USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1036 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 64 HIS :FLIP no HD1:sc=-0.00238 F(o=-3.8,f=-3) USER MOD Set 1.2: A 65 THR OG1 : rot 90:sc= -1.56! USER MOD Set 1.3: A 68 ASN : amide:sc= 0.0248 K(o=-3,f=-4.3) USER MOD Set 1.4: A 118 SER OG : rot 108:sc= -0.345 USER MOD Set 1.5: A 122 LYS NZ :NH3+ -176:sc= -1.1 (180deg=-1.19) USER MOD Set 2.1: A 79 LYS NZ :NH3+ -161:sc= -2.27! (180deg=-2.52!) USER MOD Set 2.2: A 81 THR OG1 : rot -43:sc= 0.73 USER MOD Set 3.1: A 45 HIS : no HE2:sc= 0.143 X(o=0.27,f=-0.15) USER MOD Set 3.2: A 48 LYS NZ :NH3+ -179:sc= 0.129 (180deg=0) USER MOD Set 4.1: A 34 MET CE :methyl -123:sc= -2.44! (180deg=-3.31!) USER MOD Set 4.2: A 38 ASN : amide:sc= -3.81! C(o=-6.3!,f=-12!) USER MOD Set 5.1: A 13 THR OG1 : rot 94:sc= 0.3 USER MOD Set 5.2: A 50 MET CE :methyl -179:sc= -0.772 (180deg=-0.783) USER MOD Single : A 1 MET CE :methyl -173:sc= 0 (180deg=-0.0398) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.99!) USER MOD Single : A 19 ASN : amide:sc= -0.292 K(o=-0.29,f=-2.5!) USER MOD Single : A 21 ASN :FLIP amide:sc= -0.0854 F(o=-3.5!,f=-0.085) USER MOD Single : A 23 THR OG1 : rot 125:sc= 0.949 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -1.24 X(o=-1.2,f=-1.3) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 173:sc= -2.98 (180deg=-3.2) USER MOD Single : A 57 SER OG : rot 180:sc= 0.0345 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl 131:sc= -8.55! (180deg=-11.3!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -115:sc= -0.127 (180deg=-0.929) USER MOD Single : A 75 ASN : amide:sc= -0.188 K(o=-0.19,f=-0.97) USER MOD Single : A 76 SER OG : rot 3:sc= 0.521 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl -171:sc= -0.752 (180deg=-1.21) USER MOD Single : A 96 THR OG1 : rot 90:sc= 1.25 USER MOD Single : A 98 MET CE :methyl -179:sc= -1.65 (180deg=-1.69) USER MOD Single : A 101 LYS NZ :NH3+ -157:sc=-0.00318 (180deg=-0.325) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.627 K(o=-0.63,f=-1.9!) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 88:sc= 2.24 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.546 -31.034 -0.877 1.00 0.00 N ATOM 2 CA MET A 1 8.181 -29.821 -0.284 1.00 0.00 C ATOM 3 C MET A 1 8.098 -28.648 -1.266 1.00 0.00 C ATOM 4 O MET A 1 9.095 -28.051 -1.622 1.00 0.00 O ATOM 5 CB MET A 1 9.638 -30.217 -0.041 1.00 0.00 C ATOM 6 CG MET A 1 9.990 -29.990 1.429 1.00 0.00 C ATOM 7 SD MET A 1 11.731 -29.513 1.568 1.00 0.00 S ATOM 8 CE MET A 1 12.439 -31.143 1.216 1.00 0.00 C ATOM 0 H1 MET A 1 7.608 -31.823 -0.203 1.00 0.00 H new ATOM 0 H2 MET A 1 6.547 -30.835 -1.087 1.00 0.00 H new ATOM 0 H3 MET A 1 8.040 -31.290 -1.756 1.00 0.00 H new ATOM 0 HA MET A 1 7.687 -29.501 0.634 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.790 -31.264 -0.305 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.297 -29.628 -0.679 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.354 -29.211 1.850 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.804 -30.898 2.003 1.00 0.00 H new ATOM 0 HE1 MET A 1 13.517 -31.112 1.371 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.997 -31.883 1.883 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.229 -31.415 0.182 1.00 0.00 H new ATOM 20 N MET A 2 6.915 -28.314 -1.707 1.00 0.00 N ATOM 21 CA MET A 2 6.768 -27.182 -2.668 1.00 0.00 C ATOM 22 C MET A 2 5.913 -26.069 -2.054 1.00 0.00 C ATOM 23 O MET A 2 5.149 -25.415 -2.736 1.00 0.00 O ATOM 24 CB MET A 2 6.068 -27.786 -3.886 1.00 0.00 C ATOM 25 CG MET A 2 6.682 -27.215 -5.165 1.00 0.00 C ATOM 26 SD MET A 2 5.851 -25.666 -5.594 1.00 0.00 S ATOM 27 CE MET A 2 6.178 -25.718 -7.372 1.00 0.00 C ATOM 0 H MET A 2 6.044 -28.776 -1.444 1.00 0.00 H new ATOM 0 HA MET A 2 7.728 -26.735 -2.928 1.00 0.00 H new ATOM 0 HB2 MET A 2 6.169 -28.871 -3.875 1.00 0.00 H new ATOM 0 HB3 MET A 2 5.001 -27.565 -3.852 1.00 0.00 H new ATOM 0 HG2 MET A 2 7.748 -27.041 -5.023 1.00 0.00 H new ATOM 0 HG3 MET A 2 6.582 -27.932 -5.980 1.00 0.00 H new ATOM 0 HE1 MET A 2 5.745 -24.838 -7.848 1.00 0.00 H new ATOM 0 HE2 MET A 2 7.254 -25.730 -7.544 1.00 0.00 H new ATOM 0 HE3 MET A 2 5.732 -26.617 -7.798 1.00 0.00 H new ATOM 37 N GLU A 3 6.036 -25.846 -0.773 1.00 0.00 N ATOM 38 CA GLU A 3 5.228 -24.773 -0.123 1.00 0.00 C ATOM 39 C GLU A 3 6.136 -23.768 0.566 1.00 0.00 C ATOM 40 O GLU A 3 5.683 -22.810 1.164 1.00 0.00 O ATOM 41 CB GLU A 3 4.391 -25.476 0.935 1.00 0.00 C ATOM 42 CG GLU A 3 5.318 -26.218 1.899 1.00 0.00 C ATOM 43 CD GLU A 3 5.415 -27.688 1.488 1.00 0.00 C ATOM 44 OE1 GLU A 3 4.450 -28.193 0.939 1.00 0.00 O ATOM 45 OE2 GLU A 3 6.451 -28.282 1.729 1.00 0.00 O ATOM 0 H GLU A 3 6.659 -26.359 -0.150 1.00 0.00 H new ATOM 0 HA GLU A 3 4.623 -24.239 -0.856 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.787 -24.750 1.479 1.00 0.00 H new ATOM 0 HB3 GLU A 3 3.701 -26.176 0.464 1.00 0.00 H new ATOM 0 HG2 GLU A 3 6.308 -25.762 1.891 1.00 0.00 H new ATOM 0 HG3 GLU A 3 4.938 -26.139 2.918 1.00 0.00 H new ATOM 52 N GLU A 4 7.407 -23.985 0.517 1.00 0.00 N ATOM 53 CA GLU A 4 8.316 -23.042 1.203 1.00 0.00 C ATOM 54 C GLU A 4 8.420 -21.740 0.414 1.00 0.00 C ATOM 55 O GLU A 4 8.918 -20.741 0.896 1.00 0.00 O ATOM 56 CB GLU A 4 9.667 -23.752 1.276 1.00 0.00 C ATOM 57 CG GLU A 4 10.597 -22.984 2.218 1.00 0.00 C ATOM 58 CD GLU A 4 10.070 -23.081 3.650 1.00 0.00 C ATOM 59 OE1 GLU A 4 9.048 -22.476 3.928 1.00 0.00 O ATOM 60 OE2 GLU A 4 10.699 -23.759 4.447 1.00 0.00 O ATOM 0 H GLU A 4 7.856 -24.765 0.038 1.00 0.00 H new ATOM 0 HA GLU A 4 7.956 -22.777 2.197 1.00 0.00 H new ATOM 0 HB2 GLU A 4 9.534 -24.774 1.632 1.00 0.00 H new ATOM 0 HB3 GLU A 4 10.110 -23.816 0.282 1.00 0.00 H new ATOM 0 HG2 GLU A 4 11.606 -23.393 2.163 1.00 0.00 H new ATOM 0 HG3 GLU A 4 10.659 -21.940 1.912 1.00 0.00 H new ATOM 67 N TYR A 5 7.936 -21.745 -0.790 1.00 0.00 N ATOM 68 CA TYR A 5 7.986 -20.508 -1.618 1.00 0.00 C ATOM 69 C TYR A 5 6.971 -19.506 -1.088 1.00 0.00 C ATOM 70 O TYR A 5 7.065 -18.317 -1.317 1.00 0.00 O ATOM 71 CB TYR A 5 7.621 -20.952 -3.034 1.00 0.00 C ATOM 72 CG TYR A 5 8.818 -20.790 -3.939 1.00 0.00 C ATOM 73 CD1 TYR A 5 10.060 -21.312 -3.555 1.00 0.00 C ATOM 74 CD2 TYR A 5 8.688 -20.118 -5.159 1.00 0.00 C ATOM 75 CE1 TYR A 5 11.171 -21.162 -4.394 1.00 0.00 C ATOM 76 CE2 TYR A 5 9.798 -19.967 -5.998 1.00 0.00 C ATOM 77 CZ TYR A 5 11.040 -20.489 -5.615 1.00 0.00 C ATOM 78 OH TYR A 5 12.135 -20.341 -6.442 1.00 0.00 O ATOM 0 H TYR A 5 7.506 -22.552 -1.241 1.00 0.00 H new ATOM 0 HA TYR A 5 8.964 -20.027 -1.595 1.00 0.00 H new ATOM 0 HB2 TYR A 5 7.295 -21.992 -3.027 1.00 0.00 H new ATOM 0 HB3 TYR A 5 6.786 -20.359 -3.408 1.00 0.00 H new ATOM 0 HD1 TYR A 5 10.161 -21.830 -2.613 1.00 0.00 H new ATOM 0 HD2 TYR A 5 7.730 -19.715 -5.454 1.00 0.00 H new ATOM 0 HE1 TYR A 5 12.129 -21.565 -4.100 1.00 0.00 H new ATOM 0 HE2 TYR A 5 9.697 -19.448 -6.940 1.00 0.00 H new ATOM 0 HH TYR A 5 11.872 -19.852 -7.249 1.00 0.00 H new ATOM 88 N LEU A 6 6.011 -19.992 -0.367 1.00 0.00 N ATOM 89 CA LEU A 6 4.972 -19.096 0.210 1.00 0.00 C ATOM 90 C LEU A 6 5.421 -18.619 1.590 1.00 0.00 C ATOM 91 O LEU A 6 5.381 -17.444 1.898 1.00 0.00 O ATOM 92 CB LEU A 6 3.718 -19.963 0.325 1.00 0.00 C ATOM 93 CG LEU A 6 3.464 -20.671 -1.005 1.00 0.00 C ATOM 94 CD1 LEU A 6 3.275 -22.168 -0.757 1.00 0.00 C ATOM 95 CD2 LEU A 6 2.200 -20.098 -1.652 1.00 0.00 C ATOM 0 H LEU A 6 5.896 -20.981 -0.148 1.00 0.00 H new ATOM 0 HA LEU A 6 4.795 -18.211 -0.401 1.00 0.00 H new ATOM 0 HB2 LEU A 6 3.842 -20.696 1.122 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.860 -19.346 0.590 1.00 0.00 H new ATOM 0 HG LEU A 6 4.315 -20.517 -1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.094 -22.674 -1.705 1.00 0.00 H new ATOM 0 HD12 LEU A 6 4.173 -22.576 -0.294 1.00 0.00 H new ATOM 0 HD13 LEU A 6 2.423 -22.322 -0.095 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.017 -20.602 -2.601 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.349 -20.253 -0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 6 2.333 -19.030 -1.827 1.00 0.00 H new ATOM 107 N GLY A 7 5.858 -19.524 2.419 1.00 0.00 N ATOM 108 CA GLY A 7 6.319 -19.123 3.776 1.00 0.00 C ATOM 109 C GLY A 7 7.250 -17.917 3.655 1.00 0.00 C ATOM 110 O GLY A 7 7.239 -17.029 4.485 1.00 0.00 O ATOM 0 H GLY A 7 5.916 -20.522 2.216 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.464 -18.876 4.405 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.839 -19.952 4.256 1.00 0.00 H new ATOM 114 N VAL A 8 8.059 -17.877 2.630 1.00 0.00 N ATOM 115 CA VAL A 8 8.989 -16.722 2.468 1.00 0.00 C ATOM 116 C VAL A 8 8.313 -15.593 1.699 1.00 0.00 C ATOM 117 O VAL A 8 8.596 -14.429 1.898 1.00 0.00 O ATOM 118 CB VAL A 8 10.181 -17.269 1.685 1.00 0.00 C ATOM 119 CG1 VAL A 8 11.099 -16.112 1.290 1.00 0.00 C ATOM 120 CG2 VAL A 8 10.952 -18.257 2.561 1.00 0.00 C ATOM 0 H VAL A 8 8.116 -18.589 1.902 1.00 0.00 H new ATOM 0 HA VAL A 8 9.292 -16.308 3.429 1.00 0.00 H new ATOM 0 HB VAL A 8 9.829 -17.778 0.787 1.00 0.00 H new ATOM 0 HG11 VAL A 8 11.951 -16.498 0.731 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.548 -15.406 0.669 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.454 -15.606 2.188 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.803 -18.649 2.005 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.307 -17.748 3.457 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.296 -19.079 2.847 1.00 0.00 H new ATOM 130 N PHE A 9 7.416 -15.934 0.835 1.00 0.00 N ATOM 131 CA PHE A 9 6.701 -14.886 0.051 1.00 0.00 C ATOM 132 C PHE A 9 5.860 -14.031 1.000 1.00 0.00 C ATOM 133 O PHE A 9 5.760 -12.829 0.850 1.00 0.00 O ATOM 134 CB PHE A 9 5.805 -15.652 -0.927 1.00 0.00 C ATOM 135 CG PHE A 9 6.369 -15.557 -2.328 1.00 0.00 C ATOM 136 CD1 PHE A 9 6.956 -14.366 -2.774 1.00 0.00 C ATOM 137 CD2 PHE A 9 6.303 -16.665 -3.182 1.00 0.00 C ATOM 138 CE1 PHE A 9 7.479 -14.287 -4.071 1.00 0.00 C ATOM 139 CE2 PHE A 9 6.824 -16.585 -4.478 1.00 0.00 C ATOM 140 CZ PHE A 9 7.413 -15.396 -4.923 1.00 0.00 C ATOM 0 H PHE A 9 7.139 -16.894 0.630 1.00 0.00 H new ATOM 0 HA PHE A 9 7.382 -14.218 -0.476 1.00 0.00 H new ATOM 0 HB2 PHE A 9 5.733 -16.697 -0.625 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.795 -15.243 -0.904 1.00 0.00 H new ATOM 0 HD1 PHE A 9 7.005 -13.509 -2.118 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.849 -17.583 -2.839 1.00 0.00 H new ATOM 0 HE1 PHE A 9 7.934 -13.369 -4.414 1.00 0.00 H new ATOM 0 HE2 PHE A 9 6.772 -17.441 -5.135 1.00 0.00 H new ATOM 0 HZ PHE A 9 7.816 -15.334 -5.923 1.00 0.00 H new ATOM 150 N VAL A 10 5.260 -14.646 1.984 1.00 0.00 N ATOM 151 CA VAL A 10 4.434 -13.876 2.955 1.00 0.00 C ATOM 152 C VAL A 10 5.333 -13.246 4.024 1.00 0.00 C ATOM 153 O VAL A 10 5.014 -12.219 4.591 1.00 0.00 O ATOM 154 CB VAL A 10 3.495 -14.909 3.581 1.00 0.00 C ATOM 155 CG1 VAL A 10 2.397 -14.196 4.372 1.00 0.00 C ATOM 156 CG2 VAL A 10 2.855 -15.751 2.474 1.00 0.00 C ATOM 0 H VAL A 10 5.307 -15.650 2.156 1.00 0.00 H new ATOM 0 HA VAL A 10 3.885 -13.063 2.481 1.00 0.00 H new ATOM 0 HB VAL A 10 4.064 -15.553 4.251 1.00 0.00 H new ATOM 0 HG11 VAL A 10 1.730 -14.935 4.816 1.00 0.00 H new ATOM 0 HG12 VAL A 10 2.849 -13.594 5.161 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.828 -13.550 3.703 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.186 -16.488 2.918 1.00 0.00 H new ATOM 0 HG22 VAL A 10 2.289 -15.103 1.805 1.00 0.00 H new ATOM 0 HG23 VAL A 10 3.634 -16.263 1.909 1.00 0.00 H new ATOM 166 N ASP A 11 6.459 -13.851 4.302 1.00 0.00 N ATOM 167 CA ASP A 11 7.378 -13.279 5.330 1.00 0.00 C ATOM 168 C ASP A 11 7.959 -11.966 4.826 1.00 0.00 C ATOM 169 O ASP A 11 8.282 -11.072 5.584 1.00 0.00 O ATOM 170 CB ASP