 -16.351 -42.563 4.839 1.00 2.72 C ATOM 1399 O GLU A 90 -16.600 -43.057 5.939 1.00 2.81 O ATOM 1400 CB GLU A 90 -15.936 -43.814 2.753 1.00 3.18 C ATOM 1401 CG GLU A 90 -14.962 -44.371 1.733 1.00 3.46 C ATOM 1402 CD GLU A 90 -15.608 -45.389 0.815 1.00 3.95 C ATOM 1403 OE1 GLU A 90 -16.751 -45.161 0.368 1.00 4.39 O ATOM 1404 OE2 GLU A 90 -14.978 -46.429 0.544 1.00 4.26 O ATOM 0 H GLU A 90 -14.898 -45.046 4.756 1.00 2.83 H new ATOM 0 HA GLU A 90 -14.600 -42.355 3.618 1.00 2.75 H new ATOM 0 HB2 GLU A 90 -16.575 -44.622 3.109 1.00 3.18 H new ATOM 0 HB3 GLU A 90 -16.584 -43.088 2.262 1.00 3.18 H new ATOM 0 HG2 GLU A 90 -14.557 -43.553 1.137 1.00 3.46 H new ATOM 0 HG3 GLU A 90 -14.122 -44.834 2.251 1.00 3.46 H new ATOM 1411 N LEU A 91 -16.999 -41.520 4.350 1.00 2.75 N ATOM 1412 CA LEU A 91 -18.157 -40.966 5.024 1.00 2.82 C ATOM 1413 C LEU A 91 -19.416 -41.688 4.578 1.00 3.23 C ATOM 1414 O LEU A 91 -19.640 -41.895 3.385 1.00 3.62 O ATOM 1415 CB LEU A 91 -18.312 -39.468 4.755 1.00 2.88 C ATOM 1416 CG LEU A 91 -17.312 -38.565 5.474 1.00 2.66 C ATOM 1417 CD1 LEU A 91 -16.067 -38.350 4.627 1.00 2.87 C ATOM 1418 CD2 LEU A 91 -17.974 -37.246 5.831 1.00 2.58 C ATOM 0 H LEU A 91 -16.741 -41.040 3.488 1.00 2.75 H new ATOM 0 HA LEU A 91 -18.006 -41.105 6.094 1.00 2.82 H new ATOM 0 HB2 LEU A 91 -18.223 -39.298 3.682 1.00 2.88 H new ATOM 0 HB3 LEU A 91 -19.319 -39.167 5.043 1.00 2.88 H new ATOM 0 HG LEU A 91 -16.995 -39.052 6.396 1.00 2.66 H new ATOM 0 HD11 LEU A 91 -15.371 -37.704 5.161 1.00 2.87 H new ATOM 0 HD12 LEU A 91 -15.591 -39.311 4.429 1.00 2.87 H new ATOM 0 HD13 LEU A 91 -16.346 -37.882 3.683 1.00 2.87 H new ATOM 0 HD21 LEU A 91 -17.256 -36.606 6.344 1.00 2.58 H new ATOM 0 HD22 LEU A 91 -18.316 -36.752 4.921 1.00 2.58 H new ATOM 0 HD23 LEU A 91 -18.826 -37.432 6.485 1.00 2.58 H new ATOM 1615 N THR A 105 -19.822 -38.898 10.842 1.00 3.09 N ATOM 1616 CA THR A 105 -18.901 -39.882 10.313 1.00 2.85 C ATOM 1617 C THR A 105 -17.607 -39.197 9.868 1.00 2.50 C ATOM 1618 O THR A 105 -17.620 -38.310 9.013 1.00 2.53 O ATOM 1619 CB THR A 105 -19.553 -40.664 9.140 1.00 3.10 C ATOM 1620 OG1 THR A 105 -18.612 -41.556 8.531 1.00 3.19 O ATOM 1621 CG2 THR A 105 -20.124 -39.718 8.092 1.00 3.33 C ATOM 0 HA THR A 105 -18.659 -40.600 11.097 1.00 2.85 H new ATOM 0 HB THR A 105 -20.372 -41.250 9.558 1.00 3.10 H new ATOM 0 HG1 THR A 105 -19.046 -42.038 7.797 1.00 3.19 H new ATOM 0 HG21 THR A 105 -20.573 -40.297 7.285 1.00 3.33 H new ATOM 0 HG22 THR A 105 -20.883 -39.084 8.549 1.00 3.33 H new ATOM 0 HG23 THR A 105 -19.325 -39.095 7.690 1.00 3.33 H new ATOM 1629 N THR A 106 -16.497 -39.569 10.494 1.00 2.30 N ATOM 1630 CA THR A 106 -15.205 -38.995 10.158 1.00 2.00 C ATOM 1631 C THR A 106 -14.389 -39.947 9.296 1.00 1.84 C ATOM 1632 O THR A 106 -14.026 -41.046 9.727 1.00 2.05 O ATOM 1633 CB THR A 106 -14.404 -38.625 11.424 1.00 2.07 C ATOM 1634 OG1 THR A 106 -14.745 -39.506 12.505 1.00 2.57 O ATOM 1635 CG2 THR A 106 -14.666 -37.185 11.831 1.00 2.28 C ATOM 0 H THR A 106 -16.468 -40.267 11.238 1.00 2.30 H new ATOM 0 HA THR A 106 -15.399 -38.084 9.592 1.00 2.00 H new ATOM 0 HB THR A 106 -13.344 -38.733 11.195 1.00 2.07 H new ATOM 0 HG1 THR A 106 -14.229 -39.262 13.301 1.00 2.57 H new ATOM 0 HG21 THR A 106 -14.090 -36.949 12.726 1.00 2.28 H new ATOM 0 HG22 THR A 106 -14.369 -36.518 11.022 1.00 2.28 H new ATOM 0 HG23 THR A 106 -15.728 -37.053 12.038 1.00 2.28 H new ATOM 1643 N GLY A 107 -14.110 -39.523 8.075 1.00 1.66 N ATOM 1644 CA GLY A 107 -13.313 -40.327 7.179 1.00 1.63 C ATOM 1645 C GLY A 107 -11.873 -40.411 7.639 1.00 1.49 C ATOM 1646 O GLY A 107 -11.420 -39.580 8.433 1.00 1.43 O ATOM 0 H GLY A 107 -14.423 -38.633 7.688 1.00 1.66 H new ATOM 0 HA2 GLY A 107 -13.735 -41.330 7.116 1.00 1.63 H new ATOM 0 HA3 GLY A 107 -13.351 -39.902 6.176 1.00 1.63 H new ATOM 1650 N ARG A 108 -11.151 -41.407 7.148 1.00 1.61 N ATOM 1651 CA ARG A 108 -9.771 -41.616 7.550 1.00 1.65 C ATOM 1652 C ARG A 108 -8.871 -41.774 6.335 1.00 1.63 C ATOM 1653 O ARG A 108 -9.137 -42.580 5.440 1.00 1.86 O ATOM 1654 CB ARG A 108 -9.650 -42.842 8.460 1.00 2.11 C ATOM 1655 CG ARG A 108 -10.425 -42.717 9.762 1.00 2.25 C ATOM 1656 CD ARG A 108 -9.854 -41.618 10.641 1.00 2.11 C ATOM 1657 NE ARG A 108 -10.727 -41.318 11.776 1.00 2.45 N ATOM 1658 CZ ARG A 108 -10.290 -40.974 12.992 1.00 2.59 C ATOM 1659 NH1 ARG A 108 -8.988 -40.934 13.257 1.00 2.59 N ATOM 1660 NH2 ARG A 108 -11.163 -40.679 13.947 1.00 3.03 N ATOM 0 H ARG A 108 -11.500 -42.084 6.469 1.00 1.61 H new ATOM 0 HA ARG A 108 -9.448 -40.737 8.107 1.00 1.65 H new ATOM 0 HB2 ARG A 108 -10.004 -43.720 7.920 1.00 2.11 H new ATOM 0 HB3 ARG A 108 -8.598 -43.011 8.689 1.00 2.11 H new ATOM 0 HG2 ARG A 108 -11.472 -42.505 9.545 1.00 2.25 H new ATOM 0 HG3 ARG A 108 -10.396 -43.666 10.298 1.00 2.25 H new ATOM 0 HD2 ARG A 108 -8.873 -41.919 11.008 1.00 2.11 H new ATOM 0 HD3 ARG A 108 -9.709 -40.716 10.046 1.00 2.11 H new ATOM 0 HE ARG A 108 -11.735 -41.375 11.630 1.00 2.45 H new ATOM 0 HH11 ARG A 108 -8.312 -41.167 12.529 1.00 2.59 H new ATOM 0 HH12 ARG A 108 -8.665 -40.670 14.188 1.00 2.59 H new ATOM 0 HH21 ARG A 108 -12.164 -40.715 13.752 1.00 3.03 H new ATOM 0 HH22 ARG A 108 -10.833 -40.416 14.876 1.00 3.03 H new ATOM 1674 N ILE A 109 -7.816 -40.981 6.310 1.00 1.50 N ATOM 1675 CA ILE A 109 -6.803 -41.072 5.275 1.00 1.60 C ATOM 1676 C ILE A 109 -5.507 -41.576 5.886 1.00 1.87 C ATOM 1677 O ILE A 109 -5.043 -41.033 6.885 1.00 1.88 O ATOM 1678 CB ILE A 109 -6.544 -39.699 4.619 1.00 1.47 C ATOM 1679 CG1 ILE A 109 -7.823 -39.162 3.977 1.00 1.37 C ATOM 1680 CG2 ILE A 109 -5.432 -39.809 3.584 1.00 1.72 C ATOM 1681 CD1 ILE A 109 -7.720 -37.723 3.514 1.00 1.51 C ATOM 0 H ILE A 109 -7.637 -40.257 7.006 1.00 1.50 H new ATOM 0 HA ILE A 109 -7.161 -41.760 4.509 1.00 1.60 H new ATOM 0 HB ILE A 109 -6.229 -38.999 5.393 1.00 1.47 H new ATOM 0 HG12 ILE A 109 -8.081 -39.790 3.124 1.00 1.37 H new ATOM 0 HG13 ILE A 109 -8.640 -39.245 4.693 1.00 1.37 H new ATOM 0 HG21 ILE A 109 -5.260 -38.833 3.130 1.00 1.72 H new ATOM 0 HG22 ILE A 109 -4.517 -40.150 4.068 1.00 1.72 H new ATOM 0 HG23 ILE A 109 -5.722 -40.522 2.813 1.00 1.72 H new ATOM 0 HD11 ILE A 109 -8.667 -37.415 3.070 1.00 1.51 H new ATOM 0 HD12 ILE A 109 -7.493 -37.082 4.366 1.00 1.51 H new ATOM 0 HD13 ILE A 109 -6.926 -37.635 2.773 1.00 1.51 H new ATOM 1693 N SER A 110 -4.937 -42.621 5.310 1.00 2.17 N ATOM 1694 CA SER A 110 -3.696 -43.175 5.820 1.00 2.50 C ATOM 1695 C SER A 110 -2.563 -42.947 4.826 1.00 2.56 C ATOM 1696 O SER A 110 -2.746 -43.098 3.614 1.00 2.59 O ATOM 1697 CB SER A 110 -3.854 -44.670 6.102 1.00 2.91 C ATOM 1698 OG SER A 110 -2.725 -45.191 6.787 1.00 3.49 O ATOM 0 H