USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 694 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 134 GLN :FLIP amide:sc= -1.14 F(o=-4.1!,f=-2.3) USER MOD Set 1.2: A 137 MET CE :methyl 174:sc= -1.14 (180deg=-1.23) USER MOD Set 2.1: A 92 GLN : amide:sc= 0 X(o=-0.44,f=-0.44) USER MOD Set 2.2: A 129 SER OG : rot 180:sc= 0 USER MOD Set 2.3: A 132 GLN : amide:sc= -0.443 K(o=-0.44,f=-1.3) USER MOD Set 3.1: A 121 ASN :FLIP amide:sc= -6.34! C(o=-10!,f=-5.1!) USER MOD Set 3.2: A 140 THR OG1 : rot 154:sc= 1.23 USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 LYS NZ :NH3+ -129:sc= -0.13 (180deg=-0.856) USER MOD Single : A 78 THR OG1 : rot 25:sc= 0.32 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0649) USER MOD Single : A 89 ASN : amide:sc= -1.45 K(o=-1.5,f=-6.4!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 82:sc= -2.07 USER MOD Single : A 95 THR OG1 : rot -62:sc= 0.495 USER MOD Single : A 101 HIS : no HE2:sc= -0.97 K(o=-0.97,f=-3.4!) USER MOD Single : A 104 MET CE :methyl 179:sc= 0 (180deg=-0.00533) USER MOD Single : A 106 HIS : no HD1:sc= -1.07 X(o=-1.1,f=-1.2) USER MOD Single : A 108 GLN : amide:sc= -0.454 X(o=-0.45,f=-0.69) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 HIS : no HD1:sc= -0.294 X(o=-0.29,f=-0.084) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.0067) USER MOD Single : A 126 THR OG1 : rot -85:sc= 0.294 USER MOD Single : A 127 ASN :FLIP amide:sc= -2.56 F(o=-3.4,f=-2.6) USER MOD Single : A 128 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.1) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ -112:sc= -0.674 (180deg=-4.2!) USER MOD Single : A 143 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 SER OG : rot -170:sc= -0.896 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN :FLIP amide:sc= -3.36! C(o=-4.1!,f=-3.4!) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 153 GLN : amide:sc= -0.0453 K(o=-0.045,f=-0.8) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 69 13.832 -0.884 6.094 1.00 0.00 N ATOM 2 CA VAL A 69 12.516 -0.605 5.461 1.00 0.00 C ATOM 3 C VAL A 69 11.391 -1.339 6.188 1.00 0.00 C ATOM 4 O VAL A 69 11.596 -1.885 7.272 1.00 0.00 O ATOM 5 CB VAL A 69 12.518 -1.010 3.972 1.00 0.00 C ATOM 6 CG1 VAL A 69 13.665 -0.332 3.239 1.00 0.00 C ATOM 7 CG2 VAL A 69 12.600 -2.524 3.820 1.00 0.00 C ATOM 0 HA VAL A 69 12.343 0.469 5.534 1.00 0.00 H new ATOM 0 HB VAL A 69 11.580 -0.678 3.527 1.00 0.00 H new ATOM 0 HG11 VAL A 69 13.652 -0.628 2.190 1.00 0.00 H new ATOM 0 HG12 VAL A 69 13.554 0.750 3.312 1.00 0.00 H new ATOM 0 HG13 VAL A 69 14.612 -0.631 3.689 1.00 0.00 H new ATOM 0 HG21 VAL A 69 12.600 -2.784 2.761 1.00 0.00 H new ATOM 0 HG22 VAL A 69 13.518 -2.887 4.283 1.00 0.00 H new ATOM 0 HG23 VAL A 69 11.741 -2.986 4.307 1.00 0.00 H new ATOM 17 N ARG A 70 10.204 -1.349 5.588 1.00 0.00 N ATOM 18 CA ARG A 70 9.053 -2.015 6.188 1.00 0.00 C ATOM 19 C ARG A 70 8.194 -2.684 5.121 1.00 0.00 C ATOM 20 O ARG A 70 7.673 -2.019 4.228 1.00 0.00 O ATOM 21 CB ARG A 70 8.211 -1.009 6.978 1.00 0.00 C ATOM 22 CG ARG A 70 8.090 -1.342 8.456 1.00 0.00 C ATOM 23 CD ARG A 70 7.707 -2.799 8.674 1.00 0.00 C ATOM 24 NE ARG A 70 7.201 -3.036 10.024 1.00 0.00 N ATOM 25 CZ ARG A 70 7.981 -3.160 11.096 1.00 0.00 C ATOM 26 NH1 ARG A 70 9.300 -3.071 10.980 1.00 0.00 N ATOM 27 NH2 ARG A 70 7.440 -3.375 12.288 1.00 0.00 N ATOM 0 H ARG A 70 10.015 -0.905 4.690 1.00 0.00 H new ATOM 0 HA ARG A 70 9.423 -2.784 6.866 1.00 0.00 H new ATOM 0 HB2 ARG A 70 8.652 -0.018 6.873 1.00 0.00 H new ATOM 0 HB3 ARG A 70 7.213 -0.962 6.542 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.037 -1.136 8.954 1.00 0.00 H new ATOM 0 HG3 ARG A 70 7.341 -0.696 8.915 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.948 -3.087 7.947 1.00 0.00 H new ATOM 0 HD3 ARG A 70 8.576 -3.433 8.496 1.00 0.00 H new ATOM 0 HE ARG A 70 6.192 -3.111 10.153 1.00 0.00 H new ATOM 0 HH11 ARG A 70 9.722 -2.907 10.066 1.00 0.00 H new ATOM 0 HH12 ARG A 70 9.892 -3.167 11.805 1.00 0.00 H new ATOM 0 HH21 ARG A 70 6.427 -3.445 12.383 1.00 0.00 H new ATOM 0 HH22 ARG A 70 8.037 -3.470 13.109 1.00 0.00 H new ATOM 41 N LEU A 71 8.040 -4.000 5.215 1.00 0.00 N ATOM 42 CA LEU A 71 7.235 -4.727 4.243 1.00 0.00 C ATOM 43 C LEU A 71 5.904 -5.158 4.852 1.00 0.00 C ATOM 44 O LEU A 71 5.825 -5.472 6.039 1.00 0.00 O ATOM 45 CB LEU A 71 8.010 -5.939 3.698 1.00 0.00 C ATOM 46 CG LEU A 71 7.646 -7.308 4.294 1.00 0.00 C ATOM 47 CD1 LEU A 71 7.131 -8.240 3.206 1.00 0.00 C ATOM 48 CD2 LEU A 71 8.845 -7.924 5.001 1.00 0.00 C ATOM 0 H LEU A 71 8.456 -4.578 5.945 1.00 0.00 H new ATOM 0 HA LEU A 71 7.019 -4.059 3.409 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.858 -5.985 2.620 1.00 0.00 H new ATOM 0 HB3 LEU A 71 9.074 -5.767 3.863 1.00 0.00 H new ATOM 0 HG LEU A 71 6.855 -7.163 5.030 1.00 0.00 H new ATOM 0 HD11 LEU A 71 6.877 -9.205 3.644 1.00 0.00 H new ATOM 0 HD12 LEU A 71 6.243 -7.806 2.745 1.00 0.00 H new ATOM 0 HD13 LEU A 71 7.903 -8.377 2.449 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.565 -8.892 5.415 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.659 -8.056 4.288 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.171 -7.265 5.806 1.00 0.00 H new ATOM 60 N ILE A 72 4.866 -5.177 4.027 1.00 0.00 N ATOM 61 CA ILE A 72 3.538 -5.580 4.475 1.00 0.00 C ATOM 62 C ILE A 72 2.963 -6.630 3.533 1.00 0.00 C ATOM 63 O ILE A 72 2.762 -6.366 2.349 1.00 0.00 O ATOM 64 CB ILE A 72 2.570 -4.381 4.551 1.00 0.00 C ATOM 65 CG1 ILE A 72 3.314 -3.115 4.986 1.00 0.00 C ATOM 66 CG2 ILE A 72 1.429 -4.684 5.512 1.00 0.00 C ATOM 67 CD1 ILE A 72 3.880 -3.197 6.386 1.00 0.00 C ATOM 0 H ILE A 72 4.917 -4.918 3.042 1.00 0.00 H new ATOM 0 HA ILE A 72 3.646 -5.996 5.477 1.00 0.00 H new ATOM 0 HB ILE A 72 2.153 -4.210 3.558 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.126 -2.922 4.285 1.00 0.00 H new ATOM 0 HG13 ILE A 72 2.634 -2.265 4.927 1.00 0.00 H new ATOM 0 HG21 ILE A 72 0.754 -3.830 5.556 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.883 -5.561 5.164 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.832 -4.879 6.506 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.393 -2.266 6.626 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.070 -3.359 7.097 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.586 -4.026 6.445 1.00 0.00 H new ATOM 79 N GLN A 73 2.707 -7.824 4.058 1.00 0.00 N ATOM 80 CA GLN A 73 2.169 -8.904 3.250 1.00 0.00 C ATOM 81 C GLN A 73 0.716 -9.169 3.601 1.00 0.00 C ATOM 82 O GLN A 73 0.398 -9.535 4.734 1.00 0.00 O ATOM 83 CB GLN A 73 2.994 -10.176 3.450 1.00 0.00 C ATOM 84 CG GLN A 73 4.215 -10.256 2.549 1.00 0.00 C ATOM 85 CD GLN A 73 4.332 -11.592 1.842 1.00 0.00 C ATOM 86 OE1 GLN A 73 4.919 -12.538 2.368 1.00 0.00 O ATOM 87 NE2 GLN A 73 3.772 -11.677 0.641 1.00 0.00 N ATOM 0 H GLN A 73 2.864 -8.064 5.037 1.00 0.00 H new ATOM 0 HA GLN A 73 2.223 -8.605 2.203 1.00 0.00 H new ATOM 0 HB2 GLN A 73 3.316 -10.231 4.490 1.00 0.00 H new ATOM 0 HB3 GLN A 73 2.360 -11.043 3.267 1.00 0.00 H new ATOM 0 HG2 GLN A 73 4.167 -9.459 1.807 1.00 0.00 H new ATOM 0 HG3 GLN A 73 5.112 -10.084 3.143 1.00 0.00 H new ATOM 0 HE21 GLN A 73 3.295 -10.868 0.242 1.00 0.00 H new ATOM 0 HE22 GLN A 73 3.819 -12.551 0.117 1.00 0.00 H new ATOM 96 N PHE A 74 -0.165 -8.997 2.625 1.00 0.00 N ATOM 97 CA PHE A 74 -1.582 -9.234 2.852 1.00 0.00 C ATOM 98 C PHE A 74 -2.225 -9.934 1.660 1.00 0.00 C ATOM 99 O PHE A 74 -1.558 -10.236 0.670 1.00 0.00 O ATOM 100 CB PHE A 74 -2.321 -7.924 3.150 1.00 0.00 C ATOM 101 CG PHE A 74 -2.114 -6.841 2.126 1.00 0.00 C ATOM 102 CD1 PHE A 74 -2.349 -7.073 0.777 1.00 0.00 C ATOM 103 CD2 PHE A 74 -1.693 -5.582 2.519 1.00 0.00 C ATOM 104 CE1 PHE A 74 -2.164 -6.070 -0.155 1.00 0.00 C ATOM 105 CE2 PHE A 74 -1.508 -4.576 1.591 1.00 0.00 C ATOM 106 CZ PHE A 74 -1.742 -4.820 0.252 1.00 0.00 C ATOM 0 H PHE A 74 0.073 -8.698 1.679 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.664 -9.886 3.721 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -3.388 -8.134 3.227 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -1.998 -7.553 4.123 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -2.680 -8.049 0.453 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -1.507 -5.384 3.564 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -2.349 -6.264 -1.201 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -1.180 -3.598 1.912 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.595 -4.035 -0.475 1.00 0.00 H new ATOM 116 N GLU A 75 -3.528 -10.179 1.761 1.00 0.00 N ATOM 117 CA GLU A 75 -4.272 -10.834 0.690 1.00 0.00 C ATOM 118 C GLU A 75 -5.240 -9.856 0.031 1.00 0.00 C ATOM 119 O GLU A 75 -6.109 -9.288 0.692 1.00 0.00 O ATOM 120 CB GLU A 75 -5.038 -12.041 1.235 1.00 0.00 C ATOM 121 CG GLU A 75 -5.858 -11.732 2.477 1.00 0.00 C ATOM 122 CD GLU A 75 -6.851 -12.829 2.808 1.00 0.00 C ATOM 123 OE1 GLU A 75 -7.242 -13.574 1.886 1.00 0.00 O ATOM 124 OE2 GLU A 75 -7.237 -12.943 3.991 1.00 0.00 O ATOM 0 H GLU A 75 -4.091 -9.933 2.575 1.00 0.00 H new ATOM 0 HA GLU A 75 -3.559 -11.177 -0.060 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -5.701 -12.421 0.458 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.329 -12.836 1.466 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.187 -11.587 3.324 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.394 -10.794 2.330 1.00 0.00 H new ATOM 131 N LYS A 76 -5.080 -9.662 -1.274 1.00 0.00 N ATOM 132 CA LYS A 76 -5.937 -8.749 -2.022 1.00 0.00 C ATOM 133 C LYS A 76 -6.909 -9.515 -2.915 1.00 0.00 C ATOM 134 O LYS A 76 -6.564 -9.919 -4.025 1.00 0.00 O ATOM 135 CB LYS A 76 -5.086 -7.800 -2.870 1.00 0.00 C ATOM 136 CG LYS A 76 -4.879 -6.435 -2.234 1.00 0.00 C ATOM 137 CD LYS A 76 -6.167 -5.627 -2.221 1.00 0.00 C ATOM 138 CE LYS A 76 -6.506 -5.096 -3.604 1.00 0.00 C ATOM 139 NZ LYS A 76 -7.922 -4.643 -3.695 1.00 0.00 N ATOM 0 H LYS A 76 -4.365 -10.125 -1.835 1.00 0.00 H new ATOM 0 HA LYS A 76 -6.517 -8.167 -1.305 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -4.114 -8.259 -3.049 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -5.561 -7.670 -3.842 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -4.515 -6.559 -1.214 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.111 -5.889 -2.782 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -6.985 -6.250 -1.859 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -6.068 -4.794 -1.525 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -5.843 -4.265 -3.846 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -6.326 -5.874 -4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -8.374 -5.080 -4.