A 11 8.480 -14.324 5.513 1.00 0.00 C ATOM 171 CG ASP A 11 8.120 -15.250 6.676 1.00 0.00 C ATOM 172 OD1 ASP A 11 7.073 -15.045 7.267 1.00 0.00 O ATOM 173 OD2 ASP A 11 8.896 -16.149 6.955 1.00 0.00 O ATOM 0 H ASP A 11 6.781 -14.714 3.863 1.00 0.00 H new ATOM 0 HA ASP A 11 6.870 -13.066 6.270 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.602 -14.903 4.598 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.433 -13.832 5.708 1.00 0.00 H new ATOM 178 N GLU A 12 8.068 -11.846 3.545 1.00 0.00 N ATOM 179 CA GLU A 12 8.605 -10.594 2.950 1.00 0.00 C ATOM 180 C GLU A 12 7.450 -9.630 2.704 1.00 0.00 C ATOM 181 O GLU A 12 7.620 -8.428 2.654 1.00 0.00 O ATOM 182 CB GLU A 12 9.254 -11.018 1.632 1.00 0.00 C ATOM 183 CG GLU A 12 8.183 -11.570 0.693 1.00 0.00 C ATOM 184 CD GLU A 12 8.666 -11.462 -0.755 1.00 0.00 C ATOM 185 OE1 GLU A 12 8.801 -10.347 -1.232 1.00 0.00 O ATOM 186 OE2 GLU A 12 8.892 -12.496 -1.363 1.00 0.00 O ATOM 0 H GLU A 12 7.807 -12.566 2.871 1.00 0.00 H new ATOM 0 HA GLU A 12 9.324 -10.090 3.595 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.755 -10.167 1.170 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.017 -11.775 1.816 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.970 -12.610 0.939 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.253 -11.015 0.819 1.00 0.00 H new ATOM 193 N THR A 13 6.267 -10.160 2.564 1.00 0.00 N ATOM 194 CA THR A 13 5.078 -9.298 2.333 1.00 0.00 C ATOM 195 C THR A 13 4.728 -8.548 3.624 1.00 0.00 C ATOM 196 O THR A 13 4.438 -7.370 3.609 1.00 0.00 O ATOM 197 CB THR A 13 3.967 -10.281 1.931 1.00 0.00 C ATOM 198 OG1 THR A 13 3.983 -10.456 0.522 1.00 0.00 O ATOM 199 CG2 THR A 13 2.598 -9.746 2.360 1.00 0.00 C ATOM 0 H THR A 13 6.073 -11.161 2.600 1.00 0.00 H new ATOM 0 HA THR A 13 5.235 -8.538 1.568 1.00 0.00 H new ATOM 0 HB THR A 13 4.143 -11.235 2.428 1.00 0.00 H new ATOM 0 HG1 THR A 13 4.525 -11.240 0.296 1.00 0.00 H new ATOM 0 HG21 THR A 13 1.823 -10.454 2.068 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.581 -9.616 3.442 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.414 -8.787 1.876 1.00 0.00 H new ATOM 207 N LYS A 14 4.763 -9.223 4.741 1.00 0.00 N ATOM 208 CA LYS A 14 4.438 -8.547 6.029 1.00 0.00 C ATOM 209 C LYS A 14 5.583 -7.621 6.432 1.00 0.00 C ATOM 210 O LYS A 14 5.368 -6.523 6.908 1.00 0.00 O ATOM 211 CB LYS A 14 4.276 -9.679 7.045 1.00 0.00 C ATOM 212 CG LYS A 14 3.231 -10.673 6.538 1.00 0.00 C ATOM 213 CD LYS A 14 3.658 -12.097 6.907 1.00 0.00 C ATOM 214 CE LYS A 14 2.936 -12.533 8.184 1.00 0.00 C ATOM 215 NZ LYS A 14 3.603 -13.803 8.588 1.00 0.00 N ATOM 0 H LYS A 14 5.002 -10.212 4.817 1.00 0.00 H new ATOM 0 HA LYS A 14 3.539 -7.935 5.962 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.230 -10.184 7.198 1.00 0.00 H new ATOM 0 HB3 LYS A 14 3.971 -9.275 8.010 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.258 -10.449 6.976 1.00 0.00 H new ATOM 0 HG3 LYS A 14 3.123 -10.583 5.457 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.422 -12.781 6.092 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.737 -12.137 7.055 1.00 0.00 H new ATOM 0 HE2 LYS A 14 3.022 -11.776 8.964 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.872 -12.686 8.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.163 -14.165 9.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 3.499 -14.506 7.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 4.613 -13.625 8.760 1.00 0.00 H new ATOM 229 N GLU A 15 6.800 -8.047 6.240 1.00 0.00 N ATOM 230 CA GLU A 15 7.949 -7.178 6.611 1.00 0.00 C ATOM 231 C GLU A 15 7.967 -5.942 5.719 1.00 0.00 C ATOM 232 O GLU A 15 8.586 -4.942 6.024 1.00 0.00 O ATOM 233 CB GLU A 15 9.192 -8.038 6.383 1.00 0.00 C ATOM 234 CG GLU A 15 9.214 -9.178 7.402 1.00 0.00 C ATOM 235 CD GLU A 15 9.816 -8.677 8.714 1.00 0.00 C ATOM 236 OE1 GLU A 15 10.855 -8.039 8.661 1.00 0.00 O ATOM 237 OE2 GLU A 15 9.229 -8.937 9.752 1.00 0.00 O ATOM 0 H GLU A 15 7.047 -8.954 5.844 1.00 0.00 H new ATOM 0 HA GLU A 15 7.894 -6.826 7.641 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.188 -8.441 5.370 1.00 0.00 H new ATOM 0 HB3 GLU A 15 10.091 -7.430 6.481 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.203 -9.548 7.571 1.00 0.00 H new ATOM 0 HG3 GLU A 15 9.799 -10.013 7.017 1.00 0.00 H new ATOM 244 N TYR A 16 7.276 -6.009 4.622 1.00 0.00 N ATOM 245 CA TYR A 16 7.221 -4.848 3.695 1.00 0.00 C ATOM 246 C TYR A 16 6.037 -3.948 4.043 1.00 0.00 C ATOM 247 O TYR A 16 6.123 -2.745 3.954 1.00 0.00 O ATOM 248 CB TYR A 16 7.057 -5.443 2.297 1.00 0.00 C ATOM 249 CG TYR A 16 8.323 -5.208 1.507 1.00 0.00 C ATOM 250 CD1 TYR A 16 8.970 -3.968 1.579 1.00 0.00 C ATOM 251 CD2 TYR A 16 8.852 -6.228 0.708 1.00 0.00 C ATOM 252 CE1 TYR A 16 10.145 -3.747 0.852 1.00 0.00 C ATOM 253 CE2 TYR A 16 10.029 -6.008 -0.019 1.00 0.00 C ATOM 254 CZ TYR A 16 10.676 -4.768 0.054 1.00 0.00 C ATOM 255 OH TYR A 16 11.835 -4.550 -0.661 1.00 0.00 O ATOM 0 H TYR A 16 6.741 -6.825 4.323 1.00 0.00 H new ATOM 0 HA TYR A 16 8.118 -4.232 3.762 1.00 0.00 H new ATOM 0 HB2 TYR A 16 6.849 -6.511 2.365 1.00 0.00 H new ATOM 0 HB3 TYR A 16 6.208 -4.985 1.791 1.00 0.00 H new ATOM 0 HD1 TYR A 16 8.562 -3.182 2.196 1.00 0.00 H new ATOM 0 HD2 TYR A 16 8.353 -7.184 0.652 1.00 0.00 H new ATOM 0 HE1 TYR A 16 10.642 -2.790 0.906 1.00 0.00 H new ATOM 0 HE2 TYR A 16 10.438 -6.795 -0.636 1.00 0.00 H new ATOM 0 HH TYR A 16 12.068 -5.360 -1.161 1.00 0.00 H new ATOM 265 N LEU A 17 4.931 -4.515 4.448 1.00 0.00 N ATOM 266 CA LEU A 17 3.764 -3.662 4.809 1.00 0.00 C ATOM 267 C LEU A 17 4.172 -2.734 5.943 1.00 0.00 C ATOM 268 O LEU A 17 3.844 -1.564 5.961 1.00 0.00 O ATOM 269 CB LEU A 17 2.676 -4.631 5.266 1.00 0.00 C ATOM 270 CG LEU A 17 2.165 -5.413 4.060 1.00 0.00 C ATOM 271 CD1 LEU A 17 1.203 -6.505 4.527 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.434 -4.462 3.110 1.00 0.00 C ATOM 0 H LEU A 17 4.787 -5.520 4.543 1.00 0.00 H new ATOM 0 HA LEU A 17 3.414 -3.046 3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 17 3.072 -5.315 6.017 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.857 -4.084 5.734 1.00 0.00 H new ATOM 0 HG LEU A 17 3.007 -5.871 3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.839 -7.063 3.664 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.723 -7.183 5.204 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.360 -6.049 5.047 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.068 -5.019 2.248 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.592 -4.004 3.630 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.120 -3.684 2.775 1.00 0.00 H new ATOM 284 N GLN A 18 4.918 -3.248 6.873 1.00 0.00 N ATOM 285 CA GLN A 18 5.393 -2.400 7.995 1.00 0.00 C ATOM 286 C GLN A 18 6.374 -1.401 7.426 1.00 0.00 C ATOM 287 O GLN A 18 6.269 -0.207 7.620 1.00 0.00 O ATOM 288 CB GLN A 18 6.045 -3.386 8.965 1.00 0.00 C ATOM 289 CG GLN A 18 7.529 -3.062 9.188 1.00 0.00 C ATOM 290 CD GLN A 18 8.031 -3.785 10.438 1.00 0.00 C ATOM 291 OE1 GLN A 18 7.411 -4.722 10.902 1.00 0.00 O ATOM 292 NE2 GLN A 18 9.136 -3.387 11.007 1.00 0.00 N ATOM 0 H GLN A 18 5.221 -4.222 6.905 1.00 0.00 H new ATOM 0 HA GLN A 18 4.617 -1.830 8.506 1.00 0.00 H new ATOM 0 HB2 GLN A 18 5.519 -3.360 9.919 1.00 0.00 H new ATOM 0 HB3 GLN A 18 5.948 -4.399 8.575 1.00 0.00 H new ATOM 0 HG2 GLN A 18 8.113 -3.368 8.320 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.664 -1.986 9.299 1.00 0.00 H new ATOM 0 HE21 GLN A 18 9.656 -2.601 10.617 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.480 -3.862 11.841 1.00 0.00 H new ATOM 301 N ASN A 19 7.291 -1.896 6.670 1.00 0.00 N ATOM 302 CA ASN A 19 8.260 -0.998 6.010 1.00 0.00 C ATOM 303 C ASN A 19 7.461 -0.058 5.120 1.00 0.00 C ATOM 304 O ASN A 19 7.870 1.043 4.805 1.00 0.00 O ATOM 305 CB ASN A 19 9.159 -1.918 5.182 1.00 0.00 C ATOM 306 CG ASN A 19 10.535 -2.016 5.845 1.00 0.00 C ATOM 307 OD1 ASN A 19 10.950 -1.114 6.546 1.00 0.00 O ATOM 308 ND2 ASN A 19 11.265 -3.080 5.650 1.00 0.00 N ATOM 0 H ASN A 19 7.415 -2.890 6.477 1.00 0.00 H new ATOM 0 HA ASN A 19 8.860 -0.400 6.696 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.710 -2.908 5.103 1.00 0.00 H new ATOM 0 HB3 ASN A 19 9.259 -1.531 4.168 1.00 0.00 H new ATOM 0 HD21 ASN A 19 12.184 -3.155 6.086 1.00 0.00 H new ATOM 0 HD22 ASN A 19 10.916 -3.837 5.062 1.00 0.00 H new ATOM 315 N LEU A 20 6.299 -0.502 4.743 1.00 0.00 N ATOM 316 CA LEU A 20 5.408 0.327 3.894 1.00 0.00 C ATOM 317 C LEU A 20 4.485 1.144 4.786 1.00 0.00 C ATOM 318 O LEU A 20 3.869 2.100 4.357 1.00 0.00 O ATOM 319 CB LEU A 20 4.621 -0.671 3.040 1.00 0.00 C ATOM 320 CG LEU A 20 3.300 -0.047 2.584 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.584 1.128 1.647 1.00 0.00 C ATOM 322 CD2 LEU A 20 2.468 -1.099 1.848 1.00 0.00 C ATOM 0 H LEU A 20 5.924 -1.418 4.991 1.00 0.00 H new ATOM 0 HA LEU A 20 5.952 1.032 3.265 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.212 -0.964 2.172 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.425 -1.577 3.613 1.00 0.00 H new ATOM 0 HG LEU A 20 2.748 0.310 3.453 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.642 1.571 1.323 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.176 1.877 2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.137 0.774 0.777 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.527 -0.656 1.523 1.00 0.00 H new ATOM 0 HD22 LEU A 20 3.020 -1.457 0.979 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.263 -1.935 2.517 1.00 0.00 H new ATOM 334 N ASN A 21 4.424 0.804 6.039 1.00 0.00 N ATOM 335 CA ASN A 21 3.595 1.586 6.966 1.00 0.00 C ATOM 336 C ASN A 21 4.509 2.618 7.548 1.00 0.00 C ATOM 337 O ASN A 21 4.139 3.732 7.825 1.00 0.00 O ATOM 338 CB ASN A 21 3.119 0.617 8.040 1.00 0.00 C ATOM 339 CG ASN A 21 1.655 0.248 7.790 1.00 0.00 C ATOM 340 OD1 ASN A 21 1.210 0.188 6.564 1.00 0.00 O flip ATOM 341 ND2 ASN A 21 0.909 0.014 8.719 1.00 0.00 N flip ATOM 0 H ASN A 21 4.917 0.014 6.455 1.00 0.00 H new ATOM 0 HA ASN A 21 2.732 2.065 6.503 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.737 -0.281 8.033 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.227 1.070 9.026 1.00 0.00 H new ATOM 0 HD21 ASN A 21 1.257 0.061 9.677 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -0.066 -0.230 8.542 1.00 0.00 H new ATOM 348 N ASP A 22 5.733 2.239 7.693 1.00 0.00 N ATOM 349 CA ASP A 22 6.721 3.184 8.223 1.00 0.00 C ATOM 350 C ASP A 22 6.936 4.260 7.179 1.00 0.00 C ATOM 351 O ASP A 22 7.222 5.404 7.469 1.00 0.00 O ATOM 352 CB ASP A 22 7.994 2.372 8.469 1.00 0.00 C ATOM 353 CG ASP A 22 8.208 2.201 9.974 1.00 0.00 C ATOM 354 OD1 ASP A 22 7.584 2.928 10.728 1.00 0.00 O ATOM 355 OD2 ASP A 22 8.992 1.343 10.347 1.00 0.00 O ATOM 0 H ASP A 22 6.091 1.311 7.466 1.00 0.00 H new ATOM 0 HA ASP A 22 6.409 3.667 9.149 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.914 1.397 7.989 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.852 2.877 8.024 1.00 0.00 H new ATOM 360 N THR A 23 6.756 3.877 5.959 1.00 0.00 N ATOM 361 CA THR A 23 6.889 4.823 4.829 1.00 0.00 C ATOM 362 C THR A 23 5.645 5.696 4.771 1.00 0.00 C ATOM 363 O THR A 23 5.714 6.896 4.597 1.00 0.00 O ATOM 364 CB THR A 23 6.926 3.917 3.613 1.00 0.00 C ATOM 365 OG1 THR A 23 8.117 3.142 3.633 1.00 0.00 O ATOM 366 CG2 THR A 23 6.871 4.756 2.336 1.00 0.00 C ATOM 0 H THR A 23 6.516 2.923 5.688 1.00 0.00 H new ATOM 0 HA THR A 23 7.759 5.475 4.904 1.00 0.00 H new ATOM 0 HB THR A 23 6.064 3.251 3.635 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.889 2.190 3.582 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.898 4.098 1.467 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.949 5.338 2.322 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.726 