SER A 110 -5.313 -43.101 4.492 1.00 2.17 H new ATOM 0 HA SER A 110 -3.451 -42.667 6.753 1.00 2.50 H new ATOM 0 HB2 SER A 110 -4.751 -44.836 6.698 1.00 2.91 H new ATOM 0 HB3 SER A 110 -3.991 -45.206 5.163 1.00 2.91 H new ATOM 0 HG SER A 110 -2.857 -46.148 6.954 1.00 3.49 H new ATOM 1704 N TYR A 111 -1.404 -42.563 5.340 1.00 2.69 N ATOM 1705 CA TYR A 111 -0.222 -42.379 4.515 1.00 2.85 C ATOM 1706 C TYR A 111 1.006 -42.834 5.294 1.00 3.18 C ATOM 1707 O TYR A 111 0.988 -42.851 6.527 1.00 3.29 O ATOM 1708 CB TYR A 111 -0.081 -40.908 4.088 1.00 2.73 C ATOM 1709 CG TYR A 111 0.448 -39.990 5.172 1.00 2.81 C ATOM 1710 CD1 TYR A 111 1.647 -39.310 4.998 1.00 3.03 C ATOM 1711 CD2 TYR A 111 -0.239 -39.808 6.368 1.00 2.78 C ATOM 1712 CE1 TYR A 111 2.147 -38.479 5.979 1.00 3.24 C ATOM 1713 CE2 TYR A 111 0.255 -38.973 7.354 1.00 2.98 C ATOM 1714 CZ TYR A 111 1.449 -38.314 7.154 1.00 3.21 C ATOM 1715 OH TYR A 111 1.942 -37.483 8.132 1.00 3.51 O ATOM 0 H TYR A 111 -1.258 -42.372 6.331 1.00 2.69 H new ATOM 0 HA TYR A 111 -0.317 -42.979 3.610 1.00 2.85 H new ATOM 0 HB2 TYR A 111 0.585 -40.854 3.227 1.00 2.73 H new ATOM 0 HB3 TYR A 111 -1.055 -40.542 3.762 1.00 2.73 H new ATOM 0 HD1 TYR A 111 2.198 -39.434 4.077 1.00 3.03 H new ATOM 0 HD2 TYR A 111 -1.172 -40.327 6.529 1.00 2.78 H new ATOM 0 HE1 TYR A 111 3.082 -37.960 5.826 1.00 3.24 H new ATOM 0 HE2 TYR A 111 -0.292 -38.838 8.275 1.00 2.98 H new ATOM 0 HH TYR A 111 1.328 -37.477 8.896 1.00 3.51 H new ATOM 1725 N GLU A 112 2.062 -43.213 4.588 1.00 3.39 N ATOM 1726 CA GLU A 112 3.268 -43.693 5.241 1.00 3.71 C ATOM 1727 C GLU A 112 4.408 -42.699 5.052 1.00 3.85 C ATOM 1728 O GLU A 112 4.736 -42.321 3.928 1.00 3.97 O ATOM 1729 CB GLU A 112 3.673 -45.058 4.689 1.00 4.03 C ATOM 1730 CG GLU A 112 4.774 -45.732 5.491 1.00 4.47 C ATOM 1731 CD GLU A 112 5.367 -46.930 4.785 1.00 4.81 C ATOM 1732 OE1 GLU A 112 4.864 -48.054 4.997 1.00 5.10 O ATOM 1733 OE2 GLU A 112 6.329 -46.755 4.004 1.00 5.10 O ATOM 0 H GLU A 112 2.107 -43.197 3.569 1.00 3.39 H new ATOM 0 HA GLU A 112 3.059 -43.794 6.306 1.00 3.71 H new ATOM 0 HB2 GLU A 112 2.798 -45.708 4.670 1.00 4.03 H new ATOM 0 HB3 GLU A 112 4.005 -44.940 3.658 1.00 4.03 H new ATOM 0 HG2 GLU A 112 5.564 -45.009 5.694 1.00 4.47 H new ATOM 0 HG3 GLU A 112 4.374 -46.046 6.455 1.00 4.47 H new ATOM 1740 N ASN A 113 4.995 -42.276 6.157 1.00 3.93 N ATOM 1741 CA ASN A 113 6.121 -41.353 6.135 1.00 4.16 C ATOM 1742 C ASN A 113 7.244 -41.898 7.004 1.00 4.41 C ATOM 1743 O ASN A 113 7.070 -42.064 8.199 1.00 4.41 O ATOM 1744 CB ASN A 113 5.678 -39.970 6.634 1.00 4.06 C ATOM 1745 CG ASN A 113 6.821 -38.974 6.732 1.00 4.46 C ATOM 1746 OD1 ASN A 113 7.181 -38.327 5.747 1.00 4.72 O ATOM 1747 ND2 ASN A 113 7.384 -38.827 7.924 1.00 4.78 N ATOM 0 H ASN A 113 4.708 -42.560 7.093 1.00 3.93 H new ATOM 0 HA ASN A 113 6.484 -41.250 5.112 1.00 4.16 H new ATOM 0 HB2 ASN A 113 4.917 -39.575 5.961 1.00 4.06 H new ATOM 0 HB3 ASN A 113 5.213 -40.076 7.614 1.00 4.06 H new ATOM 0 HD21 ASN A 113 8.144 -38.159 8.050 1.00 4.78 H new ATOM 0 HD22 ASN A 113 7.057 -39.382 8.715 1.00 4.78 H new ATOM 1754 N ARG A 114 8.379 -42.217 6.394 1.00 4.69 N ATOM 1755 CA ARG A 114 9.527 -42.756 7.130 1.00 4.99 C ATOM 1756 C ARG A 114 9.184 -44.080 7.817 1.00 5.05 C ATOM 1757 O ARG A 114 9.858 -44.490 8.762 1.00 5.30 O ATOM 1758 CB ARG A 114 10.025 -41.749 8.171 1.00 5.13 C ATOM 1759 CG ARG A 114 10.974 -40.701 7.620 1.00 5.31 C ATOM 1760 CD ARG A 114 11.486 -39.795 8.728 1.00 5.40 C ATOM 1761 NE ARG A 114 12.766 -39.177 8.383 1.00 5.87 N ATOM 1762 CZ ARG A 114 13.937 -39.558 8.897 1.00 6.31 C ATOM 1763 NH1 ARG A 114 13.979 -40.495 9.840 1.00 6.37 N ATOM 1764 NH2 ARG A 114 15.063 -38.985 8.487 1.00 6.97 N ATOM 0 H ARG A 114 8.534 -42.113 5.391 1.00 4.69 H new ATOM 0 HA ARG A 114 10.318 -42.942 6.403 1.00 4.99 H new ATOM 0 HB2 ARG A 114 9.165 -41.247 8.614 1.00 5.13 H new ATOM 0 HB3 ARG A 114 10.526 -42.291 8.973 1.00 5.13 H new ATOM 0 HG2 ARG A 114 11.814 -41.189 7.127 1.00 5.31 H new ATOM 0 HG3 ARG A 114 10.464 -40.104 6.864 1.00 5.31 H new ATOM 0 HD2 ARG A 114 10.750 -39.016 8.929 1.00 5.40 H new ATOM 0 HD3 ARG A 114 11.598 -40.372 9.646 1.00 5.40 H new ATOM 0 HE ARG A 114 12.763 -38.410 7.710 1.00 5.87 H new ATOM 0 HH11 ARG A 114 13.115 -40.924 10.172 1.00 6.37 H new ATOM 0 HH12 ARG A 114 14.875 -40.785 10.231 1.00 6.37 H new ATOM 0 HH21 ARG A 114 15.034 -38.252 7.778 1.00 6.97 H new ATOM 0 HH22 ARG A 114 15.957 -39.278 8.881 1.00 6.97 H new ATOM 1778 N GLY A 115 8.151 -44.751 7.325 1.00 4.92 N ATOM 1779 CA GLY A 115 7.744 -46.017 7.903 1.00 5.09 C ATOM 1780 C GLY A 115 6.637 -45.871 8.933 1.00 4.93 C ATOM 1781 O GLY A 115 6.135 -46.871 9.445 1.00 5.10 O ATOM 0 H GLY A 115 7.586 -44.440 6.534 1.00 4.92 H new ATOM 0 HA2 GLY A 115 7.407 -46.682 7.107 1.00 5.09 H new ATOM 0 HA3 GLY A 115 8.607 -46.491 8.370 1.00 5.09 H new ATOM 1785 N GLU A 116 6.249 -44.636 9.235 1.00 4.66 N ATOM 1786 CA GLU A 116 5.153 -44.397 10.164 1.00 4.53 C ATOM 1787 C GLU A 116 3.882 -44.101 9.373 1.00 4.18 C ATOM 1788 O GLU A 116 3.902 -43.333 8.414 1.00 3.99 O ATOM 1789 CB GLU A 116 5.482 -43.237 11.127 1.00 4.57 C ATOM 1790 CG GLU A 116 5.416 -41.862 10.487 1.00 4.93 C ATOM 1791 CD GLU A 116 6.261 -40.831 11.207 1.00 5.13 C ATOM 1792 OE1 GLU A 116 6.889 -39.992 10.526 1.00 5.38 O ATOM 1793 OE2 GLU A 116 6.322 -40.866 12.456 1.00 5.35 O ATOM 0 H GLU A 116 6.674 -43.792 8.853 1.00 4.66 H new ATOM 0 HA GLU A 116 5.001 -45.289 10.771 1.00 4.53 H new ATOM 0 HB2 GLU A 116 4.788 -43.269 11.967 1.00 4.57 H new ATOM 0 HB3 GLU A 116 6.482 -43.389 11.534 1.00 4.57 H new ATOM 0 HG2 GLU A 116 5.746 -41.934 9.451 1.00 4.93 H new ATOM 0 HG3 GLU A 116 4.379 -41.525 10.469 1.00 4.93 H new ATOM 1800 N CYS A 117 2.792 -44.741 9.744 1.00 4.18 N ATOM 1801 CA CYS A 117 1.525 -44.529 9.062 1.00 3.90 C ATOM 1802 C CYS A 117 0.501 -43.930 10.017 1.00 3.80 C ATOM 1803 O CYS A 117 0.165 -44.527 11.042 1.00 4.05 O ATOM 1804 CB CYS A 117 1.008 -45.839 8.457 1.00 4.06 C ATOM 1805 SG CYS A 117 0.984 -47.235 9.606 1.00 4.72 S ATOM 0 H CYS A 117 2.754 -45.411 10.512 1.00 4.18 H new ATOM 0 HA CYS A 117 1.686 -43.823 8.247 1.00 3.90 H new ATOM 0 HB2 CYS A 117 -0.002 -45.677 8.080 1.00 4.06 H new ATOM 0 HB3 CYS A 117 1.630 -46.100 7.601 1.00 4.06 H new ATOM 0 HG CYS A 117 0.634 -46.819 10.787 1.00 4.72 H new ATOM 1811 N PHE A 118 0.034 -42.736 9.696 1.00 3.50 N ATOM 1812 CA PHE A 118 -0.962 -42.062 10.516 1.00 3.44 C ATOM 1813 C PHE A 118 -2.308 -42.046 9.812 1.00 2.98 C ATOM 1814 O PHE A 118 -2.377 -42.131 8.583 1.00 2.77 O ATOM 1815 CB PHE A 118 -0.532 -40.627 10.837 1.00 3.55 C ATOM 1816 CG PHE A 118 0.696 -40.541 11.702 1.00 