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -8.432 -4.924 -2.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -7.950 -3.608 -3.792 1.00 0.00 H new ATOM 153 N VAL A 77 -8.128 -9.705 -2.420 1.00 0.00 N ATOM 154 CA VAL A 77 -9.161 -10.415 -3.168 1.00 0.00 C ATOM 155 C VAL A 77 -10.489 -10.384 -2.409 1.00 0.00 C ATOM 156 O VAL A 77 -11.227 -9.402 -2.492 1.00 0.00 O ATOM 157 CB VAL A 77 -8.760 -11.877 -3.471 1.00 0.00 C ATOM 158 CG1 VAL A 77 -8.284 -12.015 -4.910 1.00 0.00 C ATOM 159 CG2 VAL A 77 -7.691 -12.353 -2.502 1.00 0.00 C ATOM 0 H VAL A 77 -8.426 -9.376 -1.501 1.00 0.00 H new ATOM 0 HA VAL A 77 -9.277 -9.900 -4.122 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.640 -12.507 -3.341 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -8.006 -13.051 -5.104 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.085 -11.721 -5.588 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.419 -11.372 -5.070 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.424 -13.384 -2.733 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.809 -11.720 -2.594 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -8.073 -12.297 -1.483 1.00 0.00 H new ATOM 169 N THR A 78 -10.780 -11.446 -1.653 1.00 0.00 N ATOM 170 CA THR A 78 -12.007 -11.526 -0.864 1.00 0.00 C ATOM 171 C THR A 78 -13.250 -11.204 -1.692 1.00 0.00 C ATOM 172 O THR A 78 -13.161 -10.668 -2.796 1.00 0.00 O ATOM 173 CB THR A 78 -11.916 -10.572 0.329 1.00 0.00 C ATOM 174 OG1 THR A 78 -11.687 -9.241 -0.105 1.00 0.00 O ATOM 175 CG2 THR A 78 -10.808 -10.941 1.290 1.00 0.00 C ATOM 0 H THR A 78 -10.178 -12.265 -1.572 1.00 0.00 H new ATOM 0 HA THR A 78 -12.106 -12.554 -0.514 1.00 0.00 H new ATOM 0 HB THR A 78 -12.873 -10.653 0.845 1.00 0.00 H new ATOM 0 HG1 THR A 78 -12.026 -9.132 -1.018 1.00 0.00 H new ATOM 0 HG21 THR A 78 -10.791 -10.230 2.116 1.00 0.00 H new ATOM 0 HG22 THR A 78 -10.982 -11.944 1.678 1.00 0.00 H new ATOM 0 HG23 THR A 78 -9.851 -10.915 0.769 1.00 0.00 H new ATOM 183 N GLU A 79 -14.414 -11.517 -1.133 1.00 0.00 N ATOM 184 CA GLU A 79 -15.681 -11.240 -1.798 1.00 0.00 C ATOM 185 C GLU A 79 -16.283 -9.950 -1.248 1.00 0.00 C ATOM 186 O GLU A 79 -17.477 -9.690 -1.391 1.00 0.00 O ATOM 187 CB GLU A 79 -16.656 -12.403 -1.602 1.00 0.00 C ATOM 188 CG GLU A 79 -16.120 -13.736 -2.101 1.00 0.00 C ATOM 189 CD GLU A 79 -16.924 -14.292 -3.261 1.00 0.00 C ATOM 190 OE1 GLU A 79 -17.104 -13.565 -4.262 1.00 0.00 O ATOM 191 OE2 GLU A 79 -17.374 -15.453 -3.169 1.00 0.00 O ATOM 0 H GLU A 79 -14.506 -11.963 -0.220 1.00 0.00 H new ATOM 0 HA GLU A 79 -15.498 -11.122 -2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -16.896 -12.491 -0.542 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -17.587 -12.177 -2.122 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -15.082 -13.613 -2.409 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -16.126 -14.455 -1.282 1.00 0.00 H new ATOM 198 N GLU A 80 -15.429 -9.154 -0.612 1.00 0.00 N ATOM 199 CA GLU A 80 -15.826 -7.890 -0.019 1.00 0.00 C ATOM 200 C GLU A 80 -14.591 -7.201 0.563 1.00 0.00 C ATOM 201 O GLU A 80 -14.420 -7.129 1.780 1.00 0.00 O ATOM 202 CB GLU A 80 -16.882 -8.127 1.065 1.00 0.00 C ATOM 203 CG GLU A 80 -17.064 -6.957 2.014 1.00 0.00 C ATOM 204 CD GLU A 80 -18.476 -6.855 2.557 1.00 0.00 C ATOM 205 OE1 GLU A 80 -19.412 -6.684 1.747 1.00 0.00 O ATOM 206 OE2 GLU A 80 -18.646 -6.947 3.790 1.00 0.00 O ATOM 0 H GLU A 80 -14.439 -9.372 -0.495 1.00 0.00 H new ATOM 0 HA GLU A 80 -16.265 -7.246 -0.781 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -17.837 -8.346 0.586 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -16.605 -9.010 1.641 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -16.366 -7.058 2.845 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -16.811 -6.032 1.496 1.00 0.00 H new ATOM 213 N PRO A 81 -13.700 -6.707 -0.313 1.00 0.00 N ATOM 214 CA PRO A 81 -12.462 -6.042 0.097 1.00 0.00 C ATOM 215 C PRO A 81 -12.655 -5.099 1.281 1.00 0.00 C ATOM 216 O PRO A 81 -13.782 -4.755 1.639 1.00 0.00 O ATOM 217 CB PRO A 81 -12.066 -5.260 -1.152 1.00 0.00 C ATOM 218 CG PRO A 81 -12.582 -6.080 -2.286 1.00 0.00 C ATOM 219 CD PRO A 81 -13.822 -6.777 -1.782 1.00 0.00 C ATOM 0 HA PRO A 81 -11.711 -6.755 0.437 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -12.505 -4.262 -1.152 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -10.985 -5.132 -1.214 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -12.813 -5.451 -3.146 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -11.835 -6.804 -2.612 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -14.728 -6.282 -2.131 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -13.869 -7.809 -2.130 1.00 0.00 H new ATOM 227 N MET A 82 -11.545 -4.688 1.885 1.00 0.00 N ATOM 228 CA MET A 82 -11.585 -3.789 3.032 1.00 0.00 C ATOM 229 C MET A 82 -11.802 -2.344 2.589 1.00 0.00 C ATOM 230 O MET A 82 -12.896 -1.801 2.735 1.00 0.00 O ATOM 231 CB MET A 82 -10.294 -3.906 3.848 1.00 0.00 C ATOM 232 CG MET A 82 -9.794 -5.334 3.998 1.00 0.00 C ATOM 233 SD MET A 82 -10.989 -6.409 4.815 1.00 0.00 S ATOM 234 CE MET A 82 -10.551 -7.997 4.113 1.00 0.00 C ATOM 0 H MET A 82 -10.606 -4.964 1.599 1.00 0.00 H new ATOM 0 HA MET A 82 -12.426 -4.082 3.661 1.00 0.00 H new ATOM 0 HB2 MET A 82 -9.518 -3.307 3.372 1.00 0.00 H new ATOM 0 HB3 MET A 82 -10.461 -3.483 4.839 1.00 0.00 H new ATOM 0 HG2 MET A 82 -9.562 -5.738 3.013 1.00 0.00 H new ATOM 0 HG3 MET A 82 -8.865 -5.331 4.568 1.00 0.00 H new ATOM 0 HE1 MET A 82 -11.204 -8.768 4.522 1.00 0.00 H new ATOM 0 HE2 MET A 82 -10.667 -7.960 3.030 1.00 0.00 H new ATOM 0 HE3 MET A 82 -9.515 -8.230 4.359 1.00 0.00 H new ATOM 244 N GLY A 83 -10.757 -1.724 2.047 1.00 0.00 N ATOM 245 CA GLY A 83 -10.866 -0.349 1.596 1.00 0.00 C ATOM 246 C GLY A 83 -9.700 0.510 2.047 1.00 0.00 C ATOM 247 O GLY A 83 -9.748 1.118 3.117 1.00 0.00 O ATOM 0 H GLY A 83 -9.839 -2.149 1.913 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -10.925 -0.332 0.508 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -11.795 0.080 1.972 1.00 0.00 H new ATOM 251 N ILE A 84 -8.650 0.566 1.232 1.00 0.00 N ATOM 252 CA ILE A 84 -7.471 1.361 1.558 1.00 0.00 C ATOM 253 C ILE A 84 -7.057 2.240 0.381 1.00 0.00 C ATOM 254 O ILE A 84 -7.188 1.847 -0.778 1.00 0.00 O ATOM 255 CB ILE A 84 -6.282 0.466 1.962 1.00 0.00 C ATOM 256 CG1 ILE A 84 -5.896 -0.463 0.810 1.00 0.00 C ATOM 257 CG2 ILE A 84 -6.624 -0.338 3.207 1.00 0.00 C ATOM 258 CD1 ILE A 84 -4.403 -0.556 0.584 1.00 0.00 C ATOM 0 H ILE A 84 -8.592 0.071 0.342 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.741 1.995 2.403 1.00 0.00 H new ATOM 0 HB ILE A 84 -5.428 1.104 2.188 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -6.288 -1.460 1.011 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.373 -0.112 -0.105 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -5.775 -0.965 3.480 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -6.852 0.342 4.028 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -7.491 -0.968 3.007 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.202 -1.232 -0.248 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.008 0.433 0.352 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.922 -0.937 1.485 1.00 0.00 H new ATOM 270 N THR A 85 -6.561 3.437 0.686 1.00 0.00 N ATOM 271 CA THR A 85 -6.133 4.373 -0.346 1.00 0.00 C ATOM 272 C THR A 85 -4.926 5.182 0.120 1.00 0.00 C ATOM 273 O THR A 85 -4.695 5.334 1.319 1.00 0.00 O ATOM 274 CB THR A 85 -7.287 5.309 -0.716 1.00 0.00 C ATOM 275 OG1 THR A 85 -8.333 4.591 -1.344 1.00 0.00 O ATOM 276 CG2 THR A 85 -6.880 6.434 -1.645 1.00 0.00 C ATOM 0 H THR A 85 -6.446 3.780 1.640 1.00 0.00 H new ATOM 0 HA THR A 85 -5.840 3.803 -1.228 1.00 0.00 H new ATOM 0 HB THR A 85 -7.615 5.744 0.228 1.00 0.00 H new ATOM 0 HG1 THR A 85 -9.061 5.206 -1.571 1.00 0.00 H new ATOM 0 HG21 THR A 85 -7.747 7.057 -1.864 1.00 0.00 H new ATOM 0 HG22 THR A 85 -6.110 7.040 -1.167 1.00 0.00 H new ATOM 0 HG23 THR A 85 -6.489 6.016 -2.573 1.00 0.00 H new ATOM 284 N LEU A 86 -4.161 5.706 -0.835 1.00 0.00 N ATOM 285 CA LEU A 86 -2.985 6.507 -0.517 1.00 0.00 C ATOM 286 C LEU A 86 -3.009 7.833 -1.269 1.00 0.00 C ATOM 287 O LEU A 86 -3.657 7.959 -2.308 1.00 0.00 O ATOM 288 CB LEU A 86 -1.700 5.743 -0.849 1.00 0.00 C ATOM 289 CG LEU A 86 -1.555 5.317 -2.308 1.00 0.00 C ATOM 290 CD1 LEU A 86 -0.114 4.942 -2.615 1.00 0.00 C ATOM 291 CD2 LEU A 86 -2.487 4.155 -2.609 1.00 0.00 C ATOM 0 H LEU A 86 -4.335 5.590 -1.833 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.004 6.713 0.553 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.847 6.367 -0.583 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -1.653 4.853 -0.221 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.830 6.157 -2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.031 4.641 -3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.532 5.800 -2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.191 4.115 -1.974 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.375 3.860 -3.652 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.238 3.312 -1.964 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.518 4.459 -2.426 1.00 0.00 H new ATOM 303 N LYS A 87 -2.297 8.817 -0.735 1.00 0.00 N ATOM 304 CA LYS A 87 -2.229 10.135 -1.348 1.00 0.00 C ATOM 305 C LYS A 87 -0.780 10.578 -1.512 1.00 0.00 C ATOM 306 O LYS A 87 0.040 10.410 -0.609 1.00 0.00 O ATOM 307 CB LYS A 87 -2.996 11.155 -0.503 1.00 0.00 C ATOM 308 CG LYS A 87 -4.491 10.890 -0.439 1.00 0.00 C ATOM 309 CD LYS A 87 -5.079 11.333 0.891 1.00 0.00 C ATOM 310 CE LYS A 87 -6.546 10.954 1.005 1.00 0.00 C ATOM 311 NZ LYS A 87 -7.380 11.644 -0.017 1.00 0.00 N ATOM 0 H LYS A 87 -1.757 8.725 0.125 1.00 0.00 H new ATOM 0 HA LYS A 87 -2.688 10.076 -2.335 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -2.591 11.154 0.509 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -2.829 12.152 -0.911 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -4.990 11.417 -1.252 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -4.680 9.826 -0.585 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -4.520 10.876 1.707 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -4.972 12.413 0.996 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.652 9.875 0.891 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -6.910 11.207 2.