5.431 2.307 1.00 0.00 H new ATOM 374 N LEU A 24 4.500 5.087 4.923 1.00 0.00 N ATOM 375 CA LEU A 24 3.242 5.866 4.887 1.00 0.00 C ATOM 376 C LEU A 24 3.063 6.556 6.238 1.00 0.00 C ATOM 377 O LEU A 24 2.428 7.587 6.343 1.00 0.00 O ATOM 378 CB LEU A 24 2.139 4.831 4.588 1.00 0.00 C ATOM 379 CG LEU A 24 1.306 4.525 5.837 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.389 5.712 6.137 1.00 0.00 C ATOM 381 CD2 LEU A 24 0.461 3.275 5.583 1.00 0.00 C ATOM 0 H LEU A 24 4.387 4.084 5.070 1.00 0.00 H new ATOM 0 HA LEU A 24 3.224 6.653 4.133 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.489 5.208 3.799 1.00 0.00 H new ATOM 0 HB3 LEU A 24 2.592 3.912 4.216 1.00 0.00 H new ATOM 0 HG LEU A 24 1.965 4.353 6.688 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.205 5.497 7.025 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.992 6.603 6.311 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.275 5.883 5.289 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.134 3.052 6.469 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.201 3.450 4.735 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.116 2.431 5.364 1.00 0.00 H new ATOM 393 N LEU A 25 3.644 6.006 7.273 1.00 0.00 N ATOM 394 CA LEU A 25 3.520 6.660 8.609 1.00 0.00 C ATOM 395 C LEU A 25 4.473 7.832 8.683 1.00 0.00 C ATOM 396 O LEU A 25 4.303 8.749 9.457 1.00 0.00 O ATOM 397 CB LEU A 25 3.876 5.591 9.624 1.00 0.00 C ATOM 398 CG LEU A 25 2.712 4.623 9.687 1.00 0.00 C ATOM 399 CD1 LEU A 25 3.171 3.302 10.299 1.00 0.00 C ATOM 400 CD2 LEU A 25 1.597 5.245 10.525 1.00 0.00 C ATOM 0 H LEU A 25 4.191 5.145 7.253 1.00 0.00 H new ATOM 0 HA LEU A 25 2.519 7.049 8.796 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.790 5.074 9.333 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.059 6.036 10.602 1.00 0.00 H new ATOM 0 HG LEU A 25 2.337 4.423 8.683 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.330 2.609 10.342 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.964 2.873 9.686 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.547 3.479 11.307 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.754 4.556 10.577 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.966 5.444 11.531 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.275 6.179 10.066 1.00 0.00 H new ATOM 412 N GLU A 26 5.430 7.835 7.820 1.00 0.00 N ATOM 413 CA GLU A 26 6.362 8.974 7.749 1.00 0.00 C ATOM 414 C GLU A 26 5.764 9.903 6.729 1.00 0.00 C ATOM 415 O GLU A 26 5.923 11.107 6.762 1.00 0.00 O ATOM 416 CB GLU A 26 7.699 8.392 7.288 1.00 0.00 C ATOM 417 CG GLU A 26 8.298 7.543 8.411 1.00 0.00 C ATOM 418 CD GLU A 26 9.172 8.421 9.308 1.00 0.00 C ATOM 419 OE1 GLU A 26 9.578 9.478 8.853 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.421 8.022 10.433 1.00 0.00 O ATOM 0 H GLU A 26 5.610 7.087 7.151 1.00 0.00 H new ATOM 0 HA GLU A 26 6.519 9.512 8.684 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.555 7.784 6.395 1.00 0.00 H new ATOM 0 HB3 GLU A 26 8.385 9.196 7.019 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.502 7.085 8.998 1.00 0.00 H new ATOM 0 HG3 GLU A 26 8.891 6.731 7.990 1.00 0.00 H new ATOM 427 N LEU A 27 5.025 9.317 5.838 1.00 0.00 N ATOM 428 CA LEU A 27 4.340 10.099 4.814 1.00 0.00 C ATOM 429 C LEU A 27 3.313 10.984 5.508 1.00 0.00 C ATOM 430 O LEU A 27 3.024 12.080 5.080 1.00 0.00 O ATOM 431 CB LEU A 27 3.667 9.068 3.911 1.00 0.00 C ATOM 432 CG LEU A 27 2.723 9.772 2.941 1.00 0.00 C ATOM 433 CD1 LEU A 27 3.525 10.686 2.014 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.984 8.723 2.108 1.00 0.00 C ATOM 0 H LEU A 27 4.871 8.310 5.785 1.00 0.00 H new ATOM 0 HA LEU A 27 5.001 10.744 4.235 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.421 8.508 3.358 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.114 8.348 4.514 1.00 0.00 H new ATOM 0 HG LEU A 27 2.004 10.370 3.502 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.848 11.187 1.322 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.055 11.431 2.607 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.245 10.092 1.451 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.308 9.221 1.413 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.706 8.128 1.549 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.411 8.072 2.768 1.00 0.00 H new ATOM 446 N GLU A 28 2.782 10.520 6.609 1.00 0.00 N ATOM 447 CA GLU A 28 1.806 11.349 7.360 1.00 0.00 C ATOM 448 C GLU A 28 2.569 12.510 7.989 1.00 0.00 C ATOM 449 O GLU A 28 2.112 13.635 8.013 1.00 0.00 O ATOM 450 CB GLU A 28 1.242 10.429 8.441 1.00 0.00 C ATOM 451 CG GLU A 28 0.201 9.495 7.825 1.00 0.00 C ATOM 452 CD GLU A 28 -0.265 8.484 8.874 1.00 0.00 C ATOM 453 OE1 GLU A 28 -1.018 8.874 9.750 1.00 0.00 O ATOM 454 OE2 GLU A 28 0.140 7.337 8.782 1.00 0.00 O ATOM 0 H GLU A 28 2.984 9.607 7.016 1.00 0.00 H new ATOM 0 HA GLU A 28 1.008 11.753 6.738 1.00 0.00 H new ATOM 0 HB2 GLU A 28 2.045 9.847 8.893 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.789 11.021 9.237 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.648 10.072 7.458 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.627 8.974 6.967 1.00 0.00 H new ATOM 461 N LYS A 29 3.756 12.237 8.465 1.00 0.00 N ATOM 462 CA LYS A 29 4.585 13.330 9.059 1.00 0.00 C ATOM 463 C LYS A 29 5.000 14.270 7.936 1.00 0.00 C ATOM 464 O LYS A 29 5.314 15.426 8.138 1.00 0.00 O ATOM 465 CB LYS A 29 5.823 12.664 9.669 1.00 0.00 C ATOM 466 CG LYS A 29 5.456 11.333 10.329 1.00 0.00 C ATOM 467 CD LYS A 29 4.203 11.500 11.187 1.00 0.00 C ATOM 468 CE LYS A 29 3.731 10.121 11.648 1.00 0.00 C ATOM 469 NZ LYS A 29 3.528 10.253 13.117 1.00 0.00 N ATOM 0 H LYS A 29 4.186 11.312 8.469 1.00 0.00 H new ATOM 0 HA LYS A 29 4.043 13.895 9.818 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.570 12.496 8.893 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.273 13.329 10.407 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.285 10.575 9.565 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.284 10.983 10.945 1.00 0.00 H new ATOM 0 HD2 LYS A 29 4.418 12.132 12.048 1.00 0.00 H new ATOM 0 HD3 LYS A 29 3.418 11.995 10.616 1.00 0.00 H new ATOM 0 HE2 LYS A 29 2.807 9.832 11.147 1.00 0.00 H new ATOM 0 HE3 LYS A 29 4.471 9.354 11.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.203 9.345 13.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 4.425 10.522 13.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.813 10.985 13.304 1.00 0.00 H new ATOM 483 N ASN A 30 4.972 13.758 6.745 1.00 0.00 N ATOM 484 CA ASN A 30 5.326 14.565 5.547 1.00 0.00 C ATOM 485 C ASN A 30 4.554 14.002 4.377 1.00 0.00 C ATOM 486 O ASN A 30 5.065 13.254 3.566 1.00 0.00 O ATOM 487 CB ASN A 30 6.836 14.417 5.356 1.00 0.00 C ATOM 488 CG ASN A 30 7.572 15.206 6.441 1.00 0.00 C ATOM 489 OD1 ASN A 30 7.455 16.414 6.516 1.00 0.00 O ATOM 490 ND2 ASN A 30 8.332 14.571 7.291 1.00 0.00 N ATOM 0 H ASN A 30 4.713 12.792 6.544 1.00 0.00 H new ATOM 0 HA ASN A 30 5.077 15.622 5.645 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.117 13.365 5.404 1.00 0.00 H new ATOM 0 HB3 ASN A 30 7.125 14.780 4.370 1.00 0.00 H new ATOM 0 HD21 ASN A 30 8.827 15.088 8.018 1.00 0.00 H new ATOM 0 HD22 ASN A 30 8.431 13.558 7.229 1.00 0.00 H new ATOM 497 N PRO A 31 3.313 14.364 4.380 1.00 0.00 N ATOM 498 CA PRO A 31 2.368 13.885 3.364 1.00 0.00 C ATOM 499 C PRO A 31 2.442 14.723 2.086 1.00 0.00 C ATOM 500 O PRO A 31 1.529 14.733 1.285 1.00 0.00 O ATOM 501 CB PRO A 31 1.033 14.048 4.068 1.00 0.00 C ATOM 502 CG PRO A 31 1.215 15.132 5.081 1.00 0.00 C ATOM 503 CD PRO A 31 2.682 15.262 5.350 1.00 0.00 C ATOM 0 HA PRO A 31 2.563 12.866 3.031 1.00 0.00 H new ATOM 0 HB2 PRO A 31 0.249 14.309 3.357 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.731 13.117 4.547 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.809 16.073 4.711 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.678 14.892 5.999 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.020 16.290 5.218 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.925 14.975 6.373 1.00 0.00 H new ATOM 511 N GLU A 32 3.528 15.411 1.880 1.00 0.00 N ATOM 512 CA GLU A 32 3.670 16.231 0.646 1.00 0.00 C ATOM 513 C GLU A 32 4.997 15.887 -0.021 1.00 0.00 C ATOM 514 O GLU A 32 5.290 16.320 -1.118 1.00 0.00 O ATOM 515 CB GLU A 32 3.652 17.699 1.098 1.00 0.00 C ATOM 516 CG GLU A 32 3.118 17.805 2.529 1.00 0.00 C ATOM 517 CD GLU A 32 3.162 19.261 2.993 1.00 0.00 C ATOM 518 OE1 GLU A 32 3.007 20.135 2.155 1.00 0.00 O ATOM 519 OE2 GLU A 32 3.349 19.479 4.179 1.00 0.00 O ATOM 0 H GLU A 32 4.326 15.441 2.515 1.00 0.00 H new ATOM 0 HA GLU A 32 2.871 16.044 -0.072 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.658 18.116 1.046 1.00 0.00 H new ATOM 0 HB3 GLU A 32 3.028 18.287 0.425 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.095 17.430 2.574 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.715 17.183 3.196 1.00 0.00 H new ATOM 526 N ASP A 33 5.795 15.100 0.641 1.00 0.00 N ATOM 527 CA ASP A 33 7.100 14.707 0.062 1.00 0.00 C ATOM 528 C ASP A 33 6.890 13.576 -0.946 1.00 0.00 C ATOM 529 O ASP A 33 6.235 12.594 -0.660 1.00 0.00 O ATOM 530 CB ASP A 33 7.943 14.226 1.246 1.00 0.00 C ATOM 531 CG ASP A 33 9.209 15.080 1.350 1.00 0.00 C ATOM 532 OD1 ASP A 33 9.490 15.803 0.409 1.00 0.00 O ATOM 533 OD2 ASP A 33 9.874 14.993 2.368 1.00 0.00 O ATOM 0 H ASP A 33 5.595 14.712 1.563 1.00 0.00 H new ATOM 0 HA ASP A 33 7.587 15.528 -0.464 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.367 14.296 2.169 1.00 0.00 H new ATOM 0 HB3 ASP A 33 8.209 13.177 1.115 1.00 0.00 H new ATOM 538 N MET A 34 7.424 13.706 -2.125 1.00 0.00 N ATOM 539 CA MET A 34 7.234 12.637 -3.144 1.00 0.00 C ATOM 540 C MET A 34 8.045 11.394 -2.782 1.00 0.00 C ATOM 541 O MET A 34 7.998 10.394 -3.471 1.00 0.00 O ATOM 542 CB MET A 34 7.725 13.248 -4.457 1.00 0.00 C ATOM 543 CG MET A 34 6.846 14.449 -4.817 1.00 0.00 C ATOM 544 SD MET A 34 6.550 14.467 -6.602 1.00 0.00 S ATOM 545 CE MET A 34 5.386 13.083 -6.655 1.00 0.00 C ATOM 0 H MET A 34 7.983 14.504 -2.428 1.00 0.00 H new ATOM 0 HA MET A 34 6.195 12.315 -3.210 1.00 0.00 H new ATOM 0 HB2 MET A 34 8.765 13.560 -4.360 1.00 0.00 H new ATOM 0 HB3 MET A 34 7.689 12.505 -5.253 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.898 14.393 -4.281 1.00 0.00 H new ATOM 0 HG3 MET A 34 7.332 15.375 -4.509 1.00 0.00 H new ATOM 0 HE1 MET A 34 5.761 12.318 -7.334 1.00 0.00 H new ATOM 0 HE2 MET A 34 5.278 12.660 -5.656 1.00 0.00 H new ATOM 0 HE3 MET A 34 4.417 13.436 -7.007 1.00 0.00 H new ATOM 555 N GLU A 35 8.771 11.432 -1.702 1.00 0.00 N ATOM 556 CA GLU A 35 9.555 10.232 -1.309 1.00 0.00 C ATOM 557 C GLU A 35 8.638 9.262 -0.576 1.00 0.00 C ATOM 558 O GLU A 35 8.419 8.151 -1.016 1.00 0.00 O ATOM 559 CB GLU A 35 10.659 10.746 -0.388 1.00 0.00 C ATOM 560 CG GLU A 35 11.976 10.805 -1.160 1.00 0.00 C ATOM 561 CD GLU A 35 13.143 10.896 -0.176 1.00 0.00 C ATOM 562 OE1 GLU A 35 13.315 9.967 0.596 1.00 0.00 O ATOM 563 OE2 GLU A 35 13.844 11.893 -0.209 1.00 0.00 O ATOM 0 H GLU A 35 8.855 12.235 -1.079 1.00 0.00 H new ATOM 0 HA GLU A 35 9.979 9.704 -2.163 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.401 11.735 -0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.761 10.091 0.477 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.083 9.919 -1.786 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.981 11.668 -1.826 1.00 0.00 H new ATOM 570 N LEU A 36 8.072 9.677 0.521 1.00 0.00 N ATOM 571 CA LEU A 36 7.147 8.767 1.237 1.00 0.00 C ATOM 572 C LEU A 36 5.935 8.522 0.346 1.00 0.00 C ATOM 573 O LEU A 36 5.221 7.549 0.499 1.00 0.00 O ATOM 574 CB LEU A 36 6.746 9.496 2.521 1.00 0.00 C ATOM 575 CG LEU A 36 7.985 10.067 3.222 1.00 0.00 C