3.82 C ATOM 1817 CD1 PHE A 118 1.908 -40.128 11.168 1.00 4.03 C ATOM 1818 CD2 PHE A 118 0.640 -40.877 13.044 1.00 4.21 C ATOM 1819 CE1 PHE A 118 3.039 -40.052 11.958 1.00 4.37 C ATOM 1820 CE2 PHE A 118 1.768 -40.802 13.838 1.00 4.61 C ATOM 1821 CZ PHE A 118 2.960 -40.371 13.304 1.00 4.58 C ATOM 0 H PHE A 118 0.328 -42.211 8.872 1.00 3.50 H new ATOM 0 HA PHE A 118 -1.052 -42.616 11.451 1.00 3.44 H new ATOM 0 HB2 PHE A 118 -0.346 -40.096 9.904 1.00 3.55 H new ATOM 0 HB3 PHE A 118 -1.354 -40.114 11.337 1.00 3.55 H new ATOM 0 HD1 PHE A 118 1.968 -39.863 10.123 1.00 4.03 H new ATOM 0 HD2 PHE A 118 -0.296 -41.201 13.475 1.00 4.21 H new ATOM 0 HE1 PHE A 118 3.981 -39.745 11.528 1.00 4.37 H new ATOM 0 HE2 PHE A 118 1.714 -41.082 14.880 1.00 4.61 H new ATOM 0 HZ PHE A 118 3.833 -40.281 13.933 1.00 4.58 H new ATOM 1831 N PHE A 119 -3.371 -41.949 10.596 1.00 2.93 N ATOM 1832 CA PHE A 119 -4.719 -41.863 10.063 1.00 2.55 C ATOM 1833 C PHE A 119 -5.277 -40.471 10.303 1.00 2.30 C ATOM 1834 O PHE A 119 -5.337 -40.006 11.442 1.00 2.51 O ATOM 1835 CB PHE A 119 -5.626 -42.918 10.706 1.00 2.77 C ATOM 1836 CG PHE A 119 -5.247 -44.332 10.356 1.00 3.13 C ATOM 1837 CD1 PHE A 119 -4.227 -44.985 11.035 1.00 3.59 C ATOM 1838 CD2 PHE A 119 -5.913 -45.008 9.345 1.00 3.09 C ATOM 1839 CE1 PHE A 119 -3.881 -46.283 10.709 1.00 3.96 C ATOM 1840 CE2 PHE A 119 -5.571 -46.305 9.018 1.00 3.50 C ATOM 1841 CZ PHE A 119 -4.553 -46.944 9.699 1.00 3.92 C ATOM 0 H PHE A 119 -3.323 -41.928 11.615 1.00 2.93 H new ATOM 0 HA PHE A 119 -4.684 -42.055 8.991 1.00 2.55 H new ATOM 0 HB2 PHE A 119 -5.595 -42.800 11.789 1.00 2.77 H new ATOM 0 HB3 PHE A 119 -6.655 -42.739 10.395 1.00 2.77 H new ATOM 0 HD1 PHE A 119 -3.699 -44.474 11.826 1.00 3.59 H new ATOM 0 HD2 PHE A 119 -6.709 -44.514 8.807 1.00 3.09 H new ATOM 0 HE1 PHE A 119 -3.085 -46.780 11.244 1.00 3.96 H new ATOM 0 HE2 PHE A 119 -6.099 -46.820 8.230 1.00 3.50 H new ATOM 0 HZ PHE A 119 -4.283 -47.958 9.442 1.00 3.92 H new ATOM 1851 N LEU A 120 -5.686 -39.809 9.233 1.00 1.95 N ATOM 1852 CA LEU A 120 -6.155 -38.435 9.318 1.00 1.87 C ATOM 1853 C LEU A 120 -7.671 -38.386 9.227 1.00 1.61 C ATOM 1854 O LEU A 120 -8.256 -38.845 8.246 1.00 1.40 O ATOM 1855 CB LEU A 120 -5.554 -37.569 8.192 1.00 1.90 C ATOM 1856 CG LEU A 120 -4.053 -37.250 8.286 1.00 2.20 C ATOM 1857 CD1 LEU A 120 -3.704 -36.654 9.640 1.00 2.75 C ATOM 1858 CD2 LEU A 120 -3.203 -38.483 8.006 1.00 2.63 C ATOM 0 H LEU A 120 -5.703 -40.202 8.292 1.00 1.95 H new ATOM 0 HA LEU A 120 -5.831 -38.037 10.280 1.00 1.87 H new ATOM 0 HB2 LEU A 120 -5.735 -38.073 7.243 1.00 1.90 H new ATOM 0 HB3 LEU A 120 -6.100 -36.626 8.161 1.00 1.90 H new ATOM 0 HG LEU A 120 -3.829 -36.508 7.519 1.00 2.20 H new ATOM 0 HD11 LEU A 120 -2.636 -36.438 9.678 1.00 2.75 H new ATOM 0 HD12 LEU A 120 -4.266 -35.732 9.787 1.00 2.75 H new ATOM 0 HD13 LEU A 120 -3.959 -37.364 10.427 1.00 2.75 H new ATOM 0 HD21 LEU A 120 -2.147 -38.222 8.081 1.00 2.63 H new ATOM 0 HD22 LEU A 120 -3.437 -39.259 8.734 1.00 2.63 H new ATOM 0 HD23 LEU A 120 -3.415 -38.851 7.002 1.00 2.63 H new ATOM 1870 N PRO A 121 -8.325 -37.853 10.269 1.00 1.73 N ATOM 1871 CA PRO A 121 -9.774 -37.644 10.276 1.00 1.62 C ATOM 1872 C PRO A 121 -10.173 -36.428 9.446 1.00 1.64 C ATOM 1873 O PRO A 121 -9.568 -35.363 9.565 1.00 1.95 O ATOM 1874 CB PRO A 121 -10.082 -37.398 11.751 1.00 1.92 C ATOM 1875 CG PRO A 121 -8.836 -36.792 12.295 1.00 2.30 C ATOM 1876 CD PRO A 121 -7.700 -37.416 11.535 1.00 2.10 C ATOM 0 HA PRO A 121 -10.317 -38.485 9.846 1.00 1.62 H new ATOM 0 HB2 PRO A 121 -10.934 -36.730 11.873 1.00 1.92 H new ATOM 0 HB3 PRO A 121 -10.329 -38.327 12.265 1.00 1.92 H new ATOM 0 HG2 PRO A 121 -8.842 -35.710 12.167 1.00 2.30 H new ATOM 0 HG3 PRO A 121 -8.743 -36.986 13.363 1.00 2.30 H new ATOM 0 HD2 PRO A 121 -6.896 -36.702 11.359 1.00 2.10 H new ATOM 0 HD3 PRO A 121 -7.267 -38.256 12.079 1.00 2.10 H new ATOM 1884 N TYR A 122 -11.177 -36.590 8.602 1.00 1.51 N ATOM 1885 CA TYR A 122 -11.671 -35.485 7.795 1.00 1.74 C ATOM 1886 C TYR A 122 -13.174 -35.600 7.610 1.00 1.86 C ATOM 1887 O TYR A 122 -13.741 -36.691 7.709 1.00 1.73 O ATOM 1888 CB TYR A 122 -10.964 -35.439 6.429 1.00 1.68 C ATOM 1889 CG TYR A 122 -11.340 -36.566 5.482 1.00 1.53 C ATOM 1890 CD1 TYR A 122 -10.794 -37.836 5.621 1.00 1.31 C ATOM 1891 CD2 TYR A 122 -12.243 -36.351 4.446 1.00 1.85 C ATOM 1892 CE1 TYR A 122 -11.136 -38.857 4.752 1.00 1.49 C ATOM 1893 CE2 TYR A 122 -12.588 -37.366 3.577 1.00 1.95 C ATOM 1894 CZ TYR A 122 -12.035 -38.616 3.736 1.00 1.80 C ATOM 1895 OH TYR A 122 -12.374 -39.626 2.870 1.00 2.13 O ATOM 0 H TYR A 122 -11.666 -37.473 8.457 1.00 1.51 H new ATOM 0 HA TYR A 122 -11.451 -34.555 8.320 1.00 1.74 H new ATOM 0 HB2 TYR A 122 -11.192 -34.488 5.949 1.00 1.68 H new ATOM 0 HB3 TYR A 122 -9.886 -35.463 6.592 1.00 1.68 H new ATOM 0 HD1 TYR A 122 -10.092 -38.029 6.419 1.00 1.31 H new ATOM 0 HD2 TYR A 122 -12.682 -35.372 4.319 1.00 1.85 H new ATOM 0 HE1 TYR A 122 -10.700 -39.838 4.870 1.00 1.49 H new ATOM 0 HE2 TYR A 122 -13.288 -37.180 2.776 1.00 1.95 H new ATOM 0 HH TYR A 122 -13.175 -39.371 2.367 1.00 2.13 H new ATOM 1905 N THR A 123 -13.819 -34.471 7.367 1.00 2.24 N ATOM 1906 CA THR A 123 -15.245 -34.451 7.121 1.00 2.46 C ATOM 1907 C THR A 123 -15.518 -34.176 5.647 1.00 2.67 C ATOM 1908 O THR A 123 -14.593 -34.095 4.841 1.00 2.68 O ATOM 1909 CB THR A 123 -15.960 -33.381 7.975 1.00 2.83 C ATOM 1910 OG1 THR A 123 -15.485 -32.070 7.640 1.00 3.07 O ATOM 1911 CG2 THR A 123 -15.752 -33.635 9.459 1.00 2.70 C ATOM 0 H THR A 123 -13.372 -33.555 7.336 1.00 2.24 H new ATOM 0 HA THR A 123 -15.636 -35.430 7.399 1.00 2.46 H new ATOM 0 HB THR A 123 -17.026 -33.443 7.758 1.00 2.83 H new ATOM 0 HG1 THR A 123 -14.597 -32.138 7.232 1.00 3.07 H new ATOM 0 HG21 THR A 123 -16.267 -32.866 10.035 1.00 2.70 H new ATOM 0 HG22 THR A 123 -16.153 -34.614 9.720 1.00 2.70 H new ATOM 0 HG23 THR A 123 -14.686 -33.607 9.687 1.00 2.70 H new ATOM 1919 N LYS A 124 -16.787 -34.023 5.302 1.00 2.91 N ATOM 1920 CA LYS A 124 -17.187 -33.726 3.934 1.00 3.18 C ATOM 1921 C LYS A 124 -16.806 -32.288 3.563 1.00 3.52 C ATOM 1922 O LYS A 124 -16.714 -31.936 2.389 1.00 3.73 O ATOM 1923 CB LYS A 124 -18.697 -33.937 3.798 1.00 3.46 C ATOM 1924 CG LYS A 124 -19.246 -33.659 2.412 1.00 3.82 C ATOM 1925 CD LYS A 124 -20.762 -33.795 2.372 1.00 4.06 C ATOM 1926 CE LYS A 124 -21.219 -35.235 2.554 1.00 4.34 C ATOM 1927 NZ LYS A 124 -22.701 -35.348 2.528 1.00 4.80 N ATOM 0 H LYS A 124 -17.565 -34.100 5.957 1.00 2.91 H new ATOM 0 HA LYS A 124 -16.666 -34.396 3.250 1.00 3.18 H new ATOM 0 HB2 LYS A 124 -18.934 -34.966 4.070 1.00 3.46 H new ATOM 0 HB3 LYS A 124 -19.208 -33.293 4.514 