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -8.385 11.452 0.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -7.209 12.669 0.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.130 11.294 -0.964 1.00 0.00 H new ATOM 325 N LEU A 88 -0.468 11.130 -2.676 1.00 0.00 N ATOM 326 CA LEU A 88 0.884 11.590 -2.961 1.00 0.00 C ATOM 327 C LEU A 88 0.876 13.004 -3.527 1.00 0.00 C ATOM 328 O LEU A 88 -0.126 13.460 -4.077 1.00 0.00 O ATOM 329 CB LEU A 88 1.580 10.637 -3.933 1.00 0.00 C ATOM 330 CG LEU A 88 0.661 9.959 -4.950 1.00 0.00 C ATOM 331 CD1 LEU A 88 1.464 9.422 -6.124 1.00 0.00 C ATOM 332 CD2 LEU A 88 -0.125 8.841 -4.286 1.00 0.00 C ATOM 0 H LEU A 88 -1.132 11.270 -3.438 1.00 0.00 H new ATOM 0 HA LEU A 88 1.437 11.603 -2.022 1.00 0.00 H new ATOM 0 HB2 LEU A 88 2.347 11.191 -4.473 1.00 0.00 H new ATOM 0 HB3 LEU A 88 2.090 9.865 -3.357 1.00 0.00 H new ATOM 0 HG LEU A 88 -0.042 10.701 -5.329 1.00 0.00 H new ATOM 0 HD11 LEU A 88 0.792 8.943 -6.836 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.986 10.244 -6.614 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.191 8.693 -5.765 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -0.775 8.367 -5.021 1.00 0.00 H new ATOM 0 HD22 LEU A 88 0.566 8.101 -3.882 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.730 9.252 -3.478 1.00 0.00 H new ATOM 344 N ASN A 89 2.004 13.689 -3.392 1.00 0.00 N ATOM 345 CA ASN A 89 2.138 15.050 -3.894 1.00 0.00 C ATOM 346 C ASN A 89 2.497 15.041 -5.377 1.00 0.00 C ATOM 347 O ASN A 89 2.527 13.984 -6.009 1.00 0.00 O ATOM 348 CB ASN A 89 3.205 15.805 -3.100 1.00 0.00 C ATOM 349 CG ASN A 89 4.536 15.080 -3.089 1.00 0.00 C ATOM 350 OD1 ASN A 89 4.730 14.102 -3.811 1.00 0.00 O ATOM 351 ND2 ASN A 89 5.462 15.556 -2.264 1.00 0.00 N ATOM 0 H ASN A 89 2.841 13.323 -2.938 1.00 0.00 H new ATOM 0 HA ASN A 89 1.181 15.558 -3.771 1.00 0.00 H new ATOM 0 HB2 ASN A 89 3.339 16.798 -3.529 1.00 0.00 H new ATOM 0 HB3 ASN A 89 2.861 15.944 -2.075 1.00 0.00 H new ATOM 0 HD21 ASN A 89 6.377 15.108 -2.211 1.00 0.00 H new ATOM 0 HD22 ASN A 89 5.258 16.369 -1.683 1.00 0.00 H new ATOM 358 N GLU A 90 2.771 16.220 -5.930 1.00 0.00 N ATOM 359 CA GLU A 90 3.130 16.337 -7.341 1.00 0.00 C ATOM 360 C GLU A 90 4.245 15.360 -7.703 1.00 0.00 C ATOM 361 O GLU A 90 4.293 14.840 -8.818 1.00 0.00 O ATOM 362 CB GLU A 90 3.566 17.769 -7.660 1.00 0.00 C ATOM 363 CG GLU A 90 4.753 18.241 -6.835 1.00 0.00 C ATOM 364 CD GLU A 90 4.779 19.747 -6.662 1.00 0.00 C ATOM 365 OE1 GLU A 90 4.149 20.246 -5.705 1.00 0.00 O ATOM 366 OE2 GLU A 90 5.430 20.428 -7.482 1.00 0.00 O ATOM 0 H GLU A 90 2.751 17.106 -5.424 1.00 0.00 H new ATOM 0 HA GLU A 90 2.250 16.091 -7.936 1.00 0.00 H new ATOM 0 HB2 GLU A 90 3.820 17.836 -8.718 1.00 0.00 H new ATOM 0 HB3 GLU A 90 2.726 18.442 -7.491 1.00 0.00 H new ATOM 0 HG2 GLU A 90 4.721 17.767 -5.854 1.00 0.00 H new ATOM 0 HG3 GLU A 90 5.677 17.918 -7.315 1.00 0.00 H new ATOM 373 N LYS A 91 5.137 15.114 -6.749 1.00 0.00 N ATOM 374 CA LYS A 91 6.253 14.197 -6.959 1.00 0.00 C ATOM 375 C LYS A 91 5.764 12.764 -7.139 1.00 0.00 C ATOM 376 O LYS A 91 6.487 11.913 -7.657 1.00 0.00 O ATOM 377 CB LYS A 91 7.215 14.262 -5.771 1.00 0.00 C ATOM 378 CG LYS A 91 8.330 15.283 -5.937 1.00 0.00 C ATOM 379 CD LYS A 91 9.221 14.954 -7.125 1.00 0.00 C ATOM 380 CE LYS A 91 9.984 13.657 -6.912 1.00 0.00 C ATOM 381 NZ LYS A 91 10.746 13.253 -8.126 1.00 0.00 N ATOM 0 H LYS A 91 5.109 15.537 -5.821 1.00 0.00 H new ATOM 0 HA LYS A 91 6.771 14.502 -7.869 1.00 0.00 H new ATOM 0 HB2 LYS A 91 6.649 14.500 -4.870 1.00 0.00 H new ATOM 0 HB3 LYS A 91 7.657 13.277 -5.619 1.00 0.00 H new ATOM 0 HG2 LYS A 91 7.898 16.275 -6.069 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.932 15.316 -5.029 1.00 0.00 H new ATOM 0 HD2 LYS A 91 8.612 14.875 -8.026 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.926 15.769 -7.288 1.00 0.00 H new ATOM 0 HE2 LYS A 91 10.672 13.774 -6.074 1.00 0.00 H new ATOM 0 HE3 LYS A 91 9.285 12.865 -6.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 11.252 12.364 -7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.088 13.116 -8.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 11.431 13.997 -8.369 1.00 0.00 H new ATOM 395 N GLN A 92 4.538 12.499 -6.702 1.00 0.00 N ATOM 396 CA GLN A 92 3.963 11.166 -6.808 1.00 0.00 C ATOM 397 C GLN A 92 4.804 10.159 -6.026 1.00 0.00 C ATOM 398 O GLN A 92 5.344 9.206 -6.592 1.00 0.00 O ATOM 399 CB GLN A 92 3.861 10.741 -8.275 1.00 0.00 C ATOM 400 CG GLN A 92 2.886 11.579 -9.084 1.00 0.00 C ATOM 401 CD GLN A 92 3.007 11.333 -10.575 1.00 0.00 C ATOM 402 OE1 GLN A 92 3.859 11.915 -11.246 1.00 0.00 O ATOM 403 NE2 GLN A 92 2.149 10.466 -11.103 1.00 0.00 N ATOM 0 H GLN A 92 3.924 13.190 -6.271 1.00 0.00 H new ATOM 0 HA GLN A 92 2.960 11.190 -6.382 1.00 0.00 H new ATOM 0 HB2 GLN A 92 4.848 10.804 -8.733 1.00 0.00 H new ATOM 0 HB3 GLN A 92 3.555 9.696 -8.321 1.00 0.00 H new ATOM 0 HG2 GLN A 92 1.868 11.357 -8.764 1.00 0.00 H new ATOM 0 HG3 GLN A 92 3.061 12.635 -8.878 1.00 0.00 H new ATOM 0 HE21 GLN A 92 1.459 10.006 -10.510 1.00 0.00 H new ATOM 0 HE22 GLN A 92 2.181 10.261 -12.102 1.00 0.00 H new ATOM 412 N SER A 93 4.926 10.393 -4.725 1.00 0.00 N ATOM 413 CA SER A 93 5.717 9.529 -3.854 1.00 0.00 C ATOM 414 C SER A 93 4.868 8.478 -3.146 1.00 0.00 C ATOM 415 O SER A 93 5.310 7.864 -2.174 1.00 0.00 O ATOM 416 CB SER A 93 6.428 10.385 -2.819 1.00 0.00 C ATOM 417 OG SER A 93 7.829 10.392 -3.027 1.00 0.00 O ATOM 0 H SER A 93 4.485 11.178 -4.247 1.00 0.00 H new ATOM 0 HA SER A 93 6.435 8.998 -4.479 1.00 0.00 H new ATOM 0 HB2 SER A 93 6.047 11.405 -2.865 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.209 10.008 -1.820 1.00 0.00 H new ATOM 0 HG SER A 93 8.258 10.952 -2.347 1.00 0.00 H new ATOM 423 N CYS A 94 3.655 8.276 -3.637 1.00 0.00 N ATOM 424 CA CYS A 94 2.725 7.301 -3.062 1.00 0.00 C ATOM 425 C CYS A 94 2.808 7.267 -1.540 1.00 0.00 C ATOM 426 O CYS A 94 3.418 6.368 -0.961 1.00 0.00 O ATOM 427 CB CYS A 94 2.971 5.893 -3.629 1.00 0.00 C ATOM 428 SG CYS A 94 4.601 5.643 -4.379 1.00 0.00 S ATOM 0 H CYS A 94 3.283 8.779 -4.443 1.00 0.00 H new ATOM 0 HA CYS A 94 1.722 7.623 -3.342 1.00 0.00 H new ATOM 0 HB2 CYS A 94 2.842 5.167 -2.826 1.00 0.00 H new ATOM 0 HB3 CYS A 94 2.207 5.680 -4.377 1.00 0.00 H new ATOM 0 HG CYS A 94 5.474 5.395 -3.448 1.00 0.00 H new ATOM 434 N THR A 95 2.180 8.244 -0.896 1.00 0.00 N ATOM 435 CA THR A 95 2.174 8.311 0.555 1.00 0.00 C ATOM 436 C THR A 95 0.846 7.797 1.090 1.00 0.00 C ATOM 437 O THR A 95 -0.205 8.376 0.820 1.00 0.00 O ATOM 438 CB THR A 95 2.431 9.750 1.025 1.00 0.00 C ATOM 439 OG1 THR A 95 3.821 9.998 1.137 1.00 0.00 O ATOM 440 CG2 THR A 95 1.800 10.082 2.363 1.00 0.00 C ATOM 0 H THR A 95 1.670 8.998 -1.357 1.00 0.00 H new ATOM 0 HA THR A 95 2.974 7.680 0.944 1.00 0.00 H new ATOM 0 HB THR A 95 1.970 10.380 0.265 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.207 9.400 1.811 1.00 0.00 H new ATOM 0 HG21 THR A 95 2.027 11.115 2.626 1.00 0.00 H new ATOM 0 HG22 THR A 95 0.720 9.953 2.298 1.00 0.00 H new ATOM 0 HG23 THR A 95 2.200 9.417 3.129 1.00 0.00 H new ATOM 448 N VAL A 96 0.902 6.706 1.849 1.00 0.00 N ATOM 449 CA VAL A 96 -0.297 6.103 2.429 1.00 0.00 C ATOM 450 C VAL A 96 -1.272 7.179 2.907 1.00 0.00 C ATOM 451 O VAL A 96 -0.856 8.245 3.359 1.00 0.00 O ATOM 452 CB VAL A 96 0.073 5.175 3.601 1.00 0.00 C ATOM 453 CG1 VAL A 96 -1.175 4.561 4.216 1.00 0.00 C ATOM 454 CG2 VAL A 96 1.039 4.090 3.137 1.00 0.00 C ATOM 0 H VAL A 96 1.768 6.219 2.078 1.00 0.00 H new ATOM 0 HA VAL A 96 -0.782 5.513 1.651 1.00 0.00 H new ATOM 0 HB VAL A 96 0.569 5.770 4.368 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.891 3.909 5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.826 5.353 4.586 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -1.705 3.980 3.461 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.290 3.443 3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 96 0.571 3.498 2.351 1.00 0.00 H new ATOM 0 HG23 VAL A 96 1.947 4.552 2.751 1.00 0.00 H new ATOM 464 N ALA A 97 -2.567 6.909 2.776 1.00 0.00 N ATOM 465 CA ALA A 97 -3.582 7.881 3.167 1.00 0.00 C ATOM 466 C ALA A 97 -4.577 7.319 4.176 1.00 0.00 C ATOM 467 O ALA A 97 -4.479 7.587 5.374 1.00 0.00 O ATOM 468 CB ALA A 97 -4.320 8.384 1.934 1.00 0.00 C ATOM 0 H ALA A 97 -2.936 6.033 2.406 1.00 0.00 H new ATOM 0 HA ALA A 97 -3.064 8.707 3.655 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -5.076 9.109 2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.612 8.858 1.254 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.801 7.545 1.430 1.00 0.00 H new ATOM 474 N ARG A 98 -5.556 6.564 3.684 1.00 0.00 N ATOM 475 CA ARG A 98 -6.587 5.999 4.548 1.00 0.00 C ATOM 476 C ARG A 98 -6.573 4.475 4.537 1.00 0.00 C ATOM 477 O ARG A 98 -6.067 3.848 3.606 1.00 0.00 O ATOM 478 CB ARG A 98 -7.966 6.506 4.118 1.00 0.00 C ATOM 479 CG ARG A 98 -8.179 6.508 2.609 1.00 0.00 C ATOM 480 CD ARG A 98 -9.452 7.246 2.229 1.00 0.00 C ATOM 481 NE ARG A 98 -10.116 6.637 1.078 1.00 0.00 N ATOM 482 CZ ARG A 98 -10.885 5.552 1.153 1.00 0.00 C ATOM 483 NH1 ARG A 98 -11.089 4.955 2.321 1.00 0.00 N ATOM 484 NH2 ARG A 98 -11.452 5.066 0.058 1.00 0.00 N ATOM 0 H ARG A 98 -5.656 6.330 2.696 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.373 6.325 5.566 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.732 5.885 4.583 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -8.104 7.519 4.496 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -7.325 6.977 2.120 