ATOM 576 CD1 LEU A 36 7.674 10.278 4.701 1.00 0.00 C ATOM 577 CD2 LEU A 36 9.164 9.094 3.094 1.00 0.00 C ATOM 0 H LEU A 36 8.209 10.594 0.946 1.00 0.00 H new ATOM 0 HA LEU A 36 7.596 7.803 1.474 1.00 0.00 H new ATOM 0 HB2 LEU A 36 6.050 10.301 2.287 1.00 0.00 H new ATOM 0 HB3 LEU A 36 6.227 8.809 3.189 1.00 0.00 H new ATOM 0 HG LEU A 36 8.250 11.015 2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.552 10.684 5.203 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.843 10.976 4.802 1.00 0.00 H new ATOM 0 HD13 LEU A 36 7.404 9.325 5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 36 10.037 9.512 3.596 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.902 8.142 3.555 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.393 8.936 2.040 1.00 0.00 H new ATOM 589 N ILE A 37 5.712 9.390 -0.607 1.00 0.00 N ATOM 590 CA ILE A 37 4.567 9.196 -1.528 1.00 0.00 C ATOM 591 C ILE A 37 4.948 8.142 -2.564 1.00 0.00 C ATOM 592 O ILE A 37 4.130 7.356 -2.999 1.00 0.00 O ATOM 593 CB ILE A 37 4.355 10.560 -2.184 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.595 11.473 -1.219 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.545 10.397 -3.471 1.00 0.00 C ATOM 596 CD1 ILE A 37 3.301 12.808 -1.906 1.00 0.00 C ATOM 0 H ILE A 37 6.276 10.222 -0.782 1.00 0.00 H new ATOM 0 HA ILE A 37 3.660 8.854 -1.029 1.00 0.00 H new ATOM 0 HB ILE A 37 5.324 10.999 -2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.664 10.998 -0.909 1.00 0.00 H new ATOM 0 HG13 ILE A 37 4.184 11.638 -0.317 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.397 11.373 -3.934 1.00 0.00 H new ATOM 0 HG22 ILE A 37 4.084 9.746 -4.160 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.576 9.956 -3.238 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.760 13.459 -1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.239 13.283 -2.194 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.695 12.634 -2.795 1.00 0.00 H new ATOM 608 N ASN A 38 6.198 8.109 -2.953 1.00 0.00 N ATOM 609 CA ASN A 38 6.631 7.090 -3.946 1.00 0.00 C ATOM 610 C ASN A 38 7.109 5.839 -3.222 1.00 0.00 C ATOM 611 O ASN A 38 7.096 4.748 -3.756 1.00 0.00 O ATOM 612 CB ASN A 38 7.775 7.736 -4.728 1.00 0.00 C ATOM 613 CG ASN A 38 7.257 8.963 -5.479 1.00 0.00 C ATOM 614 OD1 ASN A 38 6.075 9.244 -5.466 1.00 0.00 O ATOM 615 ND2 ASN A 38 8.099 9.710 -6.137 1.00 0.00 N ATOM 0 H ASN A 38 6.930 8.740 -2.626 1.00 0.00 H new ATOM 0 HA ASN A 38 5.821 6.789 -4.610 1.00 0.00 H new ATOM 0 HB2 ASN A 38 8.576 8.025 -4.047 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.198 7.019 -5.431 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.766 10.531 -6.642 1.00 0.00 H new ATOM 0 HD22 ASN A 38 9.091 9.473 -6.147 1.00 0.00 H new ATOM 622 N GLU A 39 7.517 5.995 -2.002 1.00 0.00 N ATOM 623 CA GLU A 39 7.987 4.820 -1.218 1.00 0.00 C ATOM 624 C GLU A 39 6.786 3.967 -0.842 1.00 0.00 C ATOM 625 O GLU A 39 6.878 2.771 -0.652 1.00 0.00 O ATOM 626 CB GLU A 39 8.651 5.400 0.032 1.00 0.00 C ATOM 627 CG GLU A 39 10.044 5.925 -0.321 1.00 0.00 C ATOM 628 CD GLU A 39 11.078 5.275 0.601 1.00 0.00 C ATOM 629 OE1 GLU A 39 10.750 5.035 1.751 1.00 0.00 O ATOM 630 OE2 GLU A 39 12.181 5.028 0.141 1.00 0.00 O ATOM 0 H GLU A 39 7.547 6.887 -1.508 1.00 0.00 H new ATOM 0 HA GLU A 39 8.682 4.191 -1.775 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.040 6.206 0.439 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.725 4.635 0.805 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.277 5.701 -1.362 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.075 7.009 -0.214 1.00 0.00 H new ATOM 637 N ALA A 40 5.655 4.589 -0.761 1.00 0.00 N ATOM 638 CA ALA A 40 4.409 3.851 -0.427 1.00 0.00 C ATOM 639 C ALA A 40 3.821 3.281 -1.716 1.00 0.00 C ATOM 640 O ALA A 40 3.525 2.106 -1.812 1.00 0.00 O ATOM 641 CB ALA A 40 3.477 4.897 0.183 1.00 0.00 C ATOM 0 H ALA A 40 5.534 5.590 -0.913 1.00 0.00 H new ATOM 0 HA ALA A 40 4.570 3.021 0.261 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.532 4.427 0.456 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.941 5.323 1.072 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.292 5.688 -0.544 1.00 0.00 H new ATOM 647 N PHE A 41 3.674 4.105 -2.720 1.00 0.00 N ATOM 648 CA PHE A 41 3.136 3.612 -4.016 1.00 0.00 C ATOM 649 C PHE A 41 4.022 2.472 -4.522 1.00 0.00 C ATOM 650 O PHE A 41 3.622 1.675 -5.348 1.00 0.00 O ATOM 651 CB PHE A 41 3.212 4.819 -4.953 1.00 0.00 C ATOM 652 CG PHE A 41 3.103 4.360 -6.387 1.00 0.00 C ATOM 653 CD1 PHE A 41 1.846 4.208 -6.979 1.00 0.00 C ATOM 654 CD2 PHE A 41 4.262 4.089 -7.125 1.00 0.00 C ATOM 655 CE1 PHE A 41 1.744 3.785 -8.310 1.00 0.00 C ATOM 656 CE2 PHE A 41 4.162 3.666 -8.456 1.00 0.00 C ATOM 657 CZ PHE A 41 2.902 3.514 -9.048 1.00 0.00 C ATOM 0 H PHE A 41 3.904 5.098 -2.696 1.00 0.00 H new ATOM 0 HA PHE A 41 2.119 3.227 -3.942 1.00 0.00 H new ATOM 0 HB2 PHE A 41 2.409 5.520 -4.724 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.152 5.350 -4.802 1.00 0.00 H new ATOM 0 HD1 PHE A 41 0.953 4.417 -6.409 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.233 4.206 -6.667 1.00 0.00 H new ATOM 0 HE1 PHE A 41 0.772 3.668 -8.767 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.056 3.457 -9.025 1.00 0.00 H new ATOM 0 HZ PHE A 41 2.824 3.188 -10.074 1.00 0.00 H new ATOM 667 N ARG A 42 5.224 2.393 -4.018 1.00 0.00 N ATOM 668 CA ARG A 42 6.153 1.309 -4.446 1.00 0.00 C ATOM 669 C ARG A 42 5.817 0.017 -3.701 1.00 0.00 C ATOM 670 O ARG A 42 5.359 -0.948 -4.279 1.00 0.00 O ATOM 671 CB ARG A 42 7.545 1.807 -4.047 1.00 0.00 C ATOM 672 CG ARG A 42 8.242 2.416 -5.264 1.00 0.00 C ATOM 673 CD ARG A 42 8.410 1.343 -6.340 1.00 0.00 C ATOM 674 NE ARG A 42 9.881 1.212 -6.529 1.00 0.00 N ATOM 675 CZ ARG A 42 10.391 0.068 -6.898 1.00 0.00 C ATOM 676 NH1 ARG A 42 9.623 -0.852 -7.414 1.00 0.00 N ATOM 677 NH2 ARG A 42 11.668 -0.155 -6.751 1.00 0.00 N ATOM 0 H ARG A 42 5.604 3.037 -3.324 1.00 0.00 H new ATOM 0 HA ARG A 42 6.085 1.095 -5.513 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.463 2.550 -3.253 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.137 0.982 -3.651 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.657 3.249 -5.653 1.00 0.00 H new ATOM 0 HG3 ARG A 42 9.215 2.816 -4.978 1.00 0.00 H new ATOM 0 HD2 ARG A 42 7.967 0.398 -6.027 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.917 1.634 -7.268 1.00 0.00 H new ATOM 0 HE ARG A 42 10.490 2.015 -6.370 1.00 0.00 H new ATOM 0 HH11 ARG A 42 8.625 -0.677 -7.529 1.00 0.00 H new ATOM 0 HH12 ARG A 42 10.021 -1.746 -7.702 1.00 0.00 H new ATOM 0 HH21 ARG A 42 12.268 0.564 -6.348 1.00 0.00 H new ATOM 0 HH22 ARG A 42 12.066 -1.049 -7.039 1.00 0.00 H new ATOM 691 N ALA A 43 6.037 -0.002 -2.416 1.00 0.00 N ATOM 692 CA ALA A 43 5.728 -1.223 -1.621 1.00 0.00 C ATOM 693 C ALA A 43 4.356 -1.771 -2.007 1.00 0.00 C ATOM 694 O ALA A 43 4.190 -2.955 -2.212 1.00 0.00 O ATOM 695 CB ALA A 43 5.728 -0.750 -0.168 1.00 0.00 C ATOM 0 H ALA A 43 6.419 0.778 -1.881 1.00 0.00 H new ATOM 0 HA ALA A 43 6.447 -2.024 -1.792 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.508 -1.592 0.489 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.707 -0.342 0.082 1.00 0.00 H new ATOM 0 HB3 ALA A 43 4.969 0.021 -0.036 1.00 0.00 H new ATOM 701 N LEU A 44 3.373 -0.921 -2.119 1.00 0.00 N ATOM 702 CA LEU A 44 2.019 -1.407 -2.502 1.00 0.00 C ATOM 703 C LEU A 44 2.061 -1.942 -3.929 1.00 0.00 C ATOM 704 O LEU A 44 1.551 -3.005 -4.223 1.00 0.00 O ATOM 705 CB LEU A 44 1.112 -0.181 -2.407 1.00 0.00 C ATOM 706 CG LEU A 44 0.829 0.139 -0.940 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.679 1.652 -0.768 1.00 0.00 C ATOM 708 CD2 LEU A 44 -0.467 -0.551 -0.507 1.00 0.00 C ATOM 0 H LEU A 44 3.448 0.084 -1.963 1.00 0.00 H new ATOM 0 HA LEU A 44 1.663 -2.214 -1.862 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.587 0.673 -2.890 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.177 -0.367 -2.935 1.00 0.00 H new ATOM 0 HG LEU A 44 1.655 -0.219 -0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.477 1.881 0.278 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.600 2.146 -1.076 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.147 2.008 -1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.669 -0.323 0.540 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.293 -0.193 -1.122 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.364 -1.629 -0.630 1.00 0.00 H new ATOM 720 N HIS A 45 2.693 -1.223 -4.813 1.00 0.00 N ATOM 721 CA HIS A 45 2.797 -1.702 -6.215 1.00 0.00 C ATOM 722 C HIS A 45 3.639 -2.974 -6.224 1.00 0.00 C ATOM 723 O HIS A 45 3.442 -3.865 -7.026 1.00 0.00 O ATOM 724 CB HIS A 45 3.505 -0.577 -6.967 1.00 0.00 C ATOM 725 CG HIS A 45 3.781 -1.017 -8.379 1.00 0.00 C ATOM 726 ND1 HIS A 45 2.764 -1.310 -9.273 1.00 0.00 N ATOM 727 CD2 HIS A 45 4.953 -1.221 -9.064 1.00 0.00 C ATOM 728 CE1 HIS A 45 3.336 -1.669 -10.436 1.00 0.00 C ATOM 729 NE2 HIS A 45 4.670 -1.632 -10.365 1.00 0.00 N ATOM 0 H HIS A 45 3.141 -0.326 -4.624 1.00 0.00 H new ATOM 0 HA HIS A 45 1.833 -1.932 -6.669 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.886 0.320 -6.968 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.438 -0.320 -6.465 1.00 0.00 H new ATOM 0 HD1 HIS A 45 1.763 -1.262 -9.083 1.00 0.00 H new ATOM 0 HD2 HIS A 45 5.944 -1.084 -8.657 1.00 0.00 H new ATOM 0 HE1 HIS A 45 2.784 -1.953 -11.320 1.00 0.00 H new ATOM 737 N THR A 46 4.566 -3.064 -5.312 1.00 0.00 N ATOM 738 CA THR A 46 5.417 -4.276 -5.227 1.00 0.00 C ATOM 739 C THR A 46 4.630 -5.381 -4.510 1.00 0.00 C ATOM 740 O THR A 46 4.639 -6.527 -4.913 1.00 0.00 O ATOM 741 CB THR A 46 6.654 -3.825 -4.426 1.00 0.00 C ATOM 742 OG1 THR A 46 7.749 -3.653 -5.315 1.00 0.00 O ATOM 743 CG2 THR A 46 7.029 -4.863 -3.363 1.00 0.00 C ATOM 0 H THR A 46 4.770 -2.344 -4.619 1.00 0.00 H new ATOM 0 HA THR A 46 5.713 -4.681 -6.195 1.00 0.00 H new ATOM 0 HB THR A 46 6.419 -2.885 -3.926 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.538 -3.364 -4.810 1.00 0.00 H new ATOM 0 HG21 THR A 46 7.905 -4.520 -2.812 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.195 -4.995 -2.673 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.254 -5.814 -3.846 1.00 0.00 H new ATOM 751 N LEU A 47 3.936 -5.034 -3.458 1.00 0.00 N ATOM 752 CA LEU A 47 3.134 -6.054 -2.726 1.00 0.00 C ATOM 753 C LEU A 47 1.914 -6.440 -3.566 1.00 0.00 C ATOM 754 O LEU A 47 1.469 -7.571 -3.554 1.00 0.00 O ATOM 755 CB LEU A 47 2.707 -5.364 -1.431 1.00 0.00 C ATOM 756 CG LEU A 47 3.640 -5.782 -0.294 1.00 0.00 C ATOM 757 CD1 LEU A 47 3.848 -4.602 0.657 1.00 0.00 C ATOM 758 CD2 LEU A 47 3.017 -6.949 0.474 1.00 0.00 C ATOM 0 H LEU A 47 3.891 -4.089 -3.076 1.00 0.00 H new ATOM 0 HA LEU A 47 3.691 -6.969 -2.526 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.734 -4.282 -1.558 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.679 -5.630 -1.187 1.00 0.00 H new ATOM 0 HG LEU A 47 4.600 -6.089 -0.708 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.513 -4.901 1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 47 4.292 -3.769 0.112 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.888 -4.294 1.071 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.682 -7.247 1.285 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.056 -6.641 0.887 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.868 -7.791 -0.202 1.00 0.00 H new ATOM 770 N LYS A 48 1.381 -5.506 -4.307 1.00 0.00 N ATOM 771 CA LYS A 48 0.203 -5.803 -5.164 1.00 0.00 C ATOM 772 C LYS A 48 0.585 -6.855 -6.210 1.00 0.00 C ATOM 773 O LYS A 48 -0.187 -7.735 -6.538 1.00 0.00 O ATOM 774 CB LYS A 48 -0.121 -4.467 -5.829 1.00 0.00 C ATOM 775 CG LYS A 48 -1.220 -4.660 -6.868 1.00 0.00 C ATOM 776 CD LYS A 48 -0.861 -3.875 -8.126 1.00 0.00 C ATOM 777 CE LYS A 48 -0.004 -4.749 -9.041 1.00 0.00 C ATOM 778 NZ LYS A 48 0.704 -3.792 -9.938 1.00 0.00 N ATOM 0 H LYS A 48 1.716 -4.544 -4.354 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.647 -6.200 -4.609 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.441 -3.745 -5.078 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.772 -4.060 -6.303 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -1.332 -5.718 -7.104 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.176 -4.319 -6.472 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.768 -3.565 -8.646 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -0.319 -2.967 -7.860 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.703 -5.348 -8.466 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -0.619 -5.444 -9.