1.00 3.46 H new ATOM 0 HG2 LYS A 124 -18.962 -32.653 2.103 1.00 3.82 H new ATOM 0 HG3 LYS A 124 -18.799 -34.350 1.698 1.00 3.82 H new ATOM 0 HD2 LYS A 124 -21.201 -33.176 3.154 1.00 4.06 H new ATOM 0 HD3 LYS A 124 -21.133 -33.416 1.420 1.00 4.06 H new ATOM 0 HE2 LYS A 124 -20.793 -35.855 1.765 1.00 4.34 H new ATOM 0 HE3 LYS A 124 -20.841 -35.620 3.501 1.00 4.34 H new ATOM 0 HZ1 LYS A 124 -22.976 -36.343 2.655 1.00 4.80 H new ATOM 0 HZ2 LYS A 124 -23.106 -34.776 3.296 1.00 4.80 H new ATOM 0 HZ3 LYS A 124 -23.059 -35.004 1.614 1.00 4.80 H new ATOM 1941 N ASP A 125 -16.584 -31.469 4.583 1.00 3.65 N ATOM 1942 CA ASP A 125 -16.268 -30.054 4.386 1.00 4.07 C ATOM 1943 C ASP A 125 -14.789 -29.852 4.064 1.00 4.05 C ATOM 1944 O ASP A 125 -14.423 -28.907 3.365 1.00 4.41 O ATOM 1945 CB ASP A 125 -16.646 -29.255 5.641 1.00 4.30 C ATOM 1946 CG ASP A 125 -16.325 -27.771 5.534 1.00 4.39 C ATOM 1947 OD1 ASP A 125 -15.390 -27.306 6.225 1.00 4.81 O ATOM 1948 OD2 ASP A 125 -16.975 -27.074 4.725 1.00 4.45 O ATOM 0 H ASP A 125 -16.616 -31.759 5.560 1.00 3.65 H new ATOM 0 HA ASP A 125 -16.848 -29.694 3.536 1.00 4.07 H new ATOM 0 HB2 ASP A 125 -17.712 -29.375 5.831 1.00 4.30 H new ATOM 0 HB3 ASP A 125 -16.120 -29.672 6.500 1.00 4.30 H new ATOM 1953 N ASP A 126 -13.948 -30.758 4.555 1.00 3.65 N ATOM 1954 CA ASP A 126 -12.495 -30.639 4.388 1.00 3.64 C ATOM 1955 C ASP A 126 -12.071 -30.969 2.961 1.00 3.61 C ATOM 1956 O ASP A 126 -10.977 -30.602 2.526 1.00 3.68 O ATOM 1957 CB ASP A 126 -11.752 -31.565 5.356 1.00 3.26 C ATOM 1958 CG ASP A 126 -12.075 -31.285 6.809 1.00 3.55 C ATOM 1959 OD1 ASP A 126 -11.456 -30.372 7.390 1.00 3.84 O ATOM 1960 OD2 ASP A 126 -12.950 -31.970 7.378 1.00 3.78 O ATOM 0 H ASP A 126 -14.244 -31.585 5.073 1.00 3.65 H new ATOM 0 HA ASP A 126 -12.234 -29.603 4.606 1.00 3.64 H new ATOM 0 HB2 ASP A 126 -12.005 -32.600 5.126 1.00 3.26 H new ATOM 0 HB3 ASP A 126 -10.678 -31.457 5.201 1.00 3.26 H new ATOM 1965 N VAL A 127 -12.932 -31.670 2.243 1.00 3.59 N ATOM 1966 CA VAL A 127 -12.640 -32.062 0.874 1.00 3.64 C ATOM 1967 C VAL A 127 -13.475 -31.249 -0.120 1.00 4.14 C ATOM 1968 O VAL A 127 -14.689 -31.428 -0.242 1.00 4.39 O ATOM 1969 CB VAL A 127 -12.861 -33.584 0.656 1.00 3.47 C ATOM 1970 CG1 VAL A 127 -14.249 -34.020 1.111 1.00 3.60 C ATOM 1971 CG2 VAL A 127 -12.632 -33.966 -0.804 1.00 3.58 C ATOM 0 H VAL A 127 -13.841 -31.980 2.586 1.00 3.59 H new ATOM 0 HA VAL A 127 -11.586 -31.849 0.693 1.00 3.64 H new ATOM 0 HB VAL A 127 -12.129 -34.109 1.269 1.00 3.47 H new ATOM 0 HG11 VAL A 127 -14.367 -35.090 0.943 1.00 3.60 H new ATOM 0 HG12 VAL A 127 -14.369 -33.804 2.173 1.00 3.60 H new ATOM 0 HG13 VAL A 127 -15.005 -33.478 0.543 1.00 3.60 H new ATOM 0 HG21 VAL A 127 -12.793 -35.037 -0.930 1.00 3.58 H new ATOM 0 HG22 VAL A 127 -13.329 -33.417 -1.437 1.00 3.58 H new ATOM 0 HG23 VAL A 127 -11.610 -33.717 -1.089 1.00 3.58 H new ATOM 1981 N GLU A 128 -12.818 -30.337 -0.827 1.00 4.35 N ATOM 1982 CA GLU A 128 -13.505 -29.524 -1.819 1.00 4.86 C ATOM 1983 C GLU A 128 -13.459 -30.205 -3.179 1.00 5.02 C ATOM 1984 O GLU A 128 -12.442 -30.772 -3.570 1.00 4.84 O ATOM 1985 CB GLU A 128 -12.906 -28.115 -1.906 1.00 5.16 C ATOM 1986 CG GLU A 128 -13.600 -27.238 -2.939 1.00 5.70 C ATOM 1987 CD GLU A 128 -13.154 -25.792 -2.896 1.00 6.10 C ATOM 1988 OE1 GLU A 128 -12.102 -25.475 -3.492 1.00 6.36 O ATOM 1989 OE2 GLU A 128 -13.831 -24.975 -2.247 1.00 6.43 O ATOM 0 H GLU A 128 -11.821 -30.144 -0.733 1.00 4.35 H new ATOM 0 HA GLU A 128 -14.544 -29.422 -1.506 1.00 4.86 H new ATOM 0 HB2 GLU A 128 -12.971 -27.637 -0.929 1.00 5.16 H new ATOM 0 HB3 GLU A 128 -11.847 -28.191 -2.154 1.00 5.16 H new ATOM 0 HG2 GLU A 128 -13.409 -27.640 -3.934 1.00 5.70 H new ATOM 0 HG3 GLU A 128 -14.677 -27.283 -2.779 1.00 5.70 H new ATOM 1996 N GLY A 129 -14.579 -30.158 -3.885 1.00 5.45 N ATOM 1997 CA GLY A 129 -14.675 -30.804 -5.174 1.00 5.71 C ATOM 1998 C GLY A 129 -15.908 -31.669 -5.269 1.00 5.64 C ATOM 1999 O GLY A 129 -16.362 -31.988 -6.364 1.00 5.91 O ATOM 0 H GLY A 129 -15.428 -29.680 -3.584 1.00 5.45 H new ATOM 0 HA2 GLY A 129 -14.698 -30.049 -5.960 1.00 5.71 H new ATOM 0 HA3 GLY A 129 -13.788 -31.414 -5.343 1.00 5.71 H new ATOM 2003 N ASN A 130 -16.442 -32.044 -4.106 1.00 5.33 N ATOM 2004 CA ASN A 130 -17.662 -32.852 -4.017 1.00 5.30 C ATOM 2005 C ASN A 130 -17.441 -34.209 -4.688 1.00 5.15 C ATOM 2006 O ASN A 130 -18.359 -34.816 -5.239 1.00 5.40 O ATOM 2007 CB ASN A 130 -18.855 -32.113 -4.652 1.00 5.81 C ATOM 2008 CG ASN A 130 -20.205 -32.631 -4.176 1.00 5.81 C ATOM 2009 OD1 ASN A 130 -20.735 -32.177 -3.160 1.00 5.87 O ATOM 2010 ND2 ASN A 130 -20.776 -33.573 -4.909 1.00 6.07 N ATOM 0 H ASN A 130 -16.043 -31.798 -3.200 1.00 5.33 H new ATOM 0 HA ASN A 130 -17.895 -33.018 -2.965 1.00 5.30 H new ATOM 0 HB2 ASN A 130 -18.780 -31.050 -4.422 1.00 5.81 H new ATOM 0 HB3 ASN A 130 -18.798 -32.209 -5.736 1.00 5.81 H new ATOM 0 HD21 ASN A 130 -21.685 -33.948 -4.639 1.00 6.07 H new ATOM 0 HD22 ASN A 130 -20.307 -33.924 -5.744 1.00 6.07 H new ATOM 2017 N VAL A 131 -16.205 -34.688 -4.624 1.00 4.82 N ATOM 2018 CA VAL A 131 -15.862 -35.974 -5.202 1.00 4.75 C ATOM 2019 C VAL A 131 -16.053 -37.084 -4.168 1.00 4.41 C ATOM 2020 O VAL A 131 -15.741 -36.911 -2.990 1.00 4.10 O ATOM 2021 CB VAL A 131 -14.413 -35.976 -5.751 1.00 4.68 C ATOM 2022 CG1 VAL A 131 -13.405 -35.702 -4.645 1.00 4.61 C ATOM 2023 CG2 VAL A 131 -14.104 -37.287 -6.446 1.00 5.27 C ATOM 0 H VAL A 131 -15.427 -34.203 -4.177 1.00 4.82 H new ATOM 0 HA VAL A 131 -16.531 -36.159 -6.042 1.00 4.75 H new ATOM 0 HB VAL A 131 -14.332 -35.172 -6.483 1.00 4.68 H new ATOM 0 HG11 VAL A 131 -12.397 -35.710 -5.061 1.00 4.61 H new ATOM 0 HG12 VAL A 131 -13.607 -34.727 -4.202 1.00 4.61 H new ATOM 0 HG13 VAL A 131 -13.487 -36.473 -3.879 1.00 4.61 H new ATOM 0 HG21 VAL A 131 -13.082 -37.266 -6.824 1.00 5.27 H new ATOM 0 HG22 VAL A 131 -14.213 -38.109 -5.738 1.00 5.27 H new ATOM 0 HG23 VAL A 131 -14.795 -37.430 -7.277 1.00 5.27 H new ATOM 2033 N ASN A 132 -16.604 -38.205 -4.597 1.00 4.53 N ATOM 2034 CA ASN A 132 -16.835 -39.326 -3.697 1.00 4.32 C ATOM 2035 C ASN A 132 -15.569 -40.145 -3.538 1.00 4.08 C ATOM 2036 O ASN A 132 -15.189 -40.899 -4.437 1.00 4.36 O ATOM 2037 CB ASN A 132 -17.970 -40.218 -4.207 1.00 4.70 C ATOM 2038 CG ASN A 132 -19.354 -39.610 -4.024 1.00 5.21 C ATOM 2039 OD1 ASN A 132 -19.453 -38.290 -4.081 1.00 5.39 O flip ATOM 2040 ND2 ASN A 132 -20.335 -40.332 -3.837 1.00 5.78 N flip ATOM 0 H ASN A 132 -16.900 -38.366 -5.560 1.00 4.53 H new ATOM 0 HA ASN A 132 -17.124 -38.922 -2.727 1.00 4.32 H new ATOM 0 HB2 ASN A 132 -17.810 -40.425 -5.265 1.00 4.70 H new ATOM 0 HB3 ASN A 132 -17.931 -41.175 -3.686 