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -8.230 5.481 2.246 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -10.134 7.253 3.079 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -9.214 8.285 2.002 1.00 0.00 H new ATOM 0 HE ARG A 98 -9.983 7.068 0.163 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -10.656 5.327 3.166 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -11.679 4.124 2.373 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -11.299 5.523 -0.841 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -12.041 4.235 0.114 1.00 0.00 H new ATOM 498 N ILE A 99 -7.149 3.893 5.585 1.00 0.00 N ATOM 499 CA ILE A 99 -7.232 2.444 5.725 1.00 0.00 C ATOM 500 C ILE A 99 -8.491 2.059 6.492 1.00 0.00 C ATOM 501 O ILE A 99 -8.609 2.322 7.689 1.00 0.00 O ATOM 502 CB ILE A 99 -5.987 1.872 6.445 1.00 0.00 C ATOM 503 CG1 ILE A 99 -4.788 1.848 5.496 1.00 0.00 C ATOM 504 CG2 ILE A 99 -6.261 0.472 6.984 1.00 0.00 C ATOM 505 CD1 ILE A 99 -3.719 2.861 5.844 1.00 0.00 C ATOM 0 H ILE A 99 -7.569 4.410 6.357 1.00 0.00 H new ATOM 0 HA ILE A 99 -7.272 2.017 4.723 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.756 2.522 7.289 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -4.348 0.851 5.505 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.136 2.034 4.480 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.370 0.094 7.485 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.087 0.511 7.694 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.522 -0.191 6.159 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -2.900 2.786 5.128 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.143 3.865 5.807 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -3.343 2.663 6.848 1.00 0.00 H new ATOM 517 N LEU A 100 -9.429 1.434 5.792 1.00 0.00 N ATOM 518 CA LEU A 100 -10.686 1.007 6.393 1.00 0.00 C ATOM 519 C LEU A 100 -10.439 0.253 7.700 1.00 0.00 C ATOM 520 O LEU A 100 -9.665 -0.702 7.742 1.00 0.00 O ATOM 521 CB LEU A 100 -11.458 0.131 5.402 1.00 0.00 C ATOM 522 CG LEU A 100 -12.605 -0.684 5.999 1.00 0.00 C ATOM 523 CD1 LEU A 100 -13.796 -0.702 5.051 1.00 0.00 C ATOM 524 CD2 LEU A 100 -12.139 -2.100 6.307 1.00 0.00 C ATOM 0 H LEU A 100 -9.342 1.210 4.801 1.00 0.00 H new ATOM 0 HA LEU A 100 -11.281 1.890 6.627 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -11.860 0.770 4.616 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -10.757 -0.555 4.927 1.00 0.00 H new ATOM 0 HG LEU A 100 -12.920 -0.214 6.931 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -14.603 -1.287 5.492 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -14.139 0.318 4.878 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -13.500 -1.150 4.103 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -12.965 -2.671 6.732 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -11.801 -2.580 5.388 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -11.317 -2.065 7.022 1.00 0.00 H new ATOM 536 N HIS A 101 -11.101 0.697 8.765 1.00 0.00 N ATOM 537 CA HIS A 101 -10.956 0.074 10.078 1.00 0.00 C ATOM 538 C HIS A 101 -11.202 -1.430 10.008 1.00 0.00 C ATOM 539 O HIS A 101 -12.142 -1.886 9.356 1.00 0.00 O ATOM 540 CB HIS A 101 -11.922 0.712 11.076 1.00 0.00 C ATOM 541 CG HIS A 101 -13.355 0.647 10.647 1.00 0.00 C ATOM 542 ND1 HIS A 101 -14.043 -0.540 10.501 1.00 0.00 N ATOM 543 CD2 HIS A 101 -14.232 1.629 10.331 1.00 0.00 C ATOM 544 CE1 HIS A 101 -15.280 -0.284 10.113 1.00 0.00 C ATOM 545 NE2 HIS A 101 -15.420 1.024 10.003 1.00 0.00 N ATOM 0 H HIS A 101 -11.745 1.488 8.744 1.00 0.00 H new ATOM 0 HA HIS A 101 -9.932 0.237 10.413 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -11.817 0.214 12.040 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -11.642 1.755 11.224 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -13.657 -1.470 10.667 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -14.034 2.691 10.336 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -16.046 -1.020 9.919 1.00 0.00 H new ATOM 554 N GLY A 102 -10.352 -2.195 10.686 1.00 0.00 N ATOM 555 CA GLY A 102 -10.492 -3.640 10.692 1.00 0.00 C ATOM 556 C GLY A 102 -10.535 -4.226 9.295 1.00 0.00 C ATOM 557 O GLY A 102 -11.589 -4.656 8.827 1.00 0.00 O ATOM 0 H GLY A 102 -9.567 -1.839 11.232 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -9.660 -4.080 11.241 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.404 -3.911 11.224 1.00 0.00 H new ATOM 561 N GLY A 103 -9.386 -4.245 8.627 1.00 0.00 N ATOM 562 CA GLY A 103 -9.322 -4.784 7.282 1.00 0.00 C ATOM 563 C GLY A 103 -7.900 -5.033 6.819 1.00 0.00 C ATOM 564 O GLY A 103 -7.349 -4.254 6.042 1.00 0.00 O ATOM 0 H GLY A 103 -8.500 -3.897 8.993 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -9.882 -5.719 7.242 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -9.808 -4.092 6.594 1.00 0.00 H new ATOM 568 N MET A 104 -7.310 -6.125 7.294 1.00 0.00 N ATOM 569 CA MET A 104 -5.944 -6.485 6.922 1.00 0.00 C ATOM 570 C MET A 104 -4.946 -5.429 7.391 1.00 0.00 C ATOM 571 O MET A 104 -4.251 -5.620 8.389 1.00 0.00 O ATOM 572 CB MET A 104 -5.837 -6.671 5.407 1.00 0.00 C ATOM 573 CG MET A 104 -6.196 -8.073 4.940 1.00 0.00 C ATOM 574 SD MET A 104 -5.107 -9.334 5.629 1.00 0.00 S ATOM 575 CE MET A 104 -6.304 -10.509 6.259 1.00 0.00 C ATOM 0 H MET A 104 -7.756 -6.778 7.938 1.00 0.00 H new ATOM 0 HA MET A 104 -5.700 -7.426 7.415 1.00 0.00 H new ATOM 0 HB2 MET A 104 -6.493 -5.954 4.914 1.00 0.00 H new ATOM 0 HB3 MET A 104 -4.819 -6.441 5.092 1.00 0.00 H new ATOM 0 HG2 MET A 104 -7.225 -8.294 5.223 1.00 0.00 H new ATOM 0 HG3 MET A 104 -6.149 -8.113 3.852 1.00 0.00 H new ATOM 0 HE1 MET A 104 -5.783 -11.358 6.701 1.00 0.00 H new ATOM 0 HE2 MET A 104 -6.922 -10.028 7.017 1.00 0.00 H new ATOM 0 HE3 MET A 104 -6.937 -10.857 5.442 1.00 0.00 H new ATOM 585 N ILE A 105 -4.876 -4.318 6.664 1.00 0.00 N ATOM 586 CA ILE A 105 -3.956 -3.238 7.007 1.00 0.00 C ATOM 587 C ILE A 105 -4.191 -2.742 8.428 1.00 0.00 C ATOM 588 O ILE A 105 -3.330 -2.884 9.295 1.00 0.00 O ATOM 589 CB ILE A 105 -4.092 -2.048 6.038 1.00 0.00 C ATOM 590 CG1 ILE A 105 -4.054 -2.526 4.585 1.00 0.00 C ATOM 591 CG2 ILE A 105 -2.989 -1.033 6.297 1.00 0.00 C ATOM 592 CD1 ILE A 105 -2.861 -3.400 4.264 1.00 0.00 C ATOM 0 H ILE A 105 -5.444 -4.142 5.835 1.00 0.00 H new ATOM 0 HA ILE A 105 -2.950 -3.651 6.928 1.00 0.00 H new ATOM 0 HB ILE A 105 -5.055 -1.568 6.211 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -4.968 -3.080 4.370 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -4.045 -1.658 3.926 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -3.095 -0.196 5.606 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -3.063 -0.669 7.322 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -2.018 -1.505 6.149 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.901 -3.701 3.217 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.942 -2.843 4.446 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.879 -4.287 4.897 1.00 0.00 H new ATOM 604 N HIS A 106 -5.363 -2.159 8.662 1.00 0.00 N ATOM 605 CA HIS A 106 -5.712 -1.642 9.982 1.00 0.00 C ATOM 606 C HIS A 106 -5.441 -2.680 11.066 1.00 0.00 C ATOM 607 O HIS A 106 -5.100 -2.337 12.198 1.00 0.00 O ATOM 608 CB HIS A 106 -7.184 -1.227 10.015 1.00 0.00 C ATOM 609 CG HIS A 106 -7.465 -0.091 10.948 1.00 0.00 C ATOM 610 ND1 HIS A 106 -7.840 -0.272 12.263 1.00 0.00 N ATOM 611 CD2 HIS A 106 -7.424 1.248 10.752 1.00 0.00 C ATOM 612 CE1 HIS A 106 -8.016 0.906 12.834 1.00 0.00 C ATOM 613 NE2 HIS A 106 -7.770 1.844 11.940 1.00 0.00 N ATOM 0 H HIS A 106 -6.087 -2.033 7.955 1.00 0.00 H new ATOM 0 HA HIS A 106 -5.089 -0.770 10.178 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -7.496 -0.946 9.009 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -7.788 -2.085 10.308 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -7.167 1.753 9.833 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -8.311 1.073 13.859 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -7.827 2.849 12.104 1.00 0.00 H new ATOM 622 N ARG A 107 -5.593 -3.952 10.710 1.00 0.00 N ATOM 623 CA ARG A 107 -5.365 -5.043 11.647 1.00 0.00 C ATOM 624 C ARG A 107 -3.875 -5.348 11.781 1.00 0.00 C ATOM 625 O ARG A 107 -3.433 -5.896 12.791 1.00 0.00 O ATOM 626 CB ARG A 107 -6.115 -6.291 11.187 1.00 0.00 C ATOM 627 CG ARG A 107 -6.533 -7.200 12.327 1.00 0.00 C ATOM 628 CD ARG A 107 -7.911 -6.834 12.855 1.00 0.00 C ATOM 629 NE ARG A 107 -8.034 -7.097 14.287 1.00 0.00 N ATOM 630 CZ ARG A 107 -9.185 -7.044 14.953 1.00 0.00 C ATOM 631 NH1 ARG A 107 -10.312 -6.741 14.323 1.00 0.00 N ATOM 632 NH2 ARG A 107 -9.208 -7.298 16.255 1.00 0.00 N ATOM 0 H ARG A 107 -5.874 -4.251 9.776 1.00 0.00 H new ATOM 0 HA ARG A 107 -5.739 -4.738 12.624 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -7.002 -5.988 10.631 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.483 -6.852 10.498 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -6.536 -8.235 11.986 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -5.803 -7.132 13.134 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -8.105 -5.779 12.662 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -8.669 -7.402 12.315 1.00 0.00 H new ATOM 0 HE ARG A 107 -7.189 -7.335 14.806 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -10.300 -6.547 13.322 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -11.191 -6.702 14.840 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -8.344 -7.533 16.744 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -10.089 -7.258 16.767 1.00 0.00 H new ATOM 646 N GLN A 108 -3.103 -4.990 10.757 1.00 0.00 N ATOM 647 CA GLN A 108 -1.662 -5.226 10.761 1.00 0.00 C ATOM 648 C GLN A 108 -1.021 -4.686 12.036 1.00 0.00 C ATOM 649 O GLN A 108 -0.425 -5.436 12.809 1.00 0.00 O ATOM 650 CB GLN A 108 -1.012 -4.577 9.536 1.00 0.00 C ATOM 651 CG GLN A 108 0.150 -5.375 8.966 1.00 0.00 C ATOM 652 CD GLN A 108 -0.229 -6.807 8.642 1.00 0.00 C ATOM 653 OE1 GLN A 108 -0.006 -7.716 9.441 1.00 0.00 O ATOM 654 NE2 GLN A 108 -0.807 -7.014 7.464 1.00 0.00 N ATOM 0 H GLN A 108 -3.452 -4.535 9.914 1.00 0.00 H new ATOM 0 HA GLN A 108 -1.499 -6.303 10.723 