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.300 -4.320 -10.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 0.006 -3.229 -10.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.301 -3.159 -9.368 1.00 0.00 H new ATOM 792 N GLY A 49 1.781 -6.774 -6.728 1.00 0.00 N ATOM 793 CA GLY A 49 2.225 -7.768 -7.744 1.00 0.00 C ATOM 794 C GLY A 49 2.422 -9.125 -7.068 1.00 0.00 C ATOM 795 O GLY A 49 2.038 -10.152 -7.590 1.00 0.00 O ATOM 0 H GLY A 49 2.470 -6.061 -6.490 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.484 -7.849 -8.539 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.156 -7.441 -8.208 1.00 0.00 H new ATOM 799 N MET A 50 3.014 -9.136 -5.905 1.00 0.00 N ATOM 800 CA MET A 50 3.230 -10.425 -5.192 1.00 0.00 C ATOM 801 C MET A 50 1.880 -11.047 -4.825 1.00 0.00 C ATOM 802 O MET A 50 1.787 -12.216 -4.507 1.00 0.00 O ATOM 803 CB MET A 50 4.016 -10.058 -3.933 1.00 0.00 C ATOM 804 CG MET A 50 5.450 -9.693 -4.320 1.00 0.00 C ATOM 805 SD MET A 50 6.551 -10.010 -2.918 1.00 0.00 S ATOM 806 CE MET A 50 5.715 -8.933 -1.730 1.00 0.00 C ATOM 0 H MET A 50 3.357 -8.308 -5.418 1.00 0.00 H new ATOM 0 HA MET A 50 3.764 -11.154 -5.801 1.00 0.00 H new ATOM 0 HB2 MET A 50 3.540 -9.220 -3.425 1.00 0.00 H new ATOM 0 HB3 MET A 50 4.018 -10.895 -3.235 1.00 0.00 H new ATOM 0 HG2 MET A 50 5.765 -10.278 -5.184 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.504 -8.643 -4.609 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.246 -8.960 -0.778 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.703 -7.912 -2.110 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.691 -9.278 -1.584 1.00 0.00 H new ATOM 816 N ALA A 51 0.831 -10.270 -4.874 1.00 0.00 N ATOM 817 CA ALA A 51 -0.516 -10.810 -4.537 1.00 0.00 C ATOM 818 C ALA A 51 -1.197 -11.335 -5.804 1.00 0.00 C ATOM 819 O ALA A 51 -2.089 -12.157 -5.748 1.00 0.00 O ATOM 820 CB ALA A 51 -1.284 -9.621 -3.961 1.00 0.00 C ATOM 0 H ALA A 51 0.850 -9.284 -5.133 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.471 -11.640 -3.832 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.291 -9.936 -3.687 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.767 -9.248 -3.077 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.343 -8.829 -4.708 1.00 0.00 H new ATOM 826 N GLY A 52 -0.768 -10.872 -6.945 1.00 0.00 N ATOM 827 CA GLY A 52 -1.373 -11.348 -8.218 1.00 0.00 C ATOM 828 C GLY A 52 -0.591 -12.565 -8.697 1.00 0.00 C ATOM 829 O GLY A 52 -1.080 -13.385 -9.448 1.00 0.00 O ATOM 0 H GLY A 52 -0.023 -10.183 -7.050 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.421 -11.606 -8.066 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.345 -10.559 -8.970 1.00 0.00 H new ATOM 833 N THR A 53 0.626 -12.689 -8.248 1.00 0.00 N ATOM 834 CA THR A 53 1.461 -13.851 -8.647 1.00 0.00 C ATOM 835 C THR A 53 1.201 -15.018 -7.695 1.00 0.00 C ATOM 836 O THR A 53 1.608 -16.138 -7.933 1.00 0.00 O ATOM 837 CB THR A 53 2.902 -13.345 -8.525 1.00 0.00 C ATOM 838 OG1 THR A 53 3.256 -12.641 -9.707 1.00 0.00 O ATOM 839 CG2 THR A 53 3.858 -14.520 -8.324 1.00 0.00 C ATOM 0 H THR A 53 1.080 -12.029 -7.617 1.00 0.00 H new ATOM 0 HA THR A 53 1.245 -14.212 -9.653 1.00 0.00 H new ATOM 0 HB THR A 53 2.974 -12.679 -7.665 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.177 -12.315 -9.630 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.879 -14.148 -8.239 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.590 -15.056 -7.413 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.788 -15.196 -9.176 1.00 0.00 H new ATOM 847 N MET A 54 0.522 -14.754 -6.620 1.00 0.00 N ATOM 848 CA MET A 54 0.217 -15.831 -5.636 1.00 0.00 C ATOM 849 C MET A 54 -1.230 -16.296 -5.795 1.00 0.00 C ATOM 850 O MET A 54 -1.734 -17.073 -5.010 1.00 0.00 O ATOM 851 CB MET A 54 0.430 -15.192 -4.263 1.00 0.00 C ATOM 852 CG MET A 54 1.310 -16.105 -3.407 1.00 0.00 C ATOM 853 SD MET A 54 2.443 -15.098 -2.419 1.00 0.00 S ATOM 854 CE MET A 54 3.620 -14.721 -3.740 1.00 0.00 C ATOM 0 H MET A 54 0.161 -13.832 -6.375 1.00 0.00 H new ATOM 0 HA MET A 54 0.849 -16.708 -5.776 1.00 0.00 H new ATOM 0 HB2 MET A 54 0.900 -14.215 -4.374 1.00 0.00 H new ATOM 0 HB3 MET A 54 -0.530 -15.030 -3.773 1.00 0.00 H new ATOM 0 HG2 MET A 54 0.689 -16.719 -2.755 1.00 0.00 H new ATOM 0 HG3 MET A 54 1.874 -16.786 -4.044 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.351 -13.997 -3.380 1.00 0.00 H new ATOM 0 HE2 MET A 54 4.132 -15.634 -4.043 1.00 0.00 H new ATOM 0 HE3 MET A 54 3.087 -14.304 -4.594 1.00 0.00 H new ATOM 864 N GLY A 55 -1.898 -15.827 -6.809 1.00 0.00 N ATOM 865 CA GLY A 55 -3.311 -16.242 -7.024 1.00 0.00 C ATOM 866 C GLY A 55 -4.234 -15.384 -6.159 1.00 0.00 C ATOM 867 O GLY A 55 -5.441 -15.504 -6.218 1.00 0.00 O ATOM 0 H GLY A 55 -1.527 -15.174 -7.499 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.577 -16.134 -8.076 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.434 -17.295 -6.771 1.00 0.00 H new ATOM 871 N PHE A 56 -3.679 -14.515 -5.358 1.00 0.00 N ATOM 872 CA PHE A 56 -4.536 -13.654 -4.497 1.00 0.00 C ATOM 873 C PHE A 56 -4.694 -12.272 -5.136 1.00 0.00 C ATOM 874 O PHE A 56 -4.247 -11.276 -4.605 1.00 0.00 O ATOM 875 CB PHE A 56 -3.786 -13.554 -3.168 1.00 0.00 C ATOM 876 CG PHE A 56 -3.589 -14.940 -2.600 1.00 0.00 C ATOM 877 CD1 PHE A 56 -4.580 -15.915 -2.772 1.00 0.00 C ATOM 878 CD2 PHE A 56 -2.418 -15.248 -1.898 1.00 0.00 C ATOM 879 CE1 PHE A 56 -4.396 -17.199 -2.245 1.00 0.00 C ATOM 880 CE2 PHE A 56 -2.235 -16.533 -1.371 1.00 0.00 C ATOM 881 CZ PHE A 56 -3.224 -17.507 -1.544 1.00 0.00 C ATOM 0 H PHE A 56 -2.675 -14.365 -5.263 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.539 -14.060 -4.365 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -2.821 -13.069 -3.317 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.347 -12.937 -2.466 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -5.485 -15.676 -3.311 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.656 -14.495 -1.763 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -5.158 -17.952 -2.379 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.331 -16.772 -0.831 1.00 0.00 H new ATOM 0 HZ PHE A 56 -3.083 -18.497 -1.137 1.00 0.00 H new ATOM 891 N SER A 57 -5.324 -12.207 -6.278 1.00 0.00 N ATOM 892 CA SER A 57 -5.503 -10.891 -6.954 1.00 0.00 C ATOM 893 C SER A 57 -6.527 -10.044 -6.211 1.00 0.00 C ATOM 894 O SER A 57 -6.488 -8.830 -6.238 1.00 0.00 O ATOM 895 CB SER A 57 -6.001 -11.222 -8.357 1.00 0.00 C ATOM 896 OG SER A 57 -5.365 -12.408 -8.815 1.00 0.00 O ATOM 0 H SER A 57 -5.721 -13.007 -6.771 1.00 0.00 H new ATOM 0 HA SER A 57 -4.576 -10.318 -6.977 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.083 -11.356 -8.349 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.787 -10.396 -9.035 1.00 0.00 H new ATOM 0 HG SER A 57 -5.685 -12.624 -9.716 1.00 0.00 H new ATOM 902 N SER A 58 -7.426 -10.679 -5.531 1.00 0.00 N ATOM 903 CA SER A 58 -8.447 -9.921 -4.760 1.00 0.00 C ATOM 904 C SER A 58 -7.721 -9.068 -3.737 1.00 0.00 C ATOM 905 O SER A 58 -8.084 -7.940 -3.467 1.00 0.00 O ATOM 906 CB SER A 58 -9.307 -10.978 -4.072 1.00 0.00 C ATOM 907 OG SER A 58 -10.677 -10.720 -4.344 1.00 0.00 O ATOM 0 H SER A 58 -7.503 -11.694 -5.472 1.00 0.00 H new ATOM 0 HA SER A 58 -9.061 -9.268 -5.379 1.00 0.00 H new ATOM 0 HB2 SER A 58 -9.035 -11.972 -4.427 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.129 -10.964 -2.997 1.00 0.00 H new ATOM 0 HG SER A 58 -11.231 -11.398 -3.905 1.00 0.00 H new ATOM 913 N MET A 59 -6.670 -9.603 -3.187 1.00 0.00 N ATOM 914 CA MET A 59 -5.878 -8.839 -2.200 1.00 0.00 C ATOM 915 C MET A 59 -4.858 -7.987 -2.946 1.00 0.00 C ATOM 916 O MET A 59 -4.369 -6.996 -2.442 1.00 0.00 O ATOM 917 CB MET A 59 -5.186 -9.898 -1.343 1.00 0.00 C ATOM 918 CG MET A 59 -4.287 -9.219 -0.307 1.00 0.00 C ATOM 919 SD MET A 59 -2.982 -10.364 0.204 1.00 0.00 S ATOM 920 CE MET A 59 -2.353 -10.728 -1.451 1.00 0.00 C ATOM 0 H MET A 59 -6.327 -10.543 -3.383 1.00 0.00 H new ATOM 0 HA MET A 59 -6.481 -8.170 -1.587 1.00 0.00 H new ATOM 0 HB2 MET A 59 -5.930 -10.517 -0.842 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.593 -10.560 -1.974 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.848 -8.315 -0.728 1.00 0.00 H new ATOM 0 HG3 MET A 59 -4.877 -8.914 0.557 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.268 -10.622 -1.459 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.620 -11.749 -1.725 1.00 0.00 H new ATOM 0 HE3 MET A 59 -2.791 -10.033 -2.168 1.00 0.00 H new ATOM 930 N ALA A 60 -4.551 -8.360 -4.158 1.00 0.00 N ATOM 931 CA ALA A 60 -3.580 -7.564 -4.950 1.00 0.00 C ATOM 932 C ALA A 60 -4.290 -6.341 -5.514 1.00 0.00 C ATOM 933 O ALA A 60 -3.729 -5.270 -5.595 1.00 0.00 O ATOM 934 CB ALA A 60 -3.117 -8.488 -6.078 1.00 0.00 C ATOM 0 H ALA A 60 -4.931 -9.180 -4.631 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.735 -7.216 -4.356 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.396 -7.964 -6.705 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.650 -9.376 -5.652 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.975 -8.784 -6.682 1.00 0.00 H new ATOM 940 N LYS A 61 -5.535 -6.478 -5.871 1.00 0.00 N ATOM 941 CA LYS A 61 -6.271 -5.301 -6.390 1.00 0.00 C ATOM 942 C LYS A 61 -6.536 -4.375 -5.214 1.00 0.00 C ATOM 943 O LYS A 61 -6.713 -3.182 -5.361 1.00 0.00 O ATOM 944 CB LYS A 61 -7.573 -5.858 -6.965 1.00 0.00 C ATOM 945 CG LYS A 61 -7.252 -6.904 -8.032 1.00 0.00 C ATOM 946 CD LYS A 61 -8.280 -8.032 -7.960 1.00 0.00 C ATOM 947 CE LYS A 61 -9.626 -7.523 -8.478 1.00 0.00 C ATOM 948 NZ LYS A 61 -10.061 -8.534 -9.480 1.00 0.00 N ATOM 0 H LYS A 61 -6.068 -7.346 -5.826 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.731 -4.740 -7.153 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -8.172 -6.305 -6.171 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.166 -5.052 -7.397 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.266 -6.447 -9.021 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.249 -7.301 -7.878 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.946 -8.882 -8.555 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.381 -8.382 -6.933 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -10.351 -7.432 -7.669 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.527 -6.536 -8.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.979 -8.253 -9.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.355 -8.594 -10.