1.00 4.70 H new ATOM 0 HD21 ASN A 132 -20.223 -41.345 -3.799 1.00 5.78 H new ATOM 0 HD22 ASN A 132 -21.259 -39.917 -3.721 1.00 5.78 H new ATOM 2047 N LEU A 133 -14.909 -39.968 -2.407 1.00 3.62 N ATOM 2048 CA LEU A 133 -13.687 -40.696 -2.108 1.00 3.40 C ATOM 2049 C LEU A 133 -14.030 -42.130 -1.724 1.00 3.37 C ATOM 2050 O LEU A 133 -14.960 -42.363 -0.952 1.00 3.37 O ATOM 2051 CB LEU A 133 -12.915 -40.026 -0.958 1.00 3.04 C ATOM 2052 CG LEU A 133 -12.760 -38.500 -1.057 1.00 2.71 C ATOM 2053 CD1 LEU A 133 -13.900 -37.792 -0.338 1.00 2.74 C ATOM 2054 CD2 LEU A 133 -11.426 -38.056 -0.481 1.00 2.93 C ATOM 0 H LEU A 133 -15.201 -39.321 -1.675 1.00 3.62 H new ATOM 0 HA LEU A 133 -13.056 -40.691 -2.996 1.00 3.40 H new ATOM 0 HB2 LEU A 133 -13.420 -40.261 -0.021 1.00 3.04 H new ATOM 0 HB3 LEU A 133 -11.921 -40.471 -0.905 1.00 3.04 H new ATOM 0 HG LEU A 133 -12.793 -38.229 -2.112 1.00 2.71 H new ATOM 0 HD11 LEU A 133 -13.769 -36.713 -0.422 1.00 2.74 H new ATOM 0 HD12 LEU A 133 -14.849 -38.078 -0.791 1.00 2.74 H new ATOM 0 HD13 LEU A 133 -13.899 -38.077 0.714 1.00 2.74 H new ATOM 0 HD21 LEU A 133 -11.337 -36.973 -0.561 1.00 2.93 H new ATOM 0 HD22 LEU A 133 -11.367 -38.348 0.567 1.00 2.93 H new ATOM 0 HD23 LEU A 133 -10.615 -38.528 -1.035 1.00 2.93 H new ATOM 2066 N ARG A 134 -13.295 -43.083 -2.269 1.00 3.47 N ATOM 2067 CA ARG A 134 -13.546 -44.490 -1.991 1.00 3.60 C ATOM 2068 C ARG A 134 -12.310 -45.133 -1.392 1.00 3.44 C ATOM 2069 O ARG A 134 -11.223 -45.052 -1.954 1.00 3.34 O ATOM 2070 CB ARG A 134 -13.965 -45.232 -3.265 1.00 4.11 C ATOM 2071 CG ARG A 134 -15.310 -44.781 -3.824 1.00 4.62 C ATOM 2072 CD ARG A 134 -16.402 -44.881 -2.773 1.00 5.03 C ATOM 2073 NE ARG A 134 -17.738 -44.663 -3.324 1.00 5.60 N ATOM 2074 CZ ARG A 134 -18.861 -44.824 -2.624 1.00 6.26 C ATOM 2075 NH1 ARG A 134 -18.804 -45.131 -1.331 1.00 6.50 N ATOM 2076 NH2 ARG A 134 -20.038 -44.655 -3.213 1.00 6.93 N ATOM 0 H ARG A 134 -12.518 -42.910 -2.907 1.00 3.47 H new ATOM 0 HA ARG A 134 -14.363 -44.557 -1.273 1.00 3.60 H new ATOM 0 HB2 ARG A 134 -13.199 -45.089 -4.027 1.00 4.11 H new ATOM 0 HB3 ARG A 134 -14.009 -46.301 -3.054 1.00 4.11 H new ATOM 0 HG2 ARG A 134 -15.234 -43.752 -4.177 1.00 4.62 H new ATOM 0 HG3 ARG A 134 -15.573 -45.395 -4.685 1.00 4.62 H new ATOM 0 HD2 ARG A 134 -16.362 -45.865 -2.306 1.00 5.03 H new ATOM 0 HD3 ARG A 134 -16.213 -44.148 -1.988 1.00 5.03 H new ATOM 0 HE ARG A 134 -17.815 -44.371 -4.298 1.00 5.60 H new ATOM 0 HH11 ARG A 134 -17.900 -45.244 -0.873 1.00 6.50 H new ATOM 0 HH12 ARG A 134 -19.665 -45.254 -0.798 1.00 6.50 H new ATOM 0 HH21 ARG A 134 -20.083 -44.402 -4.200 1.00 6.93 H new ATOM 0 HH22 ARG A 134 -20.898 -44.778 -2.679 1.00 6.93 H new ATOM 2090 N ALA A 135 -12.482 -45.773 -0.250 1.00 3.50 N ATOM 2091 CA ALA A 135 -11.362 -46.341 0.477 1.00 3.46 C ATOM 2092 C ALA A 135 -10.593 -47.333 -0.380 1.00 3.76 C ATOM 2093 O ALA A 135 -11.091 -48.406 -0.721 1.00 4.12 O ATOM 2094 CB ALA A 135 -11.836 -46.972 1.768 1.00 3.55 C ATOM 0 H ALA A 135 -13.389 -45.913 0.195 1.00 3.50 H new ATOM 0 HA ALA A 135 -10.673 -45.534 0.729 1.00 3.46 H new ATOM 0 HB1 ALA A 135 -10.984 -47.393 2.301 1.00 3.55 H new ATOM 0 HB2 ALA A 135 -12.314 -46.215 2.389 1.00 3.55 H new ATOM 0 HB3 ALA A 135 -12.552 -47.763 1.545 1.00 3.55 H new ATOM 2100 N GLY A 136 -9.367 -46.965 -0.707 1.00 3.64 N ATOM 2101 CA GLY A 136 -8.570 -47.755 -1.613 1.00 3.92 C ATOM 2102 C GLY A 136 -8.171 -46.993 -2.866 1.00 3.86 C ATOM 2103 O GLY A 136 -7.450 -47.531 -3.710 1.00 4.07 O ATOM 0 H GLY A 136 -8.907 -46.125 -0.357 1.00 3.64 H new ATOM 0 HA2 GLY A 136 -7.671 -48.094 -1.098 1.00 3.92 H new ATOM 0 HA3 GLY A 136 -9.129 -48.646 -1.898 1.00 3.92 H new ATOM 2107 N ASP A 137 -8.636 -45.750 -3.004 1.00 3.62 N ATOM 2108 CA ASP A 137 -8.176 -44.892 -4.091 1.00 3.60 C ATOM 2109 C ASP A 137 -7.030 -44.001 -3.619 1.00 3.29 C ATOM 2110 O ASP A 137 -6.620 -44.059 -2.453 1.00 3.03 O ATOM 2111 CB ASP A 137 -9.317 -44.038 -4.692 1.00 3.68 C ATOM 2112 CG ASP A 137 -9.992 -43.085 -3.711 1.00 3.74 C ATOM 2113 OD1 ASP A 137 -11.171 -42.736 -3.914 1.00 4.06 O ATOM 2114 OD2 ASP A 137 -9.333 -42.696 -2.715 1.00 3.84 O ATOM 0 H ASP A 137 -9.323 -45.321 -2.383 1.00 3.62 H new ATOM 0 HA ASP A 137 -7.815 -45.546 -4.885 1.00 3.60 H new ATOM 0 HB2 ASP A 137 -8.917 -43.457 -5.523 1.00 3.68 H new ATOM 0 HB3 ASP A 137 -10.073 -44.706 -5.105 1.00 3.68 H new ATOM 2119 N LYS A 138 -6.499 -43.198 -4.526 1.00 3.37 N ATOM 2120 CA LYS A 138 -5.393 -42.313 -4.203 1.00 3.18 C ATOM 2121 C LYS A 138 -5.880 -40.900 -3.963 1.00 3.06 C ATOM 2122 O LYS A 138 -6.501 -40.286 -4.834 1.00 3.28 O ATOM 2123 CB LYS A 138 -4.363 -42.303 -5.326 1.00 3.42 C ATOM 2124 CG LYS A 138 -3.700 -43.643 -5.550 1.00 3.71 C ATOM 2125 CD LYS A 138 -2.647 -43.952 -4.499 1.00 3.84 C ATOM 2126 CE LYS A 138 -1.517 -42.930 -4.504 1.00 3.75 C ATOM 2127 NZ LYS A 138 -0.973 -42.690 -5.871 1.00 4.17 N ATOM 0 H LYS A 138 -6.817 -43.141 -5.494 1.00 3.37 H new ATOM 0 HA LYS A 138 -4.929 -42.690 -3.291 1.00 3.18 H new ATOM 0 HB2 LYS A 138 -4.848 -41.988 -6.250 1.00 3.42 H new ATOM 0 HB3 LYS A 138 -3.597 -41.561 -5.099 1.00 3.42 H new ATOM 0 HG2 LYS A 138 -4.458 -44.426 -5.542 1.00 3.71 H new ATOM 0 HG3 LYS A 138 -3.239 -43.656 -6.537 1.00 3.71 H new ATOM 0 HD2 LYS A 138 -3.113 -43.972 -3.514 1.00 3.84 H new ATOM 0 HD3 LYS A 138 -2.237 -44.946 -4.678 1.00 3.84 H new ATOM 0 HE2 LYS A 138 -1.880 -41.989 -4.090 1.00 3.75 H new ATOM 0 HE3 LYS A 138 -0.715 -43.276 -3.852 1.00 3.75 H new ATOM 0 HZ1 LYS A 138 -0.023 -42.273 -5.798 1.00 4.17 H new ATOM 0 HZ2 LYS A 138 -0.917 -43.592 -6.386 1.00 4.17 H new ATOM 0 HZ3 LYS A 138 -1.599 -42.037 -6.384 1.00 4.17 H new ATOM 2141 N VAL A 139 -5.577 -40.384 -2.791 1.00 2.77 N ATOM 2142 CA VAL A 139 -5.949 -39.024 -2.441 1.00 2.74 C ATOM 2143 C VAL A 139 -4.712 -38.200 -2.104 1.00 2.69 C ATOM 2144 O VAL A 139 -3.691 -38.734 -1.670 1.00 2.61 O ATOM 2145 CB VAL A 139 -6.954 -38.975 -1.265 1.00 2.56 C ATOM 2146 CG1 VAL A 139 -8.276 -39.614 -1.656 1.00 2.71 C ATOM 2147 CG2 VAL A 139 -6.381 -39.649 -0.027 1.00 2.26 C ATOM 0 H VAL A 139 -5.072 -40.885 -2.060 1.00 2.77 H new ATOM 0 HA VAL A 139 -6.442 -38.595 -3.313 1.00 2.74 H new ATOM 0 HB VAL A 139 -7.137 -37.927 -1.027 1.00 2.56 H new ATOM 0 HG11 VAL A 139 -8.966 -39.568 -0.813 1.00 2.71 H new ATOM 0 HG12 VAL A 139 -8.702 -39.078 -2.504 1.00 2.71 H new ATOM 0 HG13 VAL A 139 -8.109 -40.655 -1.931 1.00 2.71 H new ATOM 0 HG21 VAL A 139 -7.108 -39.600 0.784 1.00 2.26 H new ATOM 0 HG22 VAL A 139 -6.157 -40.692 -0.251 1.00 2.26 H new ATOM 0 HG23 VAL A 139 -5.466 -39.139 0.275 1.00 2.26 H new ATOM 2157 N SER A 140 -4.798 -36.904 -2.330 1.00 2.87 N