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -1.767 -4.447 8.761 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -0.660 -3.582 9.807 1.00 0.00 H new ATOM 0 HG2 GLN A 108 0.513 -4.886 8.062 1.00 0.00 H new ATOM 0 HG3 GLN A 108 0.972 -5.374 9.681 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -0.973 -6.230 6.833 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -1.085 -7.957 7.191 1.00 0.00 H new ATOM 663 N GLY A 109 -1.147 -3.380 12.249 1.00 0.00 N ATOM 664 CA GLY A 109 -0.574 -2.763 13.430 1.00 0.00 C ATOM 665 C GLY A 109 0.830 -2.240 13.189 1.00 0.00 C ATOM 666 O GLY A 109 1.304 -1.363 13.912 1.00 0.00 O ATOM 0 H GLY A 109 -1.636 -2.738 11.625 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.214 -1.942 13.754 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -0.553 -3.490 14.242 1.00 0.00 H new ATOM 670 N SER A 110 1.495 -2.776 12.170 1.00 0.00 N ATOM 671 CA SER A 110 2.850 -2.357 11.836 1.00 0.00 C ATOM 672 C SER A 110 2.840 -1.342 10.699 1.00 0.00 C ATOM 673 O SER A 110 3.780 -1.274 9.906 1.00 0.00 O ATOM 674 CB SER A 110 3.695 -3.571 11.443 1.00 0.00 C ATOM 675 OG SER A 110 3.551 -4.619 12.385 1.00 0.00 O ATOM 0 H SER A 110 1.116 -3.502 11.562 1.00 0.00 H new ATOM 0 HA SER A 110 3.287 -1.885 12.716 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.396 -3.922 10.455 1.00 0.00 H new ATOM 0 HB3 SER A 110 4.744 -3.281 11.374 1.00 0.00 H new ATOM 0 HG SER A 110 4.099 -5.383 12.110 1.00 0.00 H new ATOM 681 N LEU A 111 1.771 -0.555 10.622 1.00 0.00 N ATOM 682 CA LEU A 111 1.644 0.454 9.577 1.00 0.00 C ATOM 683 C LEU A 111 1.269 1.810 10.167 1.00 0.00 C ATOM 684 O LEU A 111 0.728 1.895 11.269 1.00 0.00 O ATOM 685 CB LEU A 111 0.594 0.024 8.547 1.00 0.00 C ATOM 686 CG LEU A 111 1.143 -0.307 7.158 1.00 0.00 C ATOM 687 CD1 LEU A 111 0.006 -0.540 6.176 1.00 0.00 C ATOM 688 CD2 LEU A 111 2.052 0.809 6.661 1.00 0.00 C ATOM 0 H LEU A 111 0.983 -0.596 11.268 1.00 0.00 H new ATOM 0 HA LEU A 111 2.611 0.550 9.083 1.00 0.00 H new ATOM 0 HB2 LEU A 111 0.069 -0.851 8.931 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -0.143 0.821 8.449 1.00 0.00 H new ATOM 0 HG LEU A 111 1.729 -1.223 7.232 1.00 0.00 H new ATOM 0 HD11 LEU A 111 0.416 -0.774 5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.608 -1.372 6.521 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.607 0.359 6.109 1.00 0.00 H new ATOM 0 HD21 LEU A 111 2.433 0.555 5.672 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.488 1.740 6.605 1.00 0.00 H new ATOM 0 HD23 LEU A 111 2.887 0.932 7.350 1.00 0.00 H new ATOM 700 N HIS A 112 1.560 2.868 9.419 1.00 0.00 N ATOM 701 CA HIS A 112 1.254 4.226 9.853 1.00 0.00 C ATOM 702 C HIS A 112 0.959 5.116 8.652 1.00 0.00 C ATOM 703 O HIS A 112 1.873 5.569 7.963 1.00 0.00 O ATOM 704 CB HIS A 112 2.420 4.800 10.659 1.00 0.00 C ATOM 705 CG HIS A 112 2.303 4.561 12.133 1.00 0.00 C ATOM 706 ND1 HIS A 112 3.396 4.387 12.956 1.00 0.00 N ATOM 707 CD2 HIS A 112 1.213 4.467 12.931 1.00 0.00 C ATOM 708 CE1 HIS A 112 2.982 4.194 14.197 1.00 0.00 C ATOM 709 NE2 HIS A 112 1.664 4.240 14.209 1.00 0.00 N ATOM 0 H HIS A 112 2.009 2.811 8.505 1.00 0.00 H new ATOM 0 HA HIS A 112 0.369 4.194 10.488 1.00 0.00 H new ATOM 0 HB2 HIS A 112 3.351 4.360 10.300 1.00 0.00 H new ATOM 0 HB3 HIS A 112 2.484 5.873 10.477 1.00 0.00 H new ATOM 0 HD2 HIS A 112 0.182 4.554 12.621 1.00 0.00 H new ATOM 0 HE1 HIS A 112 3.616 4.027 15.055 1.00 0.00 H new ATOM 0 HE2 HIS A 112 1.075 4.126 15.034 1.00 0.00 H new ATOM 718 N VAL A 113 -0.326 5.359 8.403 1.00 0.00 N ATOM 719 CA VAL A 113 -0.750 6.190 7.279 1.00 0.00 C ATOM 720 C VAL A 113 0.075 7.469 7.184 1.00 0.00 C ATOM 721 O VAL A 113 0.730 7.874 8.144 1.00 0.00 O ATOM 722 CB VAL A 113 -2.247 6.550 7.373 1.00 0.00 C ATOM 723 CG1 VAL A 113 -3.079 5.305 7.641 1.00 0.00 C ATOM 724 CG2 VAL A 113 -2.487 7.601 8.449 1.00 0.00 C ATOM 0 H VAL A 113 -1.093 4.991 8.966 1.00 0.00 H new ATOM 0 HA VAL A 113 -0.587 5.599 6.378 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.557 6.971 6.417 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.132 5.578 7.704 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.937 4.591 6.830 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -2.764 4.853 8.581 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -3.550 7.838 8.496 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.158 7.215 9.414 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.925 8.503 8.208 1.00 0.00 H new ATOM 734 N GLY A 114 0.044 8.089 6.011 1.00 0.00 N ATOM 735 CA GLY A 114 0.797 9.307 5.797 1.00 0.00 C ATOM 736 C GLY A 114 2.273 9.041 5.554 1.00 0.00 C ATOM 737 O GLY A 114 3.053 9.973 5.354 1.00 0.00 O ATOM 0 H GLY A 114 -0.491 7.768 5.204 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.382 9.842 4.943 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.686 9.957 6.665 1.00 0.00 H new ATOM 741 N ASP A 115 2.656 7.767 5.565 1.00 0.00 N ATOM 742 CA ASP A 115 4.042 7.377 5.340 1.00 0.00 C ATOM 743 C ASP A 115 4.374 7.429 3.855 1.00 0.00 C ATOM 744 O ASP A 115 3.595 7.945 3.054 1.00 0.00 O ATOM 745 CB ASP A 115 4.281 5.966 5.877 1.00 0.00 C ATOM 746 CG ASP A 115 3.389 4.942 5.210 1.00 0.00 C ATOM 747 OD1 ASP A 115 3.536 4.738 3.987 1.00 0.00 O ATOM 748 OD2 ASP A 115 2.543 4.344 5.908 1.00 0.00 O ATOM 0 H ASP A 115 2.022 6.985 5.728 1.00 0.00 H new ATOM 0 HA ASP A 115 4.691 8.076 5.868 1.00 0.00 H new ATOM 0 HB2 ASP A 115 5.325 5.692 5.722 1.00 0.00 H new ATOM 0 HB3 ASP A 115 4.104 5.954 6.953 1.00 0.00 H new ATOM 753 N GLU A 116 5.530 6.886 3.486 1.00 0.00 N ATOM 754 CA GLU A 116 5.947 6.871 2.092 1.00 0.00 C ATOM 755 C GLU A 116 6.279 5.452 1.635 1.00 0.00 C ATOM 756 O GLU A 116 6.892 4.674 2.367 1.00 0.00 O ATOM 757 CB GLU A 116 7.145 7.809 1.879 1.00 0.00 C ATOM 758 CG GLU A 116 8.500 7.166 2.135 1.00 0.00 C ATOM 759 CD GLU A 116 9.400 8.024 3.003 1.00 0.00 C ATOM 760 OE1 GLU A 116 8.908 8.563 4.017 1.00 0.00 O ATOM 761 OE2 GLU A 116 10.597 8.155 2.671 1.00 0.00 O ATOM 0 H GLU A 116 6.191 6.453 4.131 1.00 0.00 H new ATOM 0 HA GLU A 116 5.117 7.231 1.484 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.121 8.182 0.855 1.00 0.00 H new ATOM 0 HB3 GLU A 116 7.036 8.672 2.536 1.00 0.00 H new ATOM 0 HG2 GLU A 116 8.354 6.199 2.615 1.00 0.00 H new ATOM 0 HG3 GLU A 116 8.994 6.977 1.182 1.00 0.00 H new ATOM 768 N ILE A 117 5.873 5.133 0.416 1.00 0.00 N ATOM 769 CA ILE A 117 6.121 3.823 -0.167 1.00 0.00 C ATOM 770 C ILE A 117 7.041 3.956 -1.374 1.00 0.00 C ATOM 771 O ILE A 117 7.026 4.971 -2.070 1.00 0.00 O ATOM 772 CB ILE A 117 4.798 3.131 -0.562 1.00 0.00 C ATOM 773 CG1 ILE A 117 4.014 2.759 0.700 1.00 0.00 C ATOM 774 CG2 ILE A 117 5.064 1.896 -1.415 1.00 0.00 C ATOM 775 CD1 ILE A 117 2.722 2.022 0.422 1.00 0.00 C ATOM 0 H ILE A 117 5.364 5.772 -0.195 1.00 0.00 H new ATOM 0 HA ILE A 117 6.610 3.199 0.581 1.00 0.00 H new ATOM 0 HB ILE A 117 4.203 3.824 -1.158 1.00 0.00 H new ATOM 0 HG12 ILE A 117 4.644 2.140 1.339 1.00 0.00 H new ATOM 0 HG13 ILE A 117 3.790 3.668 1.258 1.00 0.00 H new ATOM 0 HG21 ILE A 117 4.117 1.426 -1.680 1.00 0.00 H new ATOM 0 HG22 ILE A 117 5.591 2.188 -2.323 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.674 1.190 -0.852 1.00 0.00 H new ATOM 0 HD11 ILE A 117 2.224 1.793 1.364 1.00 0.00 H new ATOM 0 HD12 ILE A 117 2.071 2.647 -0.190 1.00 0.00 H new ATOM 0 HD13 ILE A 117 2.939 1.095 -0.108 1.00 0.00 H new ATOM 787 N LEU A 118 7.860 2.939 -1.599 1.00 0.00 N ATOM 788 CA LEU A 118 8.812 2.958 -2.703 1.00 0.00 C ATOM 789 C LEU A 118 8.482 1.898 -3.739 1.00 0.00 C ATOM 790 O LEU A 118 8.654 2.109 -4.939 1.00 0.00 O ATOM 791 CB LEU A 118 10.242 2.735 -2.193 1.00 0.00 C ATOM 792 CG LEU A 118 10.448 2.853 -0.677 1.00 0.00 C ATOM 793 CD1 LEU A 118 9.806 4.122 -0.136 1.00 0.00 C ATOM 794 CD2 LEU A 118 9.900 1.620 0.028 1.00 0.00 C ATOM 0 H LEU A 118 7.886 2.091 -1.033 1.00 0.00 H new ATOM 0 HA LEU A 118 8.741 3.940 -3.170 1.00 0.00 H new ATOM 0 HB2 LEU A 118 10.566 1.743 -2.506 1.00 0.00 H new ATOM 0 HB3 LEU A 118 10.897 3.454 -2.685 1.00 0.00 H new ATOM 0 HG LEU A 118 11.518 2.915 -0.479 1.00 0.00 H new ATOM 0 HD11 LEU A 118 9.967 4.181 0.940 1.00 0.00 H new ATOM 0 HD12 LEU A 118 10.255 4.991 -0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 118 8.736 4.105 -0.343 1.00 0.00 H new ATOM 0 HD21 LEU A 118 10.053 1.717 1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 118 8.834 1.526 -0.180 1.00 0.00 H new ATOM 0 HD23 LEU A 118 10.420 0.733 -0.334 1.00 0.00 H new ATOM 806 N GLU A 119 8.023 0.752 -3.266 1.00 0.00 N ATOM 807 CA GLU A 119 7.688 -0.347 -4.148 1.00 0.00 C ATOM 808 C GLU A 119 6.889 -1.413 -3.422 1.00 0.00 C ATOM 809 O GLU A 119 7.186 -1.772 -2.283 1.00 0.00 O ATOM 810 CB GLU A 119 8.957 -0.960 -4.733 1.00 0.00 C ATOM 811 CG GLU A 119 9.851 -1.620 -3.696 1.00 0.00 C ATOM 812 CD GLU A 119 11.326 -1.412 -3.980 1.00 0.00 C ATOM 813 OE1 GLU A 119 11.771 -1.763 -5.093 1.00 0.00 O ATOM 814 OE2 GLU A 119 12.035 -0.899 -3.088 1.00 0.00 O ATOM 0 H GLU A 119 7.875 0.561 -2.275 1.00 0.00 H new ATOM 0 HA GLU A 119 7.073 0.049 -4.956 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.680 -1.700 -5.484 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.523 -0.182 -5.245 1.00 0.00 H new ATOM 0 HG2 GLU A 119 9.615 -1.219 -2.710 1.00 0.00 H new ATOM 0 HG3 GLU A 119 9.638 -2.689 -3.665 1.00 0.00 H new ATOM 821 N ILE A 120 5.878 -1.916 -4.104 1.00 0.00 N ATOM 822 CA ILE A 120 5.017 -2.956 -3.551 1.00 0.00 C ATOM 823 C ILE A 120 4.984 -4.186 -4.447 1.00 0.00 C ATOM 824 O ILE A 120 5.096 -4.089 -5.667 1.00 0.00 O ATOM 825 CB ILE A 120 3.573 -2.456 -3.293 1.00 0.00 C ATOM 826 CG1 ILE A 120 2.645 -2.723 -4.488 1.00 0.00 C ATOM 827 CG2 ILE A 120 3.578 -0.979 -2.943 1.00 0.00 C ATOM 828 CD1 ILE A 120 3.125 -2.145 -5.798 1.00 0.00 C ATOM 0 H ILE A 120 5.628 -1.622 -5.048 1.00 0.00 H new ATOM 0 HA ILE A 120 5.453 -3.229 -2.590 1.00 0.00 H new ATOM 0 HB ILE A 120 3.181 -3.021 -2.447 1.00 0.00 H new ATOM 0 HG12 ILE A 120 2.524 -3.800 -4.604 1.00 0.00 H new ATOM 0 HG13 ILE A 120 1.660 -2.314 -4.265 1.00 0.00 H new ATOM 0 HG21 ILE A 120 2.556 -0.644 -2.765 1.00 0.00 H new ATOM 0 HG22 ILE A 120 4.174 -0.820 -2.044 1.00 0.00 