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.153 -9.462 -9.019 1.00 0.00 H new ATOM 962 N LEU A 62 -6.529 -4.932 -4.037 1.00 0.00 N ATOM 963 CA LEU A 62 -6.741 -4.124 -2.816 1.00 0.00 C ATOM 964 C LEU A 62 -5.500 -3.267 -2.569 1.00 0.00 C ATOM 965 O LEU A 62 -5.587 -2.132 -2.149 1.00 0.00 O ATOM 966 CB LEU A 62 -6.905 -5.159 -1.706 1.00 0.00 C ATOM 967 CG LEU A 62 -6.880 -4.462 -0.347 1.00 0.00 C ATOM 968 CD1 LEU A 62 -7.811 -3.248 -0.374 1.00 0.00 C ATOM 969 CD2 LEU A 62 -7.350 -5.438 0.733 1.00 0.00 C ATOM 0 H LEU A 62 -6.383 -5.928 -3.872 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.598 -3.453 -2.880 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.844 -5.697 -1.833 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.105 -5.897 -1.762 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.864 -4.134 -0.128 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.791 -2.753 0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.478 -2.551 -1.144 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.828 -3.574 -0.594 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.333 -4.942 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.366 -5.765 0.511 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.687 -6.303 0.755 1.00 0.00 H new ATOM 981 N CYS A 63 -4.342 -3.812 -2.839 1.00 0.00 N ATOM 982 CA CYS A 63 -3.082 -3.043 -2.633 1.00 0.00 C ATOM 983 C CYS A 63 -2.904 -2.012 -3.749 1.00 0.00 C ATOM 984 O CYS A 63 -2.426 -0.919 -3.523 1.00 0.00 O ATOM 985 CB CYS A 63 -1.968 -4.088 -2.687 1.00 0.00 C ATOM 986 SG CYS A 63 -1.846 -4.928 -1.089 1.00 0.00 S ATOM 0 H CYS A 63 -4.216 -4.760 -3.194 1.00 0.00 H new ATOM 0 HA CYS A 63 -3.082 -2.495 -1.691 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -2.173 -4.812 -3.475 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.019 -3.611 -2.932 1.00 0.00 H new ATOM 0 HG CYS A 63 -0.900 -5.818 -1.138 1.00 0.00 H new ATOM 992 N HIS A 64 -3.292 -2.344 -4.952 1.00 0.00 N ATOM 993 CA HIS A 64 -3.147 -1.366 -6.066 1.00 0.00 C ATOM 994 C HIS A 64 -4.034 -0.160 -5.789 1.00 0.00 C ATOM 995 O HIS A 64 -3.724 0.957 -6.151 1.00 0.00 O ATOM 996 CB HIS A 64 -3.624 -2.103 -7.317 1.00 0.00 C ATOM 997 CG HIS A 64 -3.469 -1.205 -8.514 1.00 0.00 C ATOM 998 ND1 HIS A 64 -2.359 -0.768 -9.194 1.00 0.00 N flip ATOM 999 CD2 HIS A 64 -4.556 -0.633 -9.155 1.00 0.00 C flip ATOM 1000 CE1 HIS A 64 -2.749 0.064 -10.239 1.00 0.00 C flip ATOM 1001 NE2 HIS A 64 -4.082 0.112 -10.170 1.00 0.00 N flip ATOM 0 H HIS A 64 -3.700 -3.243 -5.209 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.124 -1.008 -6.181 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.047 -3.017 -7.457 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.667 -2.399 -7.203 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -5.595 -0.762 -8.888 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -2.111 0.564 -10.953 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -4.669 0.648 -10.809 1.00 0.00 H new ATOM 1009 N THR A 65 -5.138 -0.388 -5.138 1.00 0.00 N ATOM 1010 CA THR A 65 -6.062 0.730 -4.817 1.00 0.00 C ATOM 1011 C THR A 65 -5.377 1.698 -3.837 1.00 0.00 C ATOM 1012 O THR A 65 -5.299 2.885 -4.081 1.00 0.00 O ATOM 1013 CB THR A 65 -7.292 0.039 -4.202 1.00 0.00 C ATOM 1014 OG1 THR A 65 -8.342 0.023 -5.159 1.00 0.00 O ATOM 1015 CG2 THR A 65 -7.764 0.775 -2.948 1.00 0.00 C ATOM 0 H THR A 65 -5.441 -1.306 -4.813 1.00 0.00 H new ATOM 0 HA THR A 65 -6.344 1.332 -5.681 1.00 0.00 H new ATOM 0 HB THR A 65 -7.017 -0.978 -3.922 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.283 -0.795 -5.695 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.634 0.266 -2.533 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.963 0.785 -2.209 1.00 0.00 H new ATOM 0 HG23 THR A 65 -8.032 1.799 -3.207 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.864 1.198 -2.743 1.00 0.00 N ATOM 1024 CA LEU A 66 -4.169 2.097 -1.772 1.00 0.00 C ATOM 1025 C LEU A 66 -3.030 2.815 -2.498 1.00 0.00 C ATOM 1026 O LEU A 66 -2.828 4.000 -2.346 1.00 0.00 O ATOM 1027 CB LEU A 66 -3.596 1.188 -0.674 1.00 0.00 C ATOM 1028 CG LEU A 66 -4.603 0.104 -0.260 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -4.124 -0.554 1.035 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -5.986 0.718 -0.022 1.00 0.00 C ATOM 0 H LEU A 66 -4.895 0.213 -2.480 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.842 2.843 -1.350 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.679 0.718 -1.031 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.329 1.789 0.195 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.675 -0.634 -1.059 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.834 -1.325 1.336 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.145 -1.005 0.873 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.051 0.198 1.820 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.686 -0.065 0.270 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.922 1.463 0.772 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.336 1.194 -0.938 1.00 0.00 H new ATOM 1042 N GLU A 67 -2.290 2.090 -3.294 1.00 0.00 N ATOM 1043 CA GLU A 67 -1.157 2.698 -4.050 1.00 0.00 C ATOM 1044 C GLU A 67 -1.687 3.668 -5.105 1.00 0.00 C ATOM 1045 O GLU A 67 -0.991 4.559 -5.549 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.441 1.490 -4.684 1.00 0.00 C ATOM 1047 CG GLU A 67 -0.280 1.662 -6.201 1.00 0.00 C ATOM 1048 CD GLU A 67 0.158 0.335 -6.821 1.00 0.00 C ATOM 1049 OE1 GLU A 67 0.182 -0.653 -6.105 1.00 0.00 O ATOM 1050 OE2 GLU A 67 0.462 0.327 -8.003 1.00 0.00 O ATOM 0 H GLU A 67 -2.424 1.092 -3.454 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.483 3.283 -3.425 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.540 1.365 -4.225 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.007 0.581 -4.478 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.221 1.989 -6.643 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.457 2.436 -6.414 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.911 3.506 -5.502 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.474 4.428 -6.516 1.00 0.00 C ATOM 1059 C ASN A 68 -3.526 5.823 -5.927 1.00 0.00 C ATOM 1060 O ASN A 68 -3.177 6.797 -6.559 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.883 3.925 -6.764 1.00 0.00 C ATOM 1062 CG ASN A 68 -5.109 3.725 -8.264 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -6.016 4.298 -8.834 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -4.315 2.933 -8.933 1.00 0.00 N ATOM 0 H ASN A 68 -3.544 2.778 -5.170 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.886 4.462 -7.433 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -5.041 2.985 -6.235 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.607 4.638 -6.370 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.456 2.796 -9.934 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.553 2.452 -8.455 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.952 5.920 -4.707 1.00 0.00 N ATOM 1072 CA ILE A 69 -4.019 7.245 -4.057 1.00 0.00 C ATOM 1073 C ILE A 69 -2.618 7.778 -3.938 1.00 0.00 C ATOM 1074 O ILE A 69 -2.341 8.943 -4.124 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.621 6.970 -2.691 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -6.123 6.801 -2.853 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -4.332 8.141 -1.751 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -6.420 5.528 -3.645 1.00 0.00 C ATOM 0 H ILE A 69 -4.257 5.136 -4.131 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.609 7.980 -4.605 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.185 6.065 -2.267 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.600 6.750 -1.874 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.542 7.666 -3.367 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.767 7.938 -0.772 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.254 8.269 -1.650 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.769 9.052 -2.160 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.498 5.413 -3.758 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.958 5.596 -4.630 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -6.017 4.666 -3.113 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.731 6.899 -3.669 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.309 7.299 -3.566 1.00 0.00 C ATOM 1092 C LEU A 70 0.221 7.535 -4.966 1.00 0.00 C ATOM 1093 O LEU A 70 1.265 8.121 -5.160 1.00 0.00 O ATOM 1094 CB LEU A 70 0.410 6.140 -2.877 1.00 0.00 C ATOM 1095 CG LEU A 70 -0.345 5.762 -1.602 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.518 4.833 -0.748 1.00 0.00 C ATOM 1097 CD2 LEU A 70 -0.673 7.029 -0.805 1.00 0.00 C ATOM 0 H LEU A 70 -1.918 5.909 -3.512 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.162 8.216 -2.996 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.467 5.282 -3.547 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.434 6.424 -2.636 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.270 5.251 -1.870 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.023 4.566 0.160 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.748 3.929 -1.312 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.445 5.341 -0.481 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.211 6.758 0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.252 7.542 -0.540 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.293 7.690 -1.411 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.519 7.111 -5.949 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.083 7.350 -7.343 1.00 0.00 C ATOM 1111 C ASP A 71 -0.547 8.743 -7.753 1.00 0.00 C ATOM 1112 O ASP A 71 0.170 9.483 -8.398 1.00 0.00 O ATOM 1113 CB ASP A 71 -0.760 6.266 -8.184 1.00 0.00 C ATOM 1114 CG ASP A 71 -0.383 6.451 -9.656 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.290 7.423 -9.957 1.00 0.00 O ATOM 1116 OD2 ASP A 71 -0.772 5.616 -10.456 1.00 0.00 O ATOM 0 H ASP A 71 -1.402 6.612 -5.845 1.00 0.00 H new ATOM 0 HA ASP A 71 0.999 7.305 -7.471 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.452 5.279 -7.840 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.842 6.321 -8.065 1.00 0.00 H new ATOM 1121 N LYS A 72 -1.728 9.129 -7.343 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.201 10.495 -7.671 1.00 0.00 C ATOM 1123 C LYS A 72 -1.347 11.458 -6.885 1.00 0.00 C ATOM 1124 O LYS A 72 -0.915 12.489 -7.362 1.00 0.00 O ATOM 1125 CB LYS A 72 -3.640 10.549 -7.193 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.555 10.002 -8.270 1.00 0.00 C ATOM 1127 CD LYS A 72 -4.517 8.491 -8.239 1.00 0.00 C ATOM 1128 CE LYS A 72 -5.428 7.987 -7.118 1.00 0.00 C ATOM 1129 NZ LYS A 72 -6.817 8.220 -7.609 1.00 0.00 N ATOM 0 H LYS A 72 -2.376 8.558 -6.800 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.138 10.743 -8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -3.752 9.968 -6.278 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -3.916 11.576 -6.954 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.574 10.355 -8.111 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.241 10.365 -9.249 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -4.843 8.088 -9.198 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -3.496 8.144 -8.078 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.254 6.930 -6.914 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.243 8.525 -6.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.286 8.924 -7.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -6.785 8.571 -8.