ATOM 2158 CA SER A 140 -3.692 -36.009 -2.056 1.00 2.96 C ATOM 2159 C SER A 140 -4.152 -34.894 -1.129 1.00 2.98 C ATOM 2160 O SER A 140 -5.174 -34.254 -1.376 1.00 3.09 O ATOM 2161 CB SER A 140 -3.140 -35.423 -3.362 1.00 3.30 C ATOM 2162 OG SER A 140 -1.970 -34.648 -3.135 1.00 3.47 O ATOM 0 H SER A 140 -5.628 -36.445 -2.705 1.00 2.87 H new ATOM 0 HA SER A 140 -2.895 -36.571 -1.569 1.00 2.96 H new ATOM 0 HB2 SER A 140 -2.912 -36.232 -4.057 1.00 3.30 H new ATOM 0 HB3 SER A 140 -3.902 -34.803 -3.834 1.00 3.30 H new ATOM 0 HG SER A 140 -1.460 -35.036 -2.394 1.00 3.47 H new ATOM 2168 N PHE A 141 -3.406 -34.679 -0.059 1.00 2.94 N ATOM 2169 CA PHE A 141 -3.724 -33.635 0.900 1.00 3.02 C ATOM 2170 C PHE A 141 -2.453 -32.899 1.291 1.00 3.30 C ATOM 2171 O PHE A 141 -1.358 -33.451 1.202 1.00 3.35 O ATOM 2172 CB PHE A 141 -4.417 -34.219 2.142 1.00 2.69 C ATOM 2173 CG PHE A 141 -3.616 -35.262 2.880 1.00 2.50 C ATOM 2174 CD1 PHE A 141 -3.039 -34.972 4.110 1.00 2.60 C ATOM 2175 CD2 PHE A 141 -3.448 -36.535 2.355 1.00 2.33 C ATOM 2176 CE1 PHE A 141 -2.314 -35.930 4.795 1.00 2.53 C ATOM 2177 CE2 PHE A 141 -2.723 -37.493 3.035 1.00 2.28 C ATOM 2178 CZ PHE A 141 -2.156 -37.190 4.256 1.00 2.38 C ATOM 0 H PHE A 141 -2.570 -35.218 0.168 1.00 2.94 H new ATOM 0 HA PHE A 141 -4.416 -32.932 0.436 1.00 3.02 H new ATOM 0 HB2 PHE A 141 -4.648 -33.405 2.829 1.00 2.69 H new ATOM 0 HB3 PHE A 141 -5.367 -34.658 1.838 1.00 2.69 H new ATOM 0 HD1 PHE A 141 -3.158 -33.987 4.536 1.00 2.60 H new ATOM 0 HD2 PHE A 141 -3.891 -36.780 1.401 1.00 2.33 H new ATOM 0 HE1 PHE A 141 -1.872 -35.692 5.751 1.00 2.53 H new ATOM 0 HE2 PHE A 141 -2.600 -38.479 2.612 1.00 2.28 H new ATOM 0 HZ PHE A 141 -1.589 -37.939 4.789 1.00 2.38 H new ATOM 2188 N GLN A 142 -2.593 -31.653 1.714 1.00 3.55 N ATOM 2189 CA GLN A 142 -1.445 -30.847 2.085 1.00 3.88 C ATOM 2190 C GLN A 142 -1.484 -30.572 3.578 1.00 3.84 C ATOM 2191 O GLN A 142 -2.402 -29.917 4.074 1.00 3.78 O ATOM 2192 CB GLN A 142 -1.438 -29.541 1.286 1.00 4.29 C ATOM 2193 CG GLN A 142 -0.078 -28.870 1.199 1.00 4.35 C ATOM 2194 CD GLN A 142 1.000 -29.798 0.688 1.00 4.71 C ATOM 2195 OE1 GLN A 142 1.200 -29.930 -0.520 1.00 5.34 O ATOM 2196 NE2 GLN A 142 1.728 -30.416 1.605 1.00 4.77 N ATOM 0 H GLN A 142 -3.491 -31.179 1.808 1.00 3.55 H new ATOM 0 HA GLN A 142 -0.527 -31.388 1.853 1.00 3.88 H new ATOM 0 HB2 GLN A 142 -1.795 -29.744 0.276 1.00 4.29 H new ATOM 0 HB3 GLN A 142 -2.145 -28.847 1.741 1.00 4.29 H new ATOM 0 HG2 GLN A 142 -0.147 -28.003 0.542 1.00 4.35 H new ATOM 0 HG3 GLN A 142 0.204 -28.501 2.185 1.00 4.35 H new ATOM 0 HE21 GLN A 142 1.526 -30.277 2.595 1.00 4.77 H new ATOM 0 HE22 GLN A 142 2.491 -31.031 1.321 1.00 4.77 H new ATOM 2205 N ILE A 143 -0.504 -31.104 4.289 1.00 3.92 N ATOM 2206 CA ILE A 143 -0.478 -31.027 5.740 1.00 3.93 C ATOM 2207 C ILE A 143 -0.007 -29.652 6.215 1.00 4.34 C ATOM 2208 O ILE A 143 1.163 -29.304 6.074 1.00 4.66 O ATOM 2209 CB ILE A 143 0.439 -32.116 6.344 1.00 3.86 C ATOM 2210 CG1 ILE A 143 0.016 -33.502 5.850 1.00 3.49 C ATOM 2211 CG2 ILE A 143 0.395 -32.055 7.868 1.00 3.95 C ATOM 2212 CD1 ILE A 143 0.942 -34.618 6.286 1.00 3.49 C ATOM 0 H ILE A 143 0.290 -31.598 3.881 1.00 3.92 H new ATOM 0 HA ILE A 143 -1.499 -31.191 6.084 1.00 3.93 H new ATOM 0 HB ILE A 143 1.463 -31.932 6.018 1.00 3.86 H new ATOM 0 HG12 ILE A 143 -0.990 -33.715 6.213 1.00 3.49 H new ATOM 0 HG13 ILE A 143 -0.034 -33.489 4.761 1.00 3.49 H new ATOM 0 HG21 ILE A 143 1.044 -32.826 8.282 1.00 3.95 H new ATOM 0 HG22 ILE A 143 0.736 -31.075 8.203 1.00 3.95 H new ATOM 0 HG23 ILE A 143 -0.627 -32.220 8.209 1.00 3.95 H new ATOM 0 HD11 ILE A 143 0.575 -35.568 5.897 1.00 3.49 H new ATOM 0 HD12 ILE A 143 1.944 -34.431 5.901 1.00 3.49 H new ATOM 0 HD13 ILE A 143 0.974 -34.660 7.375 1.00 3.49 H new ATOM 2224 N ALA A 144 -0.935 -28.869 6.749 1.00 4.36 N ATOM 2225 CA ALA A 144 -0.603 -27.602 7.382 1.00 4.74 C ATOM 2226 C ALA A 144 -0.585 -27.770 8.893 1.00 4.75 C ATOM 2227 O ALA A 144 -1.624 -27.975 9.518 1.00 4.59 O ATOM 2228 CB ALA A 144 -1.590 -26.526 6.966 1.00 4.85 C ATOM 0 H ALA A 144 -1.930 -29.092 6.755 1.00 4.36 H new ATOM 0 HA ALA A 144 0.389 -27.290 7.056 1.00 4.74 H new ATOM 0 HB1 ALA A 144 -1.327 -25.585 7.449 1.00 4.85 H new ATOM 0 HB2 ALA A 144 -1.557 -26.401 5.884 1.00 4.85 H new ATOM 0 HB3 ALA A 144 -2.596 -26.819 7.267 1.00 4.85 H new ATOM 2234 N THR A 145 0.603 -27.695 9.476 1.00 4.99 N ATOM 2235 CA THR A 145 0.763 -27.921 10.904 1.00 5.06 C ATOM 2236 C THR A 145 0.516 -26.639 11.695 1.00 5.37 C ATOM 2237 O THR A 145 1.311 -25.698 11.637 1.00 5.68 O ATOM 2238 CB THR A 145 2.169 -28.459 11.228 1.00 5.22 C ATOM 2239 OG1 THR A 145 2.501 -29.514 10.315 1.00 5.02 O ATOM 2240 CG2 THR A 145 2.239 -28.991 12.652 1.00 5.31 C ATOM 0 H THR A 145 1.469 -27.480 8.982 1.00 4.99 H new ATOM 0 HA THR A 145 0.023 -28.666 11.196 1.00 5.06 H new ATOM 0 HB THR A 145 2.879 -27.638 11.129 1.00 5.22 H new ATOM 0 HG1 THR A 145 3.397 -29.855 10.521 1.00 5.02 H new ATOM 0 HG21 THR A 145 3.243 -29.364 12.852 1.00 5.31 H new ATOM 0 HG22 THR A 145 2.004 -28.189 13.352 1.00 5.31 H new ATOM 0 HG23 THR A 145 1.520 -29.801 12.773 1.00 5.31 H new ATOM 2248 N ASN A 146 -0.604 -26.603 12.408 1.00 5.32 N ATOM 2249 CA ASN A 146 -0.925 -25.489 13.292 1.00 5.64 C ATOM 2250 C ASN A 146 0.097 -25.422 14.427 1.00 5.87 C ATOM 2251 O ASN A 146 0.576 -26.456 14.889 1.00 5.76 O ATOM 2252 CB ASN A 146 -2.342 -25.659 13.853 1.00 5.52 C ATOM 2253 CG ASN A 146 -2.763 -24.521 14.764 1.00 5.73 C ATOM 2254 OD1 ASN A 146 -2.507 -24.548 15.968 1.00 6.25 O ATOM 2255 ND2 ASN A 146 -3.416 -23.518 14.197 1.00 5.63 N ATOM 0 H ASN A 146 -1.310 -27.339 12.390 1.00 5.32 H new ATOM 0 HA ASN A 146 -0.885 -24.557 12.729 1.00 5.64 H new ATOM 0 HB2 ASN A 146 -3.047 -25.734 13.025 1.00 5.52 H new ATOM 0 HB3 ASN A 146 -2.398 -26.597 14.405 1.00 5.52 H new ATOM 0 HD21 ASN A 146 -3.727 -22.728 14.762 1.00 5.63 H new ATOM 0 HD22 ASN A 146 -3.607 -23.536 13.195 1.00 5.63 H new ATOM 2262 N GLN A 147 0.416 -24.215 14.883 1.00 6.22 N ATOM 2263 CA GLN A 147 1.484 -24.021 15.866 1.00 6.51 C ATOM 2264 C GLN A 147 1.162 -24.662 17.217 1.00 6.43 C ATOM 2265 O GLN A 147 2.062 -24.889 18.025 1.00 6.68 O ATOM 2266 CB GLN A 147 1.813 -22.533 16.055 1.00 6.90 C ATOM 2267 CG GLN A 147 0.610 -21.639 16.333 1.00 7.35 C ATOM 2268 CD GLN A 147 -0.066 -21.163 15.063 1.00 7.89 C ATOM 2269 OE1 GLN A 147 -0.971 -21.811 14.543 1.00 7.90 O ATOM 2270 NE2 GLN A 147 0.376 -20.024 14.551 1.00 8.58 N ATOM 0 H GLN A 147 -0.048 -23.355 14.590 1.00 6.22 H new ATOM 0 HA GLN A 147 2.361 -24.526 15.461 1.00 6.51 H new ATOM 0 HB2 GLN A 147 2.519 -22.434 16.880 1.00 6.90 H new ATOM 0 HB3 GLN A 