H new ATOM 0 HG23 ILE A 120 4.007 -0.411 -3.768 1.00 0.00 H new ATOM 0 HD11 ILE A 120 2.409 -2.382 -6.585 1.00 0.00 H new ATOM 0 HD12 ILE A 120 3.218 -1.063 -5.706 1.00 0.00 H new ATOM 0 HD13 ILE A 120 4.096 -2.572 -6.050 1.00 0.00 H new ATOM 840 N ASN A 121 4.826 -5.343 -3.824 1.00 0.00 N ATOM 841 CA ASN A 121 4.776 -6.613 -4.547 1.00 0.00 C ATOM 842 C ASN A 121 5.858 -6.690 -5.624 1.00 0.00 C ATOM 843 O ASN A 121 5.679 -7.348 -6.649 1.00 0.00 O ATOM 844 CB ASN A 121 3.399 -6.810 -5.184 1.00 0.00 C ATOM 845 CG ASN A 121 2.985 -8.267 -5.217 1.00 0.00 C ATOM 846 OD1 ASN A 121 2.208 -8.638 -6.228 1.00 0.00 O flip ATOM 847 ND2 ASN A 121 3.358 -9.051 -4.344 1.00 0.00 N flip ATOM 0 H ASN A 121 4.729 -5.433 -2.813 1.00 0.00 H new ATOM 0 HA ASN A 121 4.958 -7.408 -3.824 1.00 0.00 H new ATOM 0 HB2 ASN A 121 2.658 -6.236 -4.627 1.00 0.00 H new ATOM 0 HB3 ASN A 121 3.411 -6.415 -6.200 1.00 0.00 H new ATOM 0 HD21 ASN A 121 3.955 -8.723 -3.585 1.00 0.00 H new ATOM 0 HD22 ASN A 121 3.070 -10.029 -4.380 1.00 0.00 H new ATOM 854 N GLY A 122 6.979 -6.014 -5.389 1.00 0.00 N ATOM 855 CA GLY A 122 8.065 -6.023 -6.353 1.00 0.00 C ATOM 856 C GLY A 122 7.818 -5.083 -7.516 1.00 0.00 C ATOM 857 O GLY A 122 8.289 -5.322 -8.628 1.00 0.00 O ATOM 0 H GLY A 122 7.155 -5.461 -4.550 1.00 0.00 H new ATOM 0 HA2 GLY A 122 8.992 -5.742 -5.853 1.00 0.00 H new ATOM 0 HA3 GLY A 122 8.202 -7.036 -6.732 1.00 0.00 H new ATOM 861 N THR A 123 7.073 -4.013 -7.260 1.00 0.00 N ATOM 862 CA THR A 123 6.756 -3.031 -8.292 1.00 0.00 C ATOM 863 C THR A 123 7.313 -1.659 -7.927 1.00 0.00 C ATOM 864 O THR A 123 6.994 -1.110 -6.873 1.00 0.00 O ATOM 865 CB THR A 123 5.236 -2.945 -8.495 1.00 0.00 C ATOM 866 OG1 THR A 123 4.774 -4.031 -9.278 1.00 0.00 O ATOM 867 CG2 THR A 123 4.775 -1.666 -9.172 1.00 0.00 C ATOM 0 H THR A 123 6.676 -3.803 -6.344 1.00 0.00 H new ATOM 0 HA THR A 123 7.222 -3.354 -9.223 1.00 0.00 H new ATOM 0 HB THR A 123 4.818 -2.967 -7.489 1.00 0.00 H new ATOM 0 HG1 THR A 123 3.804 -3.960 -9.395 1.00 0.00 H new ATOM 0 HG21 THR A 123 3.690 -1.682 -9.279 1.00 0.00 H new ATOM 0 HG22 THR A 123 5.068 -0.808 -8.567 1.00 0.00 H new ATOM 0 HG23 THR A 123 5.236 -1.589 -10.157 1.00 0.00 H new ATOM 875 N ASN A 124 8.134 -1.106 -8.813 1.00 0.00 N ATOM 876 CA ASN A 124 8.716 0.209 -8.589 1.00 0.00 C ATOM 877 C ASN A 124 7.626 1.273 -8.627 1.00 0.00 C ATOM 878 O ASN A 124 7.423 1.935 -9.645 1.00 0.00 O ATOM 879 CB ASN A 124 9.783 0.509 -9.643 1.00 0.00 C ATOM 880 CG ASN A 124 11.188 0.245 -9.136 1.00 0.00 C ATOM 881 OD1 ASN A 124 11.917 -0.579 -9.691 1.00 0.00 O ATOM 882 ND2 ASN A 124 11.576 0.945 -8.077 1.00 0.00 N ATOM 0 H ASN A 124 8.410 -1.548 -9.690 1.00 0.00 H new ATOM 0 HA ASN A 124 9.189 0.219 -7.607 1.00 0.00 H new ATOM 0 HB2 ASN A 124 9.598 -0.101 -10.527 1.00 0.00 H new ATOM 0 HB3 ASN A 124 9.701 1.551 -9.952 1.00 0.00 H new ATOM 0 HD21 ASN A 124 12.511 0.811 -7.692 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.939 1.617 -7.649 1.00 0.00 H new ATOM 889 N VAL A 125 6.919 1.423 -7.513 1.00 0.00 N ATOM 890 CA VAL A 125 5.840 2.392 -7.414 1.00 0.00 C ATOM 891 C VAL A 125 6.363 3.822 -7.357 1.00 0.00 C ATOM 892 O VAL A 125 5.585 4.776 -7.365 1.00 0.00 O ATOM 893 CB VAL A 125 4.963 2.110 -6.186 1.00 0.00 C ATOM 894 CG1 VAL A 125 4.516 0.659 -6.185 1.00 0.00 C ATOM 895 CG2 VAL A 125 5.703 2.446 -4.906 1.00 0.00 C ATOM 0 H VAL A 125 7.077 0.882 -6.663 1.00 0.00 H new ATOM 0 HA VAL A 125 5.237 2.289 -8.316 1.00 0.00 H new ATOM 0 HB VAL A 125 4.079 2.746 -6.238 1.00 0.00 H new ATOM 0 HG11 VAL A 125 3.895 0.470 -5.310 1.00 0.00 H new ATOM 0 HG12 VAL A 125 3.942 0.455 -7.089 1.00 0.00 H new ATOM 0 HG13 VAL A 125 5.390 0.009 -6.156 1.00 0.00 H new ATOM 0 HG21 VAL A 125 5.062 2.238 -4.050 1.00 0.00 H new ATOM 0 HG22 VAL A 125 6.607 1.840 -4.838 1.00 0.00 H new ATOM 0 HG23 VAL A 125 5.974 3.502 -4.909 1.00 0.00 H new ATOM 905 N THR A 126 7.681 3.968 -7.297 1.00 0.00 N ATOM 906 CA THR A 126 8.294 5.284 -7.236 1.00 0.00 C ATOM 907 C THR A 126 8.468 5.884 -8.632 1.00 0.00 C ATOM 908 O THR A 126 9.484 6.515 -8.922 1.00 0.00 O ATOM 909 CB THR A 126 9.649 5.206 -6.530 1.00 0.00 C ATOM 910 OG1 THR A 126 10.278 3.963 -6.788 1.00 0.00 O ATOM 911 CG2 THR A 126 9.550 5.368 -5.029 1.00 0.00 C ATOM 0 H THR A 126 8.343 3.192 -7.289 1.00 0.00 H new ATOM 0 HA THR A 126 7.629 5.934 -6.668 1.00 0.00 H new ATOM 0 HB THR A 126 10.233 6.034 -6.931 1.00 0.00 H new ATOM 0 HG1 THR A 126 9.952 3.293 -6.151 1.00 0.00 H new ATOM 0 HG21 THR A 126 10.545 5.303 -4.590 1.00 0.00 H new ATOM 0 HG22 THR A 126 9.113 6.339 -4.796 1.00 0.00 H new ATOM 0 HG23 THR A 126 8.920 4.579 -4.619 1.00 0.00 H new ATOM 919 N ASN A 127 7.471 5.687 -9.494 1.00 0.00 N ATOM 920 CA ASN A 127 7.520 6.211 -10.855 1.00 0.00 C ATOM 921 C ASN A 127 6.116 6.347 -11.440 1.00 0.00 C ATOM 922 O ASN A 127 5.730 7.415 -11.912 1.00 0.00 O ATOM 923 CB ASN A 127 8.364 5.298 -11.748 1.00 0.00 C ATOM 924 CG ASN A 127 9.771 5.105 -11.217 1.00 0.00 C ATOM 925 OD1 ASN A 127 9.946 4.109 -10.355 1.00 0.00 O flip ATOM 926 ND2 ASN A 127 10.690 5.840 -11.576 1.00 0.00 N flip ATOM 0 H ASN A 127 6.621 5.169 -9.273 1.00 0.00 H new ATOM 0 HA ASN A 127 7.978 7.199 -10.817 1.00 0.00 H new ATOM 0 HB2 ASN A 127 7.876 4.327 -11.834 1.00 0.00 H new ATOM 0 HB3 ASN A 127 8.413 5.721 -12.751 1.00 0.00 H new ATOM 0 HD21 ASN A 127 10.511 6.593 -12.240 1.00 0.00 H new ATOM 0 HD22 ASN A 127 11.631 5.696 -11.209 1.00 0.00 H new ATOM 933 N HIS A 128 5.360 5.252 -11.411 1.00 0.00 N ATOM 934 CA HIS A 128 4.001 5.243 -11.944 1.00 0.00 C ATOM 935 C HIS A 128 3.035 5.956 -11.003 1.00 0.00 C ATOM 936 O HIS A 128 3.326 6.139 -9.822 1.00 0.00 O ATOM 937 CB HIS A 128 3.521 3.805 -12.168 1.00 0.00 C ATOM 938 CG HIS A 128 4.599 2.870 -12.621 1.00 0.00 C ATOM 939 ND1 HIS A 128 5.217 2.970 -13.850 1.00 0.00 N ATOM 940 CD2 HIS A 128 5.172 1.811 -11.999 1.00 0.00 C ATOM 941 CE1 HIS A 128 6.120 2.011 -13.966 1.00 0.00 C ATOM 942 NE2 HIS A 128 6.112 1.296 -12.857 1.00 0.00 N ATOM 0 H HIS A 128 5.666 4.359 -11.024 1.00 0.00 H new ATOM 0 HA HIS A 128 4.019 5.773 -12.896 1.00 0.00 H new ATOM 0 HB2 HIS A 128 3.092 3.427 -11.240 1.00 0.00 H new ATOM 0 HB3 HIS A 128 2.722 3.810 -12.910 1.00 0.00 H new ATOM 0 HD2 HIS A 128 4.934 1.441 -11.013 1.00 0.00 H new ATOM 0 HE1 HIS A 128 6.756 1.842 -14.822 1.00 0.00 H new ATOM 0 HE2 HIS A 128 6.708 0.490 -12.668 1.00 0.00 H new ATOM 951 N SER A 129 1.880 6.345 -11.535 1.00 0.00 N ATOM 952 CA SER A 129 0.867 7.024 -10.738 1.00 0.00 C ATOM 953 C SER A 129 0.252 6.061 -9.735 1.00 0.00 C ATOM 954 O SER A 129 0.295 4.847 -9.924 1.00 0.00 O ATOM 955 CB SER A 129 -0.230 7.595 -11.632 1.00 0.00 C ATOM 956 OG SER A 129 0.316 8.206 -12.789 1.00 0.00 O ATOM 0 H SER A 129 1.624 6.202 -12.512 1.00 0.00 H new ATOM 0 HA SER A 129 1.350 7.842 -10.204 1.00 0.00 H new ATOM 0 HB2 SER A 129 -0.914 6.799 -11.927 1.00 0.00 H new ATOM 0 HB3 SER A 129 -0.814 8.326 -11.073 1.00 0.00 H new ATOM 0 HG SER A 129 -0.409 8.562 -13.344 1.00 0.00 H new ATOM 962 N VAL A 130 -0.318 6.604 -8.670 1.00 0.00 N ATOM 963 CA VAL A 130 -0.932 5.779 -7.641 1.00 0.00 C ATOM 964 C VAL A 130 -2.043 4.907 -8.214 1.00 0.00 C ATOM 965 O VAL A 130 -2.226 3.771 -7.786 1.00 0.00 O ATOM 966 CB VAL A 130 -1.485 6.633 -6.490 1.00 0.00 C ATOM 967 CG1 VAL A 130 -2.545 7.599 -6.999 1.00 0.00 C ATOM 968 CG2 VAL A 130 -2.040 5.754 -5.377 1.00 0.00 C ATOM 0 H VAL A 130 -0.368 7.608 -8.496 1.00 0.00 H new ATOM 0 HA VAL A 130 -0.148 5.131 -7.248 1.00 0.00 H new ATOM 0 HB VAL A 130 -0.663 7.217 -6.076 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -2.924 8.194 -6.168 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -2.107 8.259 -7.748 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -3.365 7.037 -7.446 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -2.425 6.383 -4.574 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -2.846 5.134 -5.770 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -1.247 5.115 -4.988 1.00 0.00 H new ATOM 978 N ASP A 131 -2.773 5.433 -9.189 1.00 0.00 N ATOM 979 CA ASP A 131 -3.851 4.676 -9.816 1.00 0.00 C ATOM 980 C ASP A 131 -3.285 3.440 -10.499 1.00 0.00 C ATOM 981 O ASP A 131 -3.919 2.384 -10.528 1.00 0.00 O ATOM 982 CB ASP A 131 -4.599 5.543 -10.830 1.00 0.00 C ATOM 983 CG ASP A 131 -5.545 6.524 -10.165 1.00 0.00 C ATOM 984 OD1 ASP A 131 -5.110 7.222 -9.224 1.00 0.00 O ATOM 985 OD2 ASP A 131 -6.719 6.593 -10.584 1.00 0.00 O ATOM 0 H ASP A 131 -2.641 6.373 -9.561 1.00 0.00 H new ATOM 0 HA ASP A 131 -4.555 4.367 -9.044 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -3.878 6.092 -11.437 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -5.162 4.901 -11.507 1.00 0.00 H new ATOM 990 N GLN A 132 -2.078 3.577 -11.035 1.00 0.00 N ATOM 991 CA GLN A 132 -1.413 2.471 -11.704 1.00 0.00 C ATOM 992 C GLN A 132 -1.054 1.387 -10.697 1.00 0.00 C ATOM 993 O GLN A 132 -1.201 0.198 -10.973 1.00 0.00 O ATOM 994 CB GLN A 132 -0.152 2.959 -12.420 1.00 0.00 C ATOM 995 CG GLN A 132 -0.426 3.994 -13.499 1.00 0.00 C ATOM 996 CD GLN A 132 0.634 4.003 -14.582 1.00 0.00 C ATOM 997 OE1 GLN A 132 1.136 2.954 -14.984 1.00 0.00 O ATOM 998 NE2 GLN A 132 0.982 5.192 -15.061 1.00 0.00 N ATOM 0 H GLN A 132 -1.542 4.444 -11.018 1.00 0.00 H new ATOM 0 HA GLN A 132 -2.096 2.054 -12.445 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.531 3.385 -11.685 1.00 0.00 H new ATOM 0 HB3 GLN A 132 0.355 2.104 -12.868 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.398 3.795 -13.949 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -0.482 4.982 -13.043 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.540 6.037 -14.699 1.00 0.00 H new ATOM 0 HE22 GLN A 132 1.691 5.260 -15.791 1.00 0.00 H new ATOM 1007 N LEU A 133 -0.587 1.808 -9.522 1.00 0.00 N ATOM 1008 CA LEU A 133 -0.210 0.871 -8.471 1.00 0.00 C ATOM 1009 C LEU A 133 -1.438 0.233 -7.843 1.00 0.00 C ATOM 1010 O LEU A 133 -1.491 -0.983 -7.668 1.00 0.00 O ATOM 1011 CB LEU A 133 0.601 1.565 -7.390 1.00 0.00 C ATOM 1012 CG LEU A 133 2.016 1.959 -7.785 1.00 0.00 C ATOM 1013 CD1 LEU A 133 2.701 0.844 -8.565 1.00 0.00 C ATOM 1014 CD2 LEU A 133 1.974 3.229 -8.592 1.00 0.00 C ATOM 0 H LEU