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.350 7.328 -7.579 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.066 11.074 -5.687 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.188 11.891 -4.821 1.00 0.00 C ATOM 1145 C ALA A 73 1.152 12.016 -5.525 1.00 0.00 C ATOM 1146 O ALA A 73 1.861 12.995 -5.402 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.047 11.070 -3.547 1.00 0.00 C ATOM 0 H ALA A 73 -1.411 10.214 -5.260 1.00 0.00 H new ATOM 0 HA ALA A 73 -0.566 12.892 -4.611 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.592 11.601 -2.841 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.030 10.917 -3.102 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.399 10.104 -3.784 1.00 0.00 H new ATOM 1153 N ARG A 74 1.477 11.015 -6.289 1.00 0.00 N ATOM 1154 CA ARG A 74 2.745 11.027 -7.052 1.00 0.00 C ATOM 1155 C ARG A 74 2.469 11.637 -8.426 1.00 0.00 C ATOM 1156 O ARG A 74 3.363 12.100 -9.105 1.00 0.00 O ATOM 1157 CB ARG A 74 3.169 9.549 -7.133 1.00 0.00 C ATOM 1158 CG ARG A 74 3.414 9.119 -8.584 1.00 0.00 C ATOM 1159 CD ARG A 74 4.025 7.717 -8.601 1.00 0.00 C ATOM 1160 NE ARG A 74 5.419 7.903 -8.111 1.00 0.00 N ATOM 1161 CZ ARG A 74 6.429 7.651 -8.899 1.00 0.00 C ATOM 1162 NH1 ARG A 74 6.361 7.961 -10.165 1.00 0.00 N ATOM 1163 NH2 ARG A 74 7.506 7.091 -8.421 1.00 0.00 N ATOM 0 H ARG A 74 0.908 10.178 -6.417 1.00 0.00 H new ATOM 0 HA ARG A 74 3.539 11.620 -6.598 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.076 9.396 -6.548 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.395 8.922 -6.691 1.00 0.00 H new ATOM 0 HG2 ARG A 74 2.477 9.126 -9.140 1.00 0.00 H new ATOM 0 HG3 ARG A 74 4.082 9.825 -9.076 1.00 0.00 H new ATOM 0 HD2 ARG A 74 3.468 7.035 -7.959 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.012 7.292 -9.605 1.00 0.00 H new ATOM 0 HE ARG A 74 5.585 8.228 -7.158 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.519 8.400 -10.538 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.150 7.764 -10.781 1.00 0.00 H new ATOM 0 HH21 ARG A 74 7.559 6.850 -7.431 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.295 6.894 -9.037 1.00 0.00 H new ATOM 1177 N ASN A 75 1.224 11.655 -8.828 1.00 0.00 N ATOM 1178 CA ASN A 75 0.889 12.254 -10.142 1.00 0.00 C ATOM 1179 C ASN A 75 0.727 13.756 -9.957 1.00 0.00 C ATOM 1180 O ASN A 75 1.504 14.537 -10.468 1.00 0.00 O ATOM 1181 CB ASN A 75 -0.434 11.608 -10.557 1.00 0.00 C ATOM 1182 CG ASN A 75 -0.308 11.060 -11.980 1.00 0.00 C ATOM 1183 OD1 ASN A 75 0.737 10.573 -12.366 1.00 0.00 O ATOM 1184 ND2 ASN A 75 -1.335 11.119 -12.783 1.00 0.00 N ATOM 0 H ASN A 75 0.433 11.282 -8.303 1.00 0.00 H new ATOM 0 HA ASN A 75 1.655 12.089 -10.899 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.691 10.804 -9.867 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -1.240 12.340 -10.507 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -1.261 10.757 -13.734 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.212 11.527 -12.460 1.00 0.00 H new ATOM 1191 N SER A 76 -0.271 14.142 -9.199 1.00 0.00 N ATOM 1192 CA SER A 76 -0.540 15.593 -8.907 1.00 0.00 C ATOM 1193 C SER A 76 -2.038 15.816 -8.692 1.00 0.00 C ATOM 1194 O SER A 76 -2.545 16.893 -8.937 1.00 0.00 O ATOM 1195 CB SER A 76 -0.082 16.388 -10.136 1.00 0.00 C ATOM 1196 OG SER A 76 -0.717 17.659 -10.143 1.00 0.00 O ATOM 0 H SER A 76 -0.928 13.499 -8.758 1.00 0.00 H new ATOM 0 HA SER A 76 -0.012 15.909 -8.007 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.001 16.511 -10.120 1.00 0.00 H new ATOM 0 HB3 SER A 76 -0.327 15.842 -11.047 1.00 0.00 H new ATOM 0 HG SER A 76 -1.262 17.757 -9.334 1.00 0.00 H new ATOM 1202 N GLU A 77 -2.771 14.820 -8.263 1.00 0.00 N ATOM 1203 CA GLU A 77 -4.226 15.040 -8.085 1.00 0.00 C ATOM 1204 C GLU A 77 -4.627 15.009 -6.609 1.00 0.00 C ATOM 1205 O GLU A 77 -5.503 15.735 -6.183 1.00 0.00 O ATOM 1206 CB GLU A 77 -4.873 13.928 -8.921 1.00 0.00 C ATOM 1207 CG GLU A 77 -5.636 12.951 -8.043 1.00 0.00 C ATOM 1208 CD GLU A 77 -7.037 13.497 -7.761 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -7.226 14.693 -7.907 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -7.898 12.709 -7.406 1.00 0.00 O ATOM 0 H GLU A 77 -2.429 13.886 -8.034 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.554 16.025 -8.416 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.550 14.368 -9.653 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -4.103 13.395 -9.479 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -5.706 11.982 -8.536 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -5.101 12.794 -7.106 1.00 0.00 H new ATOM 1217 N ILE A 78 -4.010 14.181 -5.828 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.395 14.133 -4.382 1.00 0.00 C ATOM 1219 C ILE A 78 -3.168 14.100 -3.473 1.00 0.00 C ATOM 1220 O ILE A 78 -2.042 14.188 -3.919 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.195 12.845 -4.223 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.341 11.675 -4.693 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.467 12.920 -5.068 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -3.800 10.916 -3.492 1.00 0.00 C ATOM 0 H ILE A 78 -3.267 13.542 -6.111 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.964 15.019 -4.099 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.470 12.709 -3.177 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.934 11.008 -5.319 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.517 12.038 -5.307 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.036 11.998 -4.952 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.073 13.764 -4.739 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.200 13.052 -6.117 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.190 10.080 -3.834 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.191 11.584 -2.883 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.631 10.538 -2.896 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.392 13.974 -2.193 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.262 13.931 -1.227 1.00 0.00 C ATOM 1238 C LYS A 79 -2.731 13.326 0.094 1.00 0.00 C ATOM 1239 O LYS A 79 -3.913 13.170 0.328 1.00 0.00 O ATOM 1240 CB LYS A 79 -1.858 15.385 -1.027 1.00 0.00 C ATOM 1241 CG LYS A 79 -3.107 16.250 -0.862 1.00 0.00 C ATOM 1242 CD LYS A 79 -2.957 17.105 0.392 1.00 0.00 C ATOM 1243 CE LYS A 79 -3.742 16.469 1.539 1.00 0.00 C ATOM 1244 NZ LYS A 79 -5.002 17.256 1.628 1.00 0.00 N ATOM 0 H LYS A 79 -4.319 13.898 -1.774 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.432 13.322 -1.586 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -1.221 15.478 -0.147 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.275 15.731 -1.880 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -3.243 16.886 -1.737 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.993 15.620 -0.785 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.905 17.192 0.662 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -3.322 18.114 0.203 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.947 15.417 1.341 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.182 16.514 2.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.438 17.108 2.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.790 18.266 1.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.659 16.944 0.885 1.00 0.00 H new ATOM 1258 N ILE A 80 -1.822 12.988 0.965 1.00 0.00 N ATOM 1259 CA ILE A 80 -2.235 12.405 2.263 1.00 0.00 C ATOM 1260 C ILE A 80 -2.904 13.469 3.111 1.00 0.00 C ATOM 1261 O ILE A 80 -2.273 14.254 3.791 1.00 0.00 O ATOM 1262 CB ILE A 80 -0.958 11.914 2.910 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -0.602 10.554 2.316 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -1.161 11.781 4.422 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.425 10.681 0.801 1.00 0.00 C ATOM 0 H ILE A 80 -0.816 13.091 0.832 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.953 11.593 2.146 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.151 12.623 2.725 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.316 10.178 2.768 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.387 9.832 2.541 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.239 11.427 4.883 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.427 12.752 4.840 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.962 11.069 4.620 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.171 9.708 0.381 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.353 11.037 0.355 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.376 11.389 0.586 1.00 0.00 H new ATOM 1277 N THR A 81 -4.180 13.480 3.058 1.00 0.00 N ATOM 1278 CA THR A 81 -4.975 14.464 3.837 1.00 0.00 C ATOM 1279 C THR A 81 -5.534 13.791 5.088 1.00 0.00 C ATOM 1280 O THR A 81 -6.503 14.240 5.666 1.00 0.00 O ATOM 1281 CB THR A 81 -6.106 14.861 2.891 1.00 0.00 C ATOM 1282 OG1 THR A 81 -6.863 15.919 3.464 1.00 0.00 O ATOM 1283 CG2 THR A 81 -7.010 13.656 2.641 1.00 0.00 C ATOM 0 H THR A 81 -4.735 12.836 2.495 1.00 0.00 H new ATOM 0 HA THR A 81 -4.392 15.324 4.168 1.00 0.00 H new ATOM 0 HB THR A 81 -5.683 15.197 1.944 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.016 15.734 4.414 1.00 0.00 H new ATOM 0 HG21 THR A 81 -7.817 13.940 1.966 1.00 0.00 H new ATOM 0 HG22 THR A 81 -6.428 12.851 2.192 1.00 0.00 H new ATOM 0 HG23 THR A 81 -7.431 13.315 3.587 1.00 0.00 H new ATOM 1291 N SER A 82 -4.943 12.692 5.486 1.00 0.00 N ATOM 1292 CA SER A 82 -5.444 11.944 6.680 1.00 0.00 C ATOM 1293 C SER A 82 -6.745 11.216 6.323 1.00 0.00 C ATOM 1294 O SER A 82 -7.287 10.463 7.106 1.00 0.00 O ATOM 1295 CB SER A 82 -5.682 12.996 7.757 1.00 0.00 C ATOM 1296 OG SER A 82 -5.675 12.371 9.034 1.00 0.00 O ATOM 0 H SER A 82 -4.129 12.278 5.032 1.00 0.00 H new ATOM 0 HA SER A 82 -4.737 11.189 7.023 1.00 0.00 H new ATOM 0 HB2 SER A 82 -4.908 13.762 7.710 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.636 13.496 7.589 1.00 0.00 H new ATOM 0 HG SER A 82 -5.826 13.045 9.729 1.00 0.00 H new ATOM 1302 N ASP A 83 -7.230 11.422 5.128 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.467 10.737 4.680 1.00 0.00 C ATOM 1304 C ASP A 83 -8.081 9.723 3.612 1.00 0.00 C ATOM 1305 O ASP A 83 -8.506 8.585 3.634 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.344 11.837 4.088 1.00 0.00 C ATOM 1307 CG ASP A 83 -9.434 13.006 5.072 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -9.037 12.827 6.211 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -9.897 14.060 4.668 1.00 0.00 O ATOM 0 H ASP A 83 -6.812 12.045 4.437 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.988 10.212 5.480 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.928 12.178 3.140 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.340 11.448 3.877 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.238 10.121 2.696 1.00 0.00 N ATOM 1315 CA LEU A 84 -6.789 9.162 1.656 1.00 0.00 C ATOM 1316 C LEU A 84 -6.045 8.038 2.361 1.00 0.00 C ATOM 1317 O LEU A 84 -6.030 6.903 1.926 1.00 0.00 O ATOM 1318 CB LEU A 84 -5.864 9.965 0.745 1.00 0.00 C ATOM 1319 CG LEU A 84 -6.661 11.098 0.103 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -5.816 11.770 -0.980 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -7.936 10.523 -0.519 1.00 0.00 C ATOM 0 H LEU A 84 -6.846 11.060 2.626 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.599 8.719 1.076 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.029 10.369 1.318 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.440 9.320 -0.024 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.924 11.837 0.859 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.386 12.578 -1.437 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.907 12.174 -0.534 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.551 11.037 -1.742 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.511 11.327 -0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.671 9.786 -1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.536 10.046 0.256 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.460 8.359 3.480 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.742 7.333 4.277 1.00 0.00 C ATOM 1335 C LEU A 85 -5.763 6.527 5.067 1.00 0.00 C ATOM 1336 O LEU A 85 -5.714 5.318 5.137 