147 2.317 -22.171 15.159 1.00 6.90 H new ATOM 0 HG2 GLN A 147 -0.111 -22.185 16.942 1.00 7.35 H new ATOM 0 HG3 GLN A 147 0.930 -20.775 16.916 1.00 7.35 H new ATOM 0 HE21 GLN A 147 1.130 -19.516 15.013 1.00 8.58 H new ATOM 0 HE22 GLN A 147 -0.037 -19.655 13.695 1.00 8.58 H new ATOM 2279 N ARG A 148 -0.107 -24.966 17.465 1.00 6.14 N ATOM 2280 CA ARG A 148 -0.484 -25.633 18.704 1.00 6.07 C ATOM 2281 C ARG A 148 -0.338 -27.147 18.557 1.00 5.78 C ATOM 2282 O ARG A 148 -0.650 -27.907 19.475 1.00 5.77 O ATOM 2283 CB ARG A 148 -1.913 -25.270 19.119 1.00 5.97 C ATOM 2284 CG ARG A 148 -2.164 -23.771 19.157 1.00 6.25 C ATOM 2285 CD ARG A 148 -3.171 -23.391 20.232 1.00 6.38 C ATOM 2286 NE ARG A 148 -4.416 -24.158 20.141 1.00 6.81 N ATOM 2287 CZ ARG A 148 -5.547 -23.809 20.759 1.00 7.23 C ATOM 2288 NH1 ARG A 148 -5.617 -22.661 21.422 1.00 7.28 N ATOM 2289 NH2 ARG A 148 -6.615 -24.594 20.695 1.00 7.86 N ATOM 0 H ARG A 148 -0.882 -24.764 16.834 1.00 6.14 H new ATOM 0 HA ARG A 148 0.189 -25.289 19.490 1.00 6.07 H new ATOM 0 HB2 ARG A 148 -2.614 -25.732 18.424 1.00 5.97 H new ATOM 0 HB3 ARG A 148 -2.116 -25.691 20.104 1.00 5.97 H new ATOM 0 HG2 ARG A 148 -1.224 -23.250 19.340 1.00 6.25 H new ATOM 0 HG3 ARG A 148 -2.528 -23.439 18.185 1.00 6.25 H new ATOM 0 HD2 ARG A 148 -2.724 -23.548 21.214 1.00 6.38 H new ATOM 0 HD3 ARG A 148 -3.398 -22.328 20.151 1.00 6.38 H new ATOM 0 HE ARG A 148 -4.419 -25.006 19.574 1.00 6.81 H new ATOM 0 HH11 ARG A 148 -4.806 -22.044 21.460 1.00 7.28 H new ATOM 0 HH12 ARG A 148 -6.482 -22.396 21.893 1.00 7.28 H new ATOM 0 HH21 ARG A 148 -6.574 -25.469 20.172 1.00 7.86 H new ATOM 0 HH22 ARG A 148 -7.476 -24.323 21.169 1.00 7.86 H new ATOM 2303 N GLY A 149 0.131 -27.570 17.386 1.00 5.59 N ATOM 2304 CA GLY A 149 0.443 -28.969 17.144 1.00 5.36 C ATOM 2305 C GLY A 149 -0.790 -29.828 16.940 1.00 5.00 C ATOM 2306 O GLY A 149 -0.725 -31.055 17.030 1.00 4.82 O ATOM 0 H GLY A 149 0.303 -26.958 16.589 1.00 5.59 H new ATOM 0 HA2 GLY A 149 1.081 -29.045 16.264 1.00 5.36 H new ATOM 0 HA3 GLY A 149 1.014 -29.358 17.987 1.00 5.36 H new ATOM 2310 N ASN A 150 -1.913 -29.186 16.665 1.00 4.94 N ATOM 2311 CA ASN A 150 -3.157 -29.896 16.409 1.00 4.64 C ATOM 2312 C ASN A 150 -3.648 -29.563 15.007 1.00 4.47 C ATOM 2313 O ASN A 150 -3.995 -28.418 14.717 1.00 4.72 O ATOM 2314 CB ASN A 150 -4.214 -29.523 17.456 1.00 4.79 C ATOM 2315 CG ASN A 150 -5.504 -30.312 17.298 1.00 4.88 C ATOM 2316 OD1 ASN A 150 -5.643 -31.409 17.842 1.00 5.18 O ATOM 2317 ND2 ASN A 150 -6.469 -29.747 16.588 1.00 5.01 N ATOM 0 H ASN A 150 -1.990 -28.170 16.613 1.00 4.94 H new ATOM 0 HA ASN A 150 -2.980 -30.969 16.479 1.00 4.64 H new ATOM 0 HB2 ASN A 150 -3.808 -29.695 18.453 1.00 4.79 H new ATOM 0 HB3 ASN A 150 -4.433 -28.458 17.381 1.00 4.79 H new ATOM 0 HD21 ASN A 150 -7.365 -30.222 16.477 1.00 5.01 H new ATOM 0 HD22 ASN A 150 -6.316 -28.837 16.153 1.00 5.01 H new ATOM 2324 N LEU A 151 -3.641 -30.558 14.133 1.00 4.10 N ATOM 2325 CA LEU A 151 -3.989 -30.351 12.737 1.00 3.95 C ATOM 2326 C LEU A 151 -4.730 -31.560 12.171 1.00 3.50 C ATOM 2327 O LEU A 151 -4.981 -32.534 12.881 1.00 3.35 O ATOM 2328 CB LEU A 151 -2.736 -30.023 11.878 1.00 4.10 C ATOM 2329 CG LEU A 151 -1.489 -30.939 11.988 1.00 4.04 C ATOM 2330 CD1 LEU A 151 -0.805 -30.808 13.336 1.00 4.28 C ATOM 2331 CD2 LEU A 151 -1.822 -32.397 11.715 1.00 3.76 C ATOM 0 H LEU A 151 -3.397 -31.520 14.368 1.00 4.10 H new ATOM 0 HA LEU A 151 -4.656 -29.490 12.693 1.00 3.95 H new ATOM 0 HB2 LEU A 151 -3.046 -30.014 10.833 1.00 4.10 H new ATOM 0 HB3 LEU A 151 -2.423 -29.009 12.127 1.00 4.10 H new ATOM 0 HG LEU A 151 -0.798 -30.598 11.217 1.00 4.04 H new ATOM 0 HD11 LEU A 151 0.063 -31.467 13.369 1.00 4.28 H new ATOM 0 HD12 LEU A 151 -0.484 -29.777 13.482 1.00 4.28 H new ATOM 0 HD13 LEU A 151 -1.502 -31.086 14.126 1.00 4.28 H new ATOM 0 HD21 LEU A 151 -0.918 -32.999 11.804 1.00 3.76 H new ATOM 0 HD22 LEU A 151 -2.561 -32.743 12.438 1.00 3.76 H new ATOM 0 HD23 LEU A 151 -2.226 -32.495 10.708 1.00 3.76 H new ATOM 2343 N GLY A 152 -5.076 -31.474 10.895 1.00 3.36 N ATOM 2344 CA GLY A 152 -5.715 -32.575 10.207 1.00 2.97 C ATOM 2345 C GLY A 152 -5.280 -32.637 8.758 1.00 2.89 C ATOM 2346 O GLY A 152 -4.189 -32.181 8.419 1.00 3.11 O ATOM 0 H GLY A 152 -4.922 -30.648 10.317 1.00 3.36 H new ATOM 0 HA2 GLY A 152 -5.467 -33.512 10.705 1.00 2.97 H new ATOM 0 HA3 GLY A 152 -6.798 -32.462 10.261 1.00 2.97 H new ATOM 2350 N ALA A 153 -6.119 -33.184 7.899 1.00 2.69 N ATOM 2351 CA ALA A 153 -5.808 -33.235 6.481 1.00 2.66 C ATOM 2352 C ALA A 153 -6.525 -32.108 5.747 1.00 2.84 C ATOM 2353 O ALA A 153 -7.752 -32.042 5.748 1.00 2.75 O ATOM 2354 CB ALA A 153 -6.193 -34.586 5.900 1.00 2.30 C ATOM 0 H ALA A 153 -7.016 -33.597 8.155 1.00 2.69 H new ATOM 0 HA ALA A 153 -4.734 -33.104 6.352 1.00 2.66 H new ATOM 0 HB1 ALA A 153 -5.953 -34.607 4.837 1.00 2.30 H new ATOM 0 HB2 ALA A 153 -5.640 -35.373 6.412 1.00 2.30 H new ATOM 0 HB3 ALA A 153 -7.263 -34.748 6.034 1.00 2.30 H new ATOM 2360 N CYS A 154 -5.760 -31.216 5.140 1.00 3.18 N ATOM 2361 CA CYS A 154 -6.338 -30.065 4.468 1.00 3.47 C ATOM 2362 C CYS A 154 -6.047 -30.114 2.970 1.00 3.64 C ATOM 2363 O CYS A 154 -5.126 -30.812 2.534 1.00 3.61 O ATOM 2364 CB CYS A 154 -5.780 -28.775 5.077 1.00 3.84 C ATOM 2365 SG CYS A 154 -6.606 -27.262 4.523 1.00 4.34 S ATOM 0 H CYS A 154 -4.742 -31.266 5.099 1.00 3.18 H new ATOM 0 HA CYS A 154 -7.419 -30.085 4.605 1.00 3.47 H new ATOM 0 HB2 CYS A 154 -5.856 -28.838 6.162 1.00 3.84 H new ATOM 0 HB3 CYS A 154 -4.719 -28.704 4.836 1.00 3.84 H new ATOM 0 HG CYS A 154 -6.090 -26.875 3.394 1.00 4.34 H new ATOM 2371 N HIS A 155 -6.850 -29.380 2.194 1.00 3.88 N ATOM 2372 CA HIS A 155 -6.696 -29.298 0.736 1.00 4.13 C ATOM 2373 C HIS A 155 -6.845 -30.669 0.089 1.00 3.76 C ATOM 2374 O HIS A 155 -6.226 -30.951 -0.942 1.00 3.84 O ATOM 2375 CB HIS A 155 -5.342 -28.680 0.358 1.00 4.61 C ATOM 2376 CG HIS A 155 -5.204 -27.247 0.783 1.00 4.96 C ATOM 2377 ND1 HIS A 155 -4.575 -26.710 1.858 1.00 5.41 N flip ATOM 2378 CD2 HIS A 155 -5.753 -26.185 0.097 1.00 5.05 C flip ATOM 2379 CE1 HIS A 155 -4.735 -25.329 1.839 1.00 5.75 C flip ATOM 2380 NE2 HIS A 155 -5.449 -25.064 0.762 1.00 5.52 N flip ATOM 0 H HIS A 155 -7.625 -28.826 2.557 1.00 3.88 H new ATOM 0 HA HIS A 155 -7.489 -28.652 0.360 1.00 4.13 H new ATOM 0 HB2 HIS A 155 -4.543 -29.265 0.814 1.00 4.61 H new ATOM 0 HB3 HIS A 155 -5.209 -28.746 -0.722 1.00 4.61 H new ATOM 0 HD2 HIS A 155 -6.327 -26.247 -0.816 1.00 5.05 H new ATOM 0 HE1 HIS A 155 -4.353 -24.619 2.558 1.00 5.75 H new ATOM 0 HE2 HIS A 155 -5.732 -24.127 0.474 1.00 5.52 H new ATOM 2388 N ILE A 156 -7.701 -31.494 0.677 1.00 3.42 N ATOM 2389 