A 133 -0.462 2.790 -9.277 1.00 0.00 H new ATOM 0 HA LEU A 133 0.399 0.094 -8.933 1.00 0.00 H new ATOM 0 HB2 LEU A 133 0.066 2.462 -7.078 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.654 0.908 -6.522 1.00 0.00 H new ATOM 0 HG LEU A 133 2.600 2.128 -6.880 1.00 0.00 H new ATOM 0 HD11 LEU A 133 3.711 1.155 -8.833 1.00 0.00 H new ATOM 0 HD12 LEU A 133 2.750 -0.054 -7.949 1.00 0.00 H new ATOM 0 HD13 LEU A 133 2.134 0.632 -9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 133 2.987 3.513 -8.876 1.00 0.00 H new ATOM 0 HD22 LEU A 133 1.376 3.070 -9.490 1.00 0.00 H new ATOM 0 HD23 LEU A 133 1.528 4.025 -7.995 1.00 0.00 H new ATOM 1026 N GLN A 134 -2.430 1.060 -7.509 1.00 0.00 N ATOM 1027 CA GLN A 134 -3.664 0.565 -6.910 1.00 0.00 C ATOM 1028 C GLN A 134 -4.147 -0.647 -7.691 1.00 0.00 C ATOM 1029 O GLN A 134 -4.422 -1.706 -7.124 1.00 0.00 O ATOM 1030 CB GLN A 134 -4.735 1.659 -6.902 1.00 0.00 C ATOM 1031 CG GLN A 134 -4.519 2.712 -5.824 1.00 0.00 C ATOM 1032 CD GLN A 134 -4.636 2.145 -4.423 1.00 0.00 C ATOM 1033 OE1 GLN A 134 -3.501 1.796 -3.830 1.00 0.00 O flip ATOM 1034 NE2 GLN A 134 -5.734 2.022 -3.880 1.00 0.00 N flip ATOM 0 H GLN A 134 -2.401 2.071 -7.644 1.00 0.00 H new ATOM 0 HA GLN A 134 -3.472 0.276 -5.877 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -4.752 2.147 -7.877 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -5.712 1.199 -6.758 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -3.533 3.158 -5.950 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -5.249 3.511 -5.951 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -6.581 2.303 -4.373 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -5.796 1.639 -2.937 1.00 0.00 H new ATOM 1043 N LYS A 135 -4.199 -0.493 -9.009 1.00 0.00 N ATOM 1044 CA LYS A 135 -4.595 -1.586 -9.875 1.00 0.00 C ATOM 1045 C LYS A 135 -3.461 -2.606 -9.939 1.00 0.00 C ATOM 1046 O LYS A 135 -3.700 -3.810 -10.049 1.00 0.00 O ATOM 1047 CB LYS A 135 -4.938 -1.072 -11.272 1.00 0.00 C ATOM 1048 CG LYS A 135 -5.264 -2.179 -12.258 1.00 0.00 C ATOM 1049 CD LYS A 135 -4.051 -2.544 -13.094 1.00 0.00 C ATOM 1050 CE LYS A 135 -4.437 -2.862 -14.529 1.00 0.00 C ATOM 1051 NZ LYS A 135 -3.277 -2.744 -15.455 1.00 0.00 N ATOM 0 H LYS A 135 -3.972 0.375 -9.495 1.00 0.00 H new ATOM 0 HA LYS A 135 -5.488 -2.062 -9.470 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -5.789 -0.395 -11.203 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -4.098 -0.491 -11.654 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -5.615 -3.059 -11.718 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -6.077 -1.860 -12.911 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -3.339 -1.719 -13.082 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -3.549 -3.405 -12.652 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -4.841 -3.873 -14.581 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -5.229 -2.185 -14.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -3.582 -2.969 -16.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -2.906 -1.773 -15.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -2.531 -3.408 -15.164 1.00 0.00 H new ATOM 1065 N ALA A 136 -2.223 -2.113 -9.842 1.00 0.00 N ATOM 1066 CA ALA A 136 -1.049 -2.981 -9.859 1.00 0.00 C ATOM 1067 C ALA A 136 -1.113 -3.975 -8.707 1.00 0.00 C ATOM 1068 O ALA A 136 -0.624 -5.100 -8.811 1.00 0.00 O ATOM 1069 CB ALA A 136 0.223 -2.156 -9.764 1.00 0.00 C ATOM 0 H ALA A 136 -2.011 -1.119 -9.751 1.00 0.00 H new ATOM 0 HA ALA A 136 -1.039 -3.530 -10.800 1.00 0.00 H new ATOM 0 HB1 ALA A 136 1.088 -2.819 -9.778 1.00 0.00 H new ATOM 0 HB2 ALA A 136 0.277 -1.471 -10.610 1.00 0.00 H new ATOM 0 HB3 ALA A 136 0.218 -1.585 -8.835 1.00 0.00 H new ATOM 1075 N MET A 137 -1.738 -3.552 -7.615 1.00 0.00 N ATOM 1076 CA MET A 137 -1.895 -4.402 -6.448 1.00 0.00 C ATOM 1077 C MET A 137 -2.960 -5.445 -6.742 1.00 0.00 C ATOM 1078 O MET A 137 -2.762 -6.639 -6.516 1.00 0.00 O ATOM 1079 CB MET A 137 -2.289 -3.572 -5.225 1.00 0.00 C ATOM 1080 CG MET A 137 -1.221 -2.581 -4.793 1.00 0.00 C ATOM 1081 SD MET A 137 -1.159 -2.360 -3.005 1.00 0.00 S ATOM 1082 CE MET A 137 -0.803 -0.608 -2.892 1.00 0.00 C ATOM 0 H MET A 137 -2.145 -2.622 -7.516 1.00 0.00 H new ATOM 0 HA MET A 137 -0.948 -4.894 -6.228 1.00 0.00 H new ATOM 0 HB2 MET A 137 -3.208 -3.030 -5.445 1.00 0.00 H new ATOM 0 HB3 MET A 137 -2.506 -4.244 -4.395 1.00 0.00 H new ATOM 0 HG2 MET A 137 -0.249 -2.924 -5.146 1.00 0.00 H new ATOM 0 HG3 MET A 137 -1.411 -1.618 -5.268 1.00 0.00 H new ATOM 0 HE1 MET A 137 -0.839 -0.296 -1.848 1.00 0.00 H new ATOM 0 HE2 MET A 137 0.191 -0.412 -3.295 1.00 0.00 H new ATOM 0 HE3 MET A 137 -1.543 -0.049 -3.464 1.00 0.00 H new ATOM 1092 N LYS A 138 -4.081 -4.977 -7.284 1.00 0.00 N ATOM 1093 CA LYS A 138 -5.176 -5.860 -7.656 1.00 0.00 C ATOM 1094 C LYS A 138 -4.736 -6.780 -8.793 1.00 0.00 C ATOM 1095 O LYS A 138 -5.302 -7.854 -8.999 1.00 0.00 O ATOM 1096 CB LYS A 138 -6.392 -5.040 -8.092 1.00 0.00 C ATOM 1097 CG LYS A 138 -6.818 -3.998 -7.072 1.00 0.00 C ATOM 1098 CD LYS A 138 -8.037 -3.223 -7.544 1.00 0.00 C ATOM 1099 CE LYS A 138 -8.144 -1.876 -6.848 1.00 0.00 C ATOM 1100 NZ LYS A 138 -8.675 -0.821 -7.755 1.00 0.00 N ATOM 0 H LYS A 138 -4.252 -3.990 -7.474 1.00 0.00 H new ATOM 0 HA LYS A 138 -5.451 -6.464 -6.791 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -6.165 -4.542 -9.035 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -7.227 -5.715 -8.280 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -7.041 -4.486 -6.123 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -5.995 -3.307 -6.890 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -7.979 -3.073 -8.622 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -8.937 -3.806 -7.351 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -8.795 -1.968 -5.978 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -7.162 -1.578 -6.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -8.732 0.082 -7.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -8.041 -0.715 -8.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -9.623 -1.092 -8.085 1.00 0.00 H new ATOM 1114 N GLU A 139 -3.712 -6.339 -9.523 1.00 0.00 N ATOM 1115 CA GLU A 139 -3.167 -7.097 -10.642 1.00 0.00 C ATOM 1116 C GLU A 139 -2.812 -8.522 -10.221 1.00 0.00 C ATOM 1117 O GLU A 139 -3.365 -9.491 -10.740 1.00 0.00 O ATOM 1118 CB GLU A 139 -1.928 -6.386 -11.185 1.00 0.00 C ATOM 1119 CG GLU A 139 -2.063 -5.953 -12.634 1.00 0.00 C ATOM 1120 CD GLU A 139 -0.805 -6.209 -13.440 1.00 0.00 C ATOM 1121 OE1 GLU A 139 0.226 -5.565 -13.153 1.00 0.00 O ATOM 1122 OE2 GLU A 139 -0.850 -7.055 -14.358 1.00 0.00 O ATOM 0 H GLU A 139 -3.241 -5.450 -9.354 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.926 -7.157 -11.422 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -1.723 -5.510 -10.570 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -1.068 -7.049 -11.091 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -2.897 -6.484 -13.092 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.303 -4.890 -12.671 1.00 0.00 H new ATOM 1129 N THR A 140 -1.882 -8.637 -9.279 1.00 0.00 N ATOM 1130 CA THR A 140 -1.444 -9.938 -8.785 1.00 0.00 C ATOM 1131 C THR A 140 -2.572 -10.655 -8.050 1.00 0.00 C ATOM 1132 O THR A 140 -3.543 -10.031 -7.624 1.00 0.00 O ATOM 1133 CB THR A 140 -0.238 -9.777 -7.859 1.00 0.00 C ATOM 1134 OG1 THR A 140 0.430 -8.553 -8.111 1.00 0.00 O ATOM 1135 CG2 THR A 140 0.776 -10.892 -8.002 1.00 0.00 C ATOM 0 H THR A 140 -1.416 -7.843 -8.841 1.00 0.00 H new ATOM 0 HA THR A 140 -1.156 -10.543 -9.645 1.00 0.00 H new ATOM 0 HB THR A 140 -0.644 -9.802 -6.848 1.00 0.00 H new ATOM 0 HG1 THR A 140 0.906 -8.268 -7.303 1.00 0.00 H new ATOM 0 HG21 THR A 140 1.607 -10.718 -7.318 1.00 0.00 H new ATOM 0 HG22 THR A 140 0.304 -11.846 -7.765 1.00 0.00 H new ATOM 0 HG23 THR A 140 1.148 -10.916 -9.026 1.00 0.00 H new ATOM 1143 N LYS A 141 -2.434 -11.973 -7.912 1.00 0.00 N ATOM 1144 CA LYS A 141 -3.436 -12.796 -7.234 1.00 0.00 C ATOM 1145 C LYS A 141 -3.971 -12.111 -5.977 1.00 0.00 C ATOM 1146 O LYS A 141 -5.181 -11.946 -5.820 1.00 0.00 O ATOM 1147 CB LYS A 141 -2.841 -14.158 -6.870 1.00 0.00 C ATOM 1148 CG LYS A 141 -1.461 -14.073 -6.237 1.00 0.00 C ATOM 1149 CD LYS A 141 -0.519 -15.121 -6.807 1.00 0.00 C ATOM 1150 CE LYS A 141 0.935 -14.769 -6.537 1.00 0.00 C ATOM 1151 NZ LYS A 141 1.534 -13.987 -7.654 1.00 0.00 N ATOM 0 H LYS A 141 -1.632 -12.497 -8.263 1.00 0.00 H new ATOM 0 HA LYS A 141 -4.270 -12.935 -7.922 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -3.516 -14.667 -6.182 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -2.781 -14.771 -7.770 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -1.044 -13.080 -6.403 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -1.546 -14.207 -5.159 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -0.747 -16.093 -6.369 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -0.679 -15.210 -7.881 1.00 0.00 H new ATOM 0 HE2 LYS A 141 1.004 -14.194 -5.614 1.00 0.00 H new ATOM 0 HE3 LYS A 141 1.508 -15.684 -6.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 2.254 -14.563 -8.