CA ILE A 156 -7.890 -32.860 0.221 1.00 3.11 C ATOM 2390 C ILE A 156 -8.476 -32.888 -1.185 1.00 3.37 C ATOM 2391 O ILE A 156 -9.513 -32.278 -1.453 1.00 3.55 O ATOM 2392 CB ILE A 156 -8.818 -33.639 1.168 1.00 2.73 C ATOM 2393 CG1 ILE A 156 -8.305 -33.537 2.599 1.00 2.54 C ATOM 2394 CG2 ILE A 156 -8.918 -35.098 0.742 1.00 2.51 C ATOM 2395 CD1 ILE A 156 -9.214 -34.187 3.614 1.00 2.21 C ATOM 0 H ILE A 156 -8.279 -31.236 1.477 1.00 3.42 H new ATOM 0 HA ILE A 156 -6.909 -33.335 0.213 1.00 3.11 H new ATOM 0 HB ILE A 156 -9.815 -33.201 1.118 1.00 2.73 H new ATOM 0 HG12 ILE A 156 -7.320 -34.000 2.657 1.00 2.54 H new ATOM 0 HG13 ILE A 156 -8.179 -32.485 2.857 1.00 2.54 H new ATOM 0 HG21 ILE A 156 -9.579 -35.632 1.425 1.00 2.51 H new ATOM 0 HG22 ILE A 156 -9.319 -35.155 -0.270 1.00 2.51 H new ATOM 0 HG23 ILE A 156 -7.928 -35.553 0.766 1.00 2.51 H new ATOM 0 HD11 ILE A 156 -8.786 -34.076 4.610 1.00 2.21 H new ATOM 0 HD12 ILE A 156 -10.193 -33.709 3.584 1.00 2.21 H new ATOM 0 HD13 ILE A 156 -9.320 -35.247 3.381 1.00 2.21 H new ATOM 2407 N ARG A 157 -7.797 -33.588 -2.075 1.00 3.45 N ATOM 2408 CA ARG A 157 -8.245 -33.742 -3.446 1.00 3.75 C ATOM 2409 C ARG A 157 -7.983 -35.162 -3.924 1.00 3.57 C ATOM 2410 O ARG A 157 -7.156 -35.877 -3.349 1.00 3.35 O ATOM 2411 CB ARG A 157 -7.533 -32.732 -4.348 1.00 4.11 C ATOM 2412 CG ARG A 157 -6.017 -32.890 -4.377 1.00 4.40 C ATOM 2413 CD ARG A 157 -5.334 -31.602 -4.818 1.00 4.77 C ATOM 2414 NE ARG A 157 -5.619 -30.511 -3.890 1.00 5.08 N ATOM 2415 CZ ARG A 157 -5.498 -29.219 -4.189 1.00 5.45 C ATOM 2416 NH1 ARG A 157 -5.040 -28.839 -5.381 1.00 5.58 N ATOM 2417 NH2 ARG A 157 -5.833 -28.306 -3.291 1.00 5.96 N ATOM 0 H ARG A 157 -6.920 -34.065 -1.868 1.00 3.45 H new ATOM 0 HA ARG A 157 -9.317 -33.553 -3.493 1.00 3.75 H new ATOM 0 HB2 ARG A 157 -7.918 -32.831 -5.363 1.00 4.11 H new ATOM 0 HB3 ARG A 157 -7.777 -31.724 -4.012 1.00 4.11 H new ATOM 0 HG2 ARG A 157 -5.660 -33.173 -3.387 1.00 4.40 H new ATOM 0 HG3 ARG A 157 -5.747 -33.698 -5.056 1.00 4.40 H new ATOM 0 HD2 ARG A 157 -4.257 -31.760 -4.878 1.00 4.77 H new ATOM 0 HD3 ARG A 157 -5.673 -31.331 -5.818 1.00 4.77 H new ATOM 0 HE ARG A 157 -5.932 -30.755 -2.950 1.00 5.08 H new ATOM 0 HH11 ARG A 157 -4.778 -29.540 -6.074 1.00 5.58 H new ATOM 0 HH12 ARG A 157 -4.951 -27.847 -5.601 1.00 5.58 H new ATOM 0 HH21 ARG A 157 -6.181 -28.594 -2.377 1.00 5.96 H new ATOM 0 HH22 ARG A 157 -5.743 -27.315 -3.513 1.00 5.96 H new ATOM 2431 N LEU A 158 -8.684 -35.571 -4.967 1.00 3.76 N ATOM 2432 CA LEU A 158 -8.497 -36.900 -5.522 1.00 3.74 C ATOM 2433 C LEU A 158 -7.227 -36.920 -6.362 1.00 3.99 C ATOM 2434 O LEU A 158 -7.097 -36.174 -7.334 1.00 4.24 O ATOM 2435 CB LEU A 158 -9.710 -37.315 -6.364 1.00 3.89 C ATOM 2436 CG LEU A 158 -9.691 -38.762 -6.869 1.00 3.97 C ATOM 2437 CD1 LEU A 158 -9.681 -39.740 -5.701 1.00 3.82 C ATOM 2438 CD2 LEU A 158 -10.889 -39.019 -7.772 1.00 4.34 C ATOM 0 H LEU A 158 -9.385 -35.005 -5.445 1.00 3.76 H new ATOM 0 HA LEU A 158 -8.400 -37.617 -4.707 1.00 3.74 H new ATOM 0 HB2 LEU A 158 -10.612 -37.166 -5.770 1.00 3.89 H new ATOM 0 HB3 LEU A 158 -9.781 -36.648 -7.223 1.00 3.89 H new ATOM 0 HG LEU A 158 -8.780 -38.915 -7.447 1.00 3.97 H new ATOM 0 HD11 LEU A 158 -9.668 -40.761 -6.082 1.00 3.82 H new ATOM 0 HD12 LEU A 158 -8.794 -39.569 -5.091 1.00 3.82 H new ATOM 0 HD13 LEU A 158 -10.574 -39.591 -5.094 1.00 3.82 H new ATOM 0 HD21 LEU A 158 -10.864 -40.050 -8.124 1.00 4.34 H new ATOM 0 HD22 LEU A 158 -11.809 -38.848 -7.213 1.00 4.34 H new ATOM 0 HD23 LEU A 158 -10.853 -38.343 -8.626 1.00 4.34 H new ATOM 2450 N GLU A 159 -6.285 -37.759 -5.969 1.00 3.97 N ATOM 2451 CA GLU A 159 -4.991 -37.808 -6.621 1.00 4.24 C ATOM 2452 C GLU A 159 -5.070 -38.705 -7.846 1.00 4.37 C ATOM 2453 O GLU A 159 -4.637 -38.329 -8.935 1.00 4.68 O ATOM 2454 CB GLU A 159 -3.935 -38.310 -5.631 1.00 4.22 C ATOM 2455 CG GLU A 159 -2.498 -38.083 -6.072 1.00 4.08 C ATOM 2456 CD GLU A 159 -1.976 -39.171 -6.992 1.00 4.54 C ATOM 2457 OE1 GLU A 159 -1.498 -38.837 -8.097 1.00 4.83 O ATOM 2458 OE2 GLU A 159 -2.072 -40.359 -6.625 1.00 4.97 O ATOM 0 H GLU A 159 -6.394 -38.418 -5.198 1.00 3.97 H new ATOM 0 HA GLU A 159 -4.703 -36.809 -6.949 1.00 4.24 H new ATOM 0 HB2 GLU A 159 -4.090 -37.815 -4.672 1.00 4.22 H new ATOM 0 HB3 GLU A 159 -4.087 -39.377 -5.467 1.00 4.22 H new ATOM 0 HG2 GLU A 159 -2.429 -37.122 -6.581 1.00 4.08 H new ATOM 0 HG3 GLU A 159 -1.859 -38.024 -5.191 1.00 4.08 H new ATOM 2465 N ASN A 160 -5.652 -39.879 -7.665 1.00 4.20 N ATOM 2466 CA ASN A 160 -5.803 -40.829 -8.753 1.00 4.41 C ATOM 2467 C ASN A 160 -6.861 -41.866 -8.381 1.00 4.43 C ATOM 2468 O ASN A 160 -6.672 -42.633 -7.439 1.00 4.21 O ATOM 2469 CB ASN A 160 -4.462 -41.511 -9.055 1.00 4.34 C ATOM 2470 CG ASN A 160 -4.452 -42.214 -10.396 1.00 4.85 C ATOM 2471 OD1 ASN A 160 -4.790 -43.390 -10.501 1.00 5.37 O ATOM 2472 ND2 ASN A 160 -4.059 -41.497 -11.439 1.00 5.08 N ATOM 0 H ASN A 160 -6.028 -40.197 -6.772 1.00 4.20 H new ATOM 0 HA ASN A 160 -6.125 -40.300 -9.650 1.00 4.41 H new ATOM 0 HB2 ASN A 160 -3.667 -40.765 -9.035 1.00 4.34 H new ATOM 0 HB3 ASN A 160 -4.242 -42.233 -8.269 1.00 4.34 H new ATOM 0 HD21 ASN A 160 -4.030 -41.920 -12.367 1.00 5.08 H new ATOM 0 HD22 ASN A 160 -3.785 -40.522 -11.314 1.00 5.08 H new ATOM 2479 N PRO A 161 -7.998 -41.884 -9.092 1.00 4.76 N ATOM 2480 CA PRO A 161 -9.095 -42.809 -8.786 1.00 4.88 C ATOM 2481 C PRO A 161 -8.724 -44.260 -9.053 1.00 5.13 C ATOM 2482 O PRO A 161 -7.896 -44.554 -9.919 1.00 5.31 O ATOM 2483 CB PRO A 161 -10.215 -42.373 -9.728 1.00 5.22 C ATOM 2484 CG PRO A 161 -9.518 -41.682 -10.846 1.00 5.44 C ATOM 2485 CD PRO A 161 -8.312 -41.016 -10.237 1.00 5.09 C ATOM 0 HA PRO A 161 -9.367 -42.769 -7.731 1.00 4.88 H new ATOM 0 HB2 PRO A 161 -10.787 -43.229 -10.086 1.00 5.22 H new ATOM 0 HB3 PRO A 161 -10.918 -41.707 -9.227 1.00 5.22 H new ATOM 0 HG2 PRO A 161 -9.223 -42.391 -11.619 1.00 5.44 H new ATOM 0 HG3 PRO A 161 -10.171 -40.949 -11.319 1.00 5.44 H new ATOM 0 HD2 PRO A 161 -7.482 -40.961 -10.942 1.00 5.09 H new ATOM 0 HD3 PRO A 161 -8.530 -39.996 -9.922 1.00 5.09 H new ATOM 2493 N ALA A 162 -9.350 -45.157 -8.322 1.00 5.21 N ATOM 2494 CA ALA A 162 -9.063 -46.571 -8.443 1.00 5.55 C ATOM 2495 C ALA A 162 -10.314 -47.344 -8.815 1.00 6.04 C ATOM 2496 O ALA A 162 -11.412 -47.017 -8.372 1.00 6.10 O ATOM 2497 CB ALA A 162 -8.476 -47.097 -7.147 1.00 5.46 C ATOM 0 H ALA A 162 -10.066 -44.930 -7.632 1.00 5.21 H new ATOM 0 HA ALA A 162 -8.332 -46.709 -9.239 1.00 5.55 H new ATOM 0 HB1 ALA A 162 -8.264 -48.161 -7.249 1.00 5.46 H new ATOM 0 HB2 ALA A 162 -7.553 -46.563 -6.923 1.00 5.46 H new ATOM 0 HB3 ALA A 162 -9.189 -46.945 -6.337 1.00 5.46 H new