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 0.791 -13.726 -8.333 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 1.976 -13.125 -7.276 1.00 0.00 H new ATOM 1165 N GLY A 142 -3.067 -11.714 -5.087 1.00 0.00 N ATOM 1166 CA GLY A 142 -3.482 -11.054 -3.863 1.00 0.00 C ATOM 1167 C GLY A 142 -2.332 -10.798 -2.908 1.00 0.00 C ATOM 1168 O GLY A 142 -2.298 -9.767 -2.234 1.00 0.00 O ATOM 0 H GLY A 142 -2.060 -11.837 -5.191 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -3.958 -10.106 -4.112 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -4.233 -11.666 -3.363 1.00 0.00 H new ATOM 1172 N MET A 143 -1.394 -11.735 -2.840 1.00 0.00 N ATOM 1173 CA MET A 143 -0.245 -11.599 -1.951 1.00 0.00 C ATOM 1174 C MET A 143 0.629 -10.418 -2.363 1.00 0.00 C ATOM 1175 O MET A 143 1.384 -10.504 -3.331 1.00 0.00 O ATOM 1176 CB MET A 143 0.584 -12.884 -1.954 1.00 0.00 C ATOM 1177 CG MET A 143 -0.169 -14.094 -1.424 1.00 0.00 C ATOM 1178 SD MET A 143 -0.832 -13.830 0.231 1.00 0.00 S ATOM 1179 CE MET A 143 0.529 -14.414 1.238 1.00 0.00 C ATOM 0 H MET A 143 -1.405 -12.595 -3.388 1.00 0.00 H new ATOM 0 HA MET A 143 -0.619 -11.417 -0.944 1.00 0.00 H new ATOM 0 HB2 MET A 143 0.916 -13.090 -2.971 1.00 0.00 H new ATOM 0 HB3 MET A 143 1.479 -12.731 -1.351 1.00 0.00 H new ATOM 0 HG2 MET A 143 -0.986 -14.335 -2.104 1.00 0.00 H new ATOM 0 HG3 MET A 143 0.499 -14.955 -1.410 1.00 0.00 H new ATOM 0 HE1 MET A 143 0.270 -14.315 2.292 1.00 0.00 H new ATOM 0 HE2 MET A 143 0.727 -15.461 1.010 1.00 0.00 H new ATOM 0 HE3 MET A 143 1.419 -13.822 1.026 1.00 0.00 H new ATOM 1189 N ILE A 144 0.527 -9.315 -1.624 1.00 0.00 N ATOM 1190 CA ILE A 144 1.318 -8.126 -1.925 1.00 0.00 C ATOM 1191 C ILE A 144 2.263 -7.778 -0.787 1.00 0.00 C ATOM 1192 O ILE A 144 1.913 -7.889 0.389 1.00 0.00 O ATOM 1193 CB ILE A 144 0.434 -6.898 -2.221 1.00 0.00 C ATOM 1194 CG1 ILE A 144 -0.570 -7.223 -3.322 1.00 0.00 C ATOM 1195 CG2 ILE A 144 1.288 -5.700 -2.617 1.00 0.00 C ATOM 1196 CD1 ILE A 144 0.067 -7.771 -4.579 1.00 0.00 C ATOM 0 H ILE A 144 -0.091 -9.221 -0.818 1.00 0.00 H new ATOM 0 HA ILE A 144 1.895 -8.372 -2.817 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.112 -6.641 -1.313 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -1.290 -7.949 -2.943 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -1.128 -6.321 -3.571 1.00 0.00 H new ATOM 0 HG21 ILE A 144 0.643 -4.845 -2.821 1.00 0.00 H new ATOM 0 HG22 ILE A 144 1.970 -5.454 -1.803 1.00 0.00 H new ATOM 0 HG23 ILE A 144 1.863 -5.943 -3.511 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -0.707 -7.979 -5.318 1.00 0.00 H new ATOM 0 HD12 ILE A 144 0.766 -7.038 -4.982 1.00 0.00 H new ATOM 0 HD13 ILE A 144 0.602 -8.691 -4.344 1.00 0.00 H new ATOM 1208 N SER A 145 3.455 -7.339 -1.166 1.00 0.00 N ATOM 1209 CA SER A 145 4.490 -6.939 -0.219 1.00 0.00 C ATOM 1210 C SER A 145 4.873 -5.484 -0.466 1.00 0.00 C ATOM 1211 O SER A 145 5.628 -5.184 -1.390 1.00 0.00 O ATOM 1212 CB SER A 145 5.716 -7.838 -0.371 1.00 0.00 C ATOM 1213 OG SER A 145 6.769 -7.417 0.479 1.00 0.00 O ATOM 0 H SER A 145 3.734 -7.249 -2.143 1.00 0.00 H new ATOM 0 HA SER A 145 4.106 -7.041 0.796 1.00 0.00 H new ATOM 0 HB2 SER A 145 5.446 -8.868 -0.137 1.00 0.00 H new ATOM 0 HB3 SER A 145 6.054 -7.824 -1.407 1.00 0.00 H new ATOM 0 HG SER A 145 7.588 -7.904 0.251 1.00 0.00 H new ATOM 1219 N LEU A 146 4.331 -4.583 0.343 1.00 0.00 N ATOM 1220 CA LEU A 146 4.601 -3.159 0.181 1.00 0.00 C ATOM 1221 C LEU A 146 5.781 -2.707 1.018 1.00 0.00 C ATOM 1222 O LEU A 146 5.827 -2.936 2.226 1.00 0.00 O ATOM 1223 CB LEU A 146 3.377 -2.333 0.569 1.00 0.00 C ATOM 1224 CG LEU A 146 2.059 -2.787 -0.064 1.00 0.00 C ATOM 1225 CD1 LEU A 146 1.046 -3.152 1.009 1.00 0.00 C ATOM 1226 CD2 LEU A 146 1.505 -1.703 -0.980 1.00 0.00 C ATOM 0 H LEU A 146 3.704 -4.811 1.115 1.00 0.00 H new ATOM 0 HA LEU A 146 4.840 -3.002 -0.871 1.00 0.00 H new ATOM 0 HB2 LEU A 146 3.269 -2.359 1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 146 3.556 -1.294 0.292 1.00 0.00 H new ATOM 0 HG LEU A 146 2.255 -3.676 -0.664 1.00 0.00 H new ATOM 0 HD11 LEU A 146 0.116 -3.472 0.538 1.00 0.00 H new ATOM 0 HD12 LEU A 146 1.441 -3.963 1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 146 0.854 -2.283 1.638 1.00 0.00 H new ATOM 0 HD21 LEU A 146 0.568 -2.043 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 146 1.326 -0.796 -0.403 1.00 0.00 H new ATOM 0 HD23 LEU A 146 2.224 -1.494 -1.772 1.00 0.00 H new ATOM 1238 N LYS A 147 6.716 -2.031 0.366 1.00 0.00 N ATOM 1239 CA LYS A 147 7.892 -1.503 1.041 1.00 0.00 C ATOM 1240 C LYS A 147 7.608 -0.083 1.505 1.00 0.00 C ATOM 1241 O LYS A 147 7.189 0.765 0.718 1.00 0.00 O ATOM 1242 CB LYS A 147 9.108 -1.524 0.114 1.00 0.00 C ATOM 1243 CG LYS A 147 9.544 -2.924 -0.288 1.00 0.00 C ATOM 1244 CD LYS A 147 11.058 -3.034 -0.381 1.00 0.00 C ATOM 1245 CE LYS A 147 11.579 -4.247 0.371 1.00 0.00 C ATOM 1246 NZ LYS A 147 11.870 -5.386 -0.544 1.00 0.00 N ATOM 0 H LYS A 147 6.682 -1.835 -0.634 1.00 0.00 H new ATOM 0 HA LYS A 147 8.117 -2.131 1.903 1.00 0.00 H new ATOM 0 HB2 LYS A 147 8.879 -0.952 -0.785 1.00 0.00 H new ATOM 0 HB3 LYS A 147 9.940 -1.022 0.608 1.00 0.00 H new ATOM 0 HG2 LYS A 147 9.170 -3.645 0.439 1.00 0.00 H new ATOM 0 HG3 LYS A 147 9.100 -3.182 -1.250 1.00 0.00 H new ATOM 0 HD2 LYS A 147 11.355 -3.099 -1.428 1.00 0.00 H new ATOM 0 HD3 LYS A 147 11.514 -2.131 0.024 1.00 0.00 H new ATOM 0 HE2 LYS A 147 12.485 -3.976 0.913 1.00 0.00 H new ATOM 0 HE3 LYS A 147 10.844 -4.557 1.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 12.223 -6.193 0.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 11.000 -5.662 -1.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 12.590 -5.099 -1.237 1.00 0.00 H new ATOM 1260 N VAL A 148 7.811 0.166 2.789 1.00 0.00 N ATOM 1261 CA VAL A 148 7.546 1.479 3.353 1.00 0.00 C ATOM 1262 C VAL A 148 8.608 1.873 4.370 1.00 0.00 C ATOM 1263 O VAL A 148 9.244 1.017 4.985 1.00 0.00 O ATOM 1264 CB VAL A 148 6.163 1.522 4.038 1.00 0.00 C ATOM 1265 CG1 VAL A 148 5.599 2.932 4.021 1.00 0.00 C ATOM 1266 CG2 VAL A 148 5.194 0.545 3.379 1.00 0.00 C ATOM 0 H VAL A 148 8.157 -0.522 3.458 1.00 0.00 H new ATOM 0 HA VAL A 148 7.564 2.186 2.524 1.00 0.00 H new ATOM 0 HB VAL A 148 6.293 1.217 5.076 1.00 0.00 H new ATOM 0 HG11 VAL A 148 4.624 2.940 4.509 1.00 0.00 H new ATOM 0 HG12 VAL A 148 6.276 3.601 4.552 1.00 0.00 H new ATOM 0 HG13 VAL A 148 5.492 3.269 2.990 1.00 0.00 H new ATOM 0 HG21 VAL A 148 4.228 0.596 3.881 1.00 0.00 H new ATOM 0 HG22 VAL A 148 5.071 0.808 2.328 1.00 0.00 H new ATOM 0 HG23 VAL A 148 5.590 -0.468 3.456 1.00 0.00 H new ATOM 1276 N ILE A 149 8.787 3.175 4.545 1.00 0.00 N ATOM 1277 CA ILE A 149 9.765 3.692 5.490 1.00 0.00 C ATOM 1278 C ILE A 149 9.066 4.263 6.726 1.00 0.00 C ATOM 1279 O ILE A 149 7.898 4.644 6.665 1.00 0.00 O ATOM 1280 CB ILE A 149 10.660 4.771 4.825 1.00 0.00 C ATOM 1281 CG1 ILE A 149 12.097 4.261 4.698 1.00 0.00 C ATOM 1282 CG2 ILE A 149 10.625 6.087 5.598 1.00 0.00 C ATOM 1283 CD1 ILE A 149 12.751 4.620 3.381 1.00 0.00 C ATOM 0 H ILE A 149 8.266 3.894 4.043 1.00 0.00 H new ATOM 0 HA ILE A 149 10.404 2.866 5.803 1.00 0.00 H new ATOM 0 HB ILE A 149 10.263 4.966 3.829 1.00 0.00 H new ATOM 0 HG12 ILE A 149 12.693 4.670 5.514 1.00 0.00 H new ATOM 0 HG13 ILE A 149 12.101 3.177 4.813 1.00 0.00 H new ATOM 0 HG21 ILE A 149 11.264 6.818 5.102 1.00 0.00 H new ATOM 0 HG22 ILE A 149 9.602 6.462 5.631 1.00 0.00 H new ATOM 0 HG23 ILE A 149 10.984 5.922 6.614 1.00 0.00 H new ATOM 0 HD11 ILE A 149 13.767 4.227 3.360 1.00 0.00 H new ATOM 0 HD12 ILE A 149 12.178 4.188 2.561 1.00 0.00 H new ATOM 0 HD13 ILE A 149 12.779 5.704 3.272 1.00 0.00 H new ATOM 1295 N PRO A 150 9.775 4.332 7.866 1.00 0.00 N ATOM 1296 CA PRO A 150 9.216 4.862 9.112 1.00 0.00 C ATOM 1297 C PRO A 150 8.546 6.216 8.906 1.00 0.00 C ATOM 1298 O PRO A 150 9.086 7.089 8.224 1.00 0.00 O ATOM 1299 CB PRO A 150 10.433 4.996 10.042 1.00 0.00 C ATOM 1300 CG PRO A 150 11.632 4.768 9.177 1.00 0.00 C ATOM 1301 CD PRO A 150 11.170 3.910 8.037 1.00 0.00 C ATOM 0 HA PRO A 150 8.439 4.212 9.515 1.00 0.00 H new ATOM 0 HB2 PRO A 150 10.466 5.983 10.504 1.00 0.00 H new ATOM 0 HB3 PRO A 150 10.390 4.267 10.851 1.00 0.00 H new ATOM 0 HG2 PRO A 150 12.035 5.713 8.814 1.00 0.00 H new ATOM 0 HG3 PRO A 150 12.428 4.276 9.737 1.00 0.00 H new ATOM 0 HD2 PRO A 150 11.759 4.081 7.136 1.00 0.00 H new ATOM 0 HD3 PRO A 150 11.247 2.848 8.271 1.00 0.00 H new ATOM 1309 N ASN A 151 7.366 6.384 9.492 1.00 0.00 N ATOM 1310 CA ASN A 151 6.621 7.634 9.362 1.00 0.00 C ATOM 1311 C ASN A 151 6.978 8.624 10.470 1.00 0.00 C ATOM 1312 O ASN A 151 6.205 9.532 10.773 1.00 0.00 O ATOM 1313 CB ASN A 151 5.110 7.352 9.356 1.00 0.00 C ATOM 1314 CG ASN A 151 4.489 7.362 10.744 1.00 0.00 C ATOM 1315 OD1 ASN A 151 5.201 6.812 11.721 1.00 0.00 O flip ATOM 1316 ND2 ASN A 151 3.379 7.861 10.933 1.00 0.00 N flip ATOM 0 H ASN A 151 6.904 5.674 10.060 1.00 0.00 H new ATOM 0 HA ASN A 151 6.901 8.092 8.413 1.00 0.00 H new ATOM 0 HB2 ASN A 151 4.611 8.098 8.737 1.00 0.00 H new ATOM 0 HB3 ASN A 151 4.931 6.382 8.893 1.00 0.00 H new ATOM 0 HD21 ASN A 151 2.866 8.273 10.154 1.00 0.00 H new ATOM 0 HD22 ASN A 151 2.973 7.862 11.869 1.00 0.00 H new ATOM 1323 N GLN A 152 8.155 8.450 11.066 1.00 0.00 N ATOM 1324 CA GLN A 152 8.619 9.330 12.133 1.00 0.00 C ATOM 1325 C GLN A 152 7.543 9.537 13.197 1.00 0.00 C ATOM 1326 O GLN A 152 6.635 10.351 13.029 1.00 0.00 O ATOM 1327 CB GLN A 152 9.048 10.676 11.554 1.00 0.00 C ATOM 1328 CG GLN A 152 10.525 10.734 11.198 1.00 0.00 C ATOM 1329 CD GLN A 152 10.765 11.187 9.771 1.00 0.00 C ATOM 1330 OE1 GLN A 152 10.746 12.382 9.475 1.00 0.00 O ATOM 1331 NE2 GLN A 152 10.992 10.232 8.877 1.00 0.00 N ATOM 0 H GLN A 152 8.807 7.703 10.826 1.00 0.00 H new ATOM 0 HA GLN A 152 9.475 8.852 12.611 1.00 0.00 H new ATOM 0 HB2 GLN A 152 8.458 10.885 10.662 1.00 0.00 H new ATOM 0 HB3 GLN A 152 8.824 11.462 12.275 1.00 0.00 H new ATOM 0 HG2 GLN A 152 11.033 11.415 11.881 1.00 0.00 H new ATOM 0 HG3 GLN A 152 10.968 9.749 11.342 1.00 0.00 H new ATOM 0 HE21 GLN A 152 10.999 9.254 9.166 1.00 0.00 H new ATOM 0 HE22 GLN A 152 11.160 10.476 7.901 1.00 0.00 H new ATOM 1340 N GLN A 153 7.655 8.795 14.293 1.00 0.00 N ATOM 1341 CA GLN A 153 6.695 8.897 15.387 1.00 0.00 C ATOM 1342 C GLN A 153 5.303 8.476 14.929 1.00 0.00 C ATOM 1343 O GLN A 153 4.497 8.064 15.789 1.00 0.00 O ATOM 1344 CB GLN A 153 6.656 10.327 15.928 1.00 0.00 C ATOM 1345 CG GLN A 153 6.276 10.412 17.397 1.00 0.00 C ATOM 1346 CD GLN A 153 5.434 11.633 17.711 1.00 0.00 C ATOM 1347 OE1 GLN A 153 5.470 12.629 16.988 1.00 0.00 O ATOM 1348 NE2 GLN A 153 4.669 11.562 18.793 1.00 0.00 N ATOM 1349 OXT GLN A 153 5.030 8.561 13.713 1.00 0.00 O ATOM 0 H GLN A 153 8.401 8.116 14.448 1.00 0.00 H new ATOM 0 HA GLN A 153 7.015 8.224 16.183 1.00 0.00 H new ATOM 0 HB2 GLN A 153 7.634 10.786 15.787 1.00 0.00 H new ATOM 0 HB3 GLN A 153 5.944 10.909 15.343 1.00 0.00 H new ATOM 0 HG2 GLN A 153 5.727 9.514 17.679 1.00 0.00 H new ATOM 0 HG3 GLN A 153 7.182 10.435 18.002 1.00 0.00 H new ATOM 0 HE21 GLN A 153 4.670 10.717 19.364 1.00 0.00 H new ATOM 0 HE22 GLN A 153 4.080 12.353 19.054 1.00 0.00 H new TER 1358 GLN A 153