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.877 8.126 5.251 1.00 0.00 C ATOM 1338 CG LEU A 85 -2.688 8.740 4.527 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -1.685 9.232 5.570 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -2.024 7.688 3.635 1.00 0.00 C ATOM 0 H LEU A 85 -5.450 9.298 3.878 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.156 6.653 3.658 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.471 8.911 5.718 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.526 7.473 6.050 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.021 9.571 3.905 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.825 9.676 5.067 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -2.159 9.980 6.206 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.354 8.392 6.181 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.173 8.133 3.119 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.681 6.855 4.248 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.744 7.326 2.901 1.00 0.00 H new ATOM 1352 N ASP A 86 -6.691 7.214 5.668 1.00 0.00 N ATOM 1353 CA ASP A 86 -7.735 6.518 6.473 1.00 0.00 C ATOM 1354 C ASP A 86 -8.262 5.304 5.713 1.00 0.00 C ATOM 1355 O ASP A 86 -8.441 4.240 6.273 1.00 0.00 O ATOM 1356 CB ASP A 86 -8.841 7.554 6.669 1.00 0.00 C ATOM 1357 CG ASP A 86 -9.654 7.204 7.916 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -9.310 6.231 8.569 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -10.605 7.913 8.199 1.00 0.00 O ATOM 0 H ASP A 86 -6.773 8.230 5.638 1.00 0.00 H new ATOM 0 HA ASP A 86 -7.349 6.152 7.425 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.408 8.549 6.772 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -9.490 7.578 5.794 1.00 0.00 H new ATOM 1364 N LYS A 87 -8.506 5.447 4.443 1.00 0.00 N ATOM 1365 CA LYS A 87 -9.014 4.289 3.658 1.00 0.00 C ATOM 1366 C LYS A 87 -7.844 3.400 3.239 1.00 0.00 C ATOM 1367 O LYS A 87 -7.919 2.189 3.307 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.704 4.895 2.438 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.660 6.003 2.889 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.720 5.415 3.824 1.00 0.00 C ATOM 1371 CE LYS A 87 -13.077 6.064 3.533 1.00 0.00 C ATOM 1372 NZ LYS A 87 -13.607 6.460 4.868 1.00 0.00 N ATOM 0 H LYS A 87 -8.377 6.310 3.916 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.702 3.667 4.231 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.961 5.299 1.750 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -10.253 4.124 1.897 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -10.106 6.790 3.400 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.138 6.460 2.023 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.784 4.336 3.685 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -11.439 5.586 4.863 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.969 6.929 2.878 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.749 5.367 3.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.536 6.913 4.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.705 5.615 5.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.950 7.129 5.318 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.754 3.987 2.828 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.581 3.159 2.437 1.00 0.00 C ATOM 1388 C ILE A 88 -5.125 2.365 3.659 1.00 0.00 C ATOM 1389 O ILE A 88 -4.897 1.173 3.599 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.521 4.174 1.980 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -4.514 4.229 0.460 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -3.126 3.780 2.481 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.327 5.677 0.008 1.00 0.00 C ATOM 0 H ILE A 88 -6.626 4.996 2.747 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.788 2.439 1.645 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.770 5.150 2.396 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.711 3.606 0.066 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.449 3.831 0.066 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.397 4.516 2.143 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.127 3.745 3.570 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.861 2.799 2.086 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.321 5.720 -1.081 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.145 6.286 0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.380 6.058 0.391 1.00 0.00 H new ATOM 1405 N PHE A 89 -5.014 3.027 4.772 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.598 2.336 6.018 1.00 0.00 C ATOM 1407 C PHE A 89 -5.648 1.305 6.386 1.00 0.00 C ATOM 1408 O PHE A 89 -5.359 0.268 6.950 1.00 0.00 O ATOM 1409 CB PHE A 89 -4.513 3.439 7.070 1.00 0.00 C ATOM 1410 CG PHE A 89 -4.178 2.835 8.413 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -3.269 1.774 8.496 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -4.777 3.337 9.576 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -2.957 1.215 9.741 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -4.466 2.776 10.821 1.00 0.00 C ATOM 1415 CZ PHE A 89 -3.556 1.715 10.903 1.00 0.00 C ATOM 0 H PHE A 89 -5.195 4.026 4.873 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.648 1.809 5.922 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.752 4.167 6.788 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.461 3.974 7.127 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -2.808 1.386 7.599 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -5.478 4.156 9.512 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.254 0.398 9.805 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -4.928 3.162 11.718 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.316 1.282 11.863 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.861 1.572 6.029 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.947 0.604 6.306 1.00 0.00 C ATOM 1427 C ALA A 90 -7.839 -0.507 5.273 1.00 0.00 C ATOM 1428 O ALA A 90 -8.157 -1.650 5.529 1.00 0.00 O ATOM 1429 CB ALA A 90 -9.250 1.386 6.139 1.00 0.00 C ATOM 0 H ALA A 90 -7.152 2.426 5.553 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.898 0.161 7.301 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.097 0.727 6.330 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.269 2.216 6.845 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.314 1.773 5.122 1.00 0.00 H new ATOM 1435 N GLY A 91 -7.348 -0.170 4.111 1.00 0.00 N ATOM 1436 CA GLY A 91 -7.165 -1.191 3.054 1.00 0.00 C ATOM 1437 C GLY A 91 -5.978 -2.057 3.458 1.00 0.00 C ATOM 1438 O GLY A 91 -6.017 -3.268 3.377 1.00 0.00 O ATOM 0 H GLY A 91 -7.066 0.775 3.852 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.064 -1.798 2.947 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.984 -0.717 2.089 1.00 0.00 H new ATOM 1442 N VAL A 92 -4.929 -1.436 3.931 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.747 -2.213 4.384 1.00 0.00 C ATOM 1444 C VAL A 92 -4.143 -3.007 5.629 1.00 0.00 C ATOM 1445 O VAL A 92 -3.503 -3.970 6.001 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.683 -1.161 4.713 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.684 -1.723 5.729 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -1.936 -0.776 3.434 1.00 0.00 C ATOM 0 H VAL A 92 -4.844 -0.424 4.022 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.378 -2.921 3.642 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.171 -0.283 5.137 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.932 -0.967 5.956 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.210 -1.997 6.643 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.198 -2.605 5.312 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.179 -0.027 3.666 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.456 -1.659 3.013 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.641 -0.366 2.710 1.00 0.00 H new ATOM 1458 N ASP A 93 -5.211 -2.607 6.267 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.674 -3.332 7.481 1.00 0.00 C ATOM 1460 C ASP A 93 -6.422 -4.597 7.063 1.00 0.00 C ATOM 1461 O ASP A 93 -6.474 -5.569 7.788 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.610 -2.349 8.191 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.474 -2.515 9.707 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -6.753 -3.599 10.191 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -6.092 -1.554 10.356 1.00 0.00 O ATOM 0 H ASP A 93 -5.783 -1.807 5.997 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.856 -3.644 8.130 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.366 -1.326 7.904 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.641 -2.528 7.886 1.00 0.00 H new ATOM 1470 N MET A 94 -6.990 -4.594 5.889 1.00 0.00 N ATOM 1471 CA MET A 94 -7.722 -5.801 5.414 1.00 0.00 C ATOM 1472 C MET A 94 -6.713 -6.845 4.936 1.00 0.00 C ATOM 1473 O MET A 94 -6.784 -8.002 5.301 1.00 0.00 O ATOM 1474 CB MET A 94 -8.598 -5.320 4.252 1.00 0.00 C ATOM 1475 CG MET A 94 -9.148 -3.924 4.557 1.00 0.00 C ATOM 1476 SD MET A 94 -10.783 -3.739 3.806 1.00 0.00 S ATOM 1477 CE MET A 94 -10.268 -4.046 2.101 1.00 0.00 C ATOM 0 H MET A 94 -6.979 -3.808 5.239 1.00 0.00 H new ATOM 0 HA MET A 94 -8.326 -6.260 6.197 1.00 0.00 H new ATOM 0 HB2 MET A 94 -8.015 -5.298 3.331 1.00 0.00 H new ATOM 0 HB3 MET A 94 -9.420 -6.017 4.092 1.00 0.00 H new ATOM 0 HG2 MET A 94 -9.213 -3.775 5.635 1.00 0.00 H new ATOM 0 HG3 MET A 94 -8.471 -3.163 4.170 1.00 0.00 H new ATOM 0 HE1 MET A 94 -11.095 -3.826 1.426 1.00 0.00 H new ATOM 0 HE2 MET A 94 -9.420 -3.407 1.856 1.00 0.00 H new ATOM 0 HE3 MET A 94 -9.978 -5.091 1.991 1.00 0.00 H new ATOM 1487 N ILE A 95 -5.760 -6.443 4.137 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.745 -7.403 3.663 1.00 0.00 C ATOM 1489 C ILE A 95 -4.008 -7.983 4.867 1.00 0.00 C ATOM 1490 O ILE A 95 -3.611 -9.131 4.874 1.00 0.00 O ATOM 1491 CB ILE A 95 -3.817 -6.565 2.793 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -3.272 -5.381 3.593 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -4.592 -6.040 1.588 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -2.058 -4.800 2.868 1.00 0.00 C ATOM 0 H ILE A 95 -5.648 -5.488 3.797 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.160 -8.246 3.110 1.00 0.00 H new ATOM 0 HB ILE A 95 -2.985 -7.186 2.460 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.042 -4.618 3.706 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.992 -5.703 4.596 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.930 -5.440 0.963 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.976 -6.880 1.008 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -5.424 -5.425 1.930 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.666 -3.955 3.434 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.287 -5.566 2.778 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.354 -4.464 1.874 1.00 0.00 H new ATOM 1506 N THR A 96 -3.856 -7.202 5.903 1.00 0.00 N ATOM 1507 CA THR A 96 -3.185 -7.717 7.122 1.00 0.00 C ATOM 1508 C THR A 96 -4.084 -8.783 7.734 1.00 0.00 C ATOM 1509 O THR A 96 -3.632 -9.811 8.197 1.00 0.00 O ATOM 1510 CB THR A 96 -3.052 -6.513 8.056 1.00 0.00 C ATOM 1511 OG1 THR A 96 -2.043 -5.643 7.564 1.00 0.00 O ATOM 1512 CG2 THR A 96 -2.676 -6.992 9.458 1.00 0.00 C ATOM 0 H THR A 96 -4.168 -6.232 5.954 1.00 0.00 H new ATOM 0 HA THR A 96 -2.209 -8.161 6.927 1.00 0.00 H new ATOM 0 HB THR A 96 -4.002 -5.980 8.100 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.445 -4.986 6.958 1.00 0.00 H new ATOM 0 HG21 THR A 96 -2.581 -6.133 10.123 1.00 0.00 H new ATOM 0 HG22 THR A 96 -3.451 -7.659 9.835 1.00 0.00 H new ATOM 0 HG23 THR A 96 -1.727 -7.526 9.418 1.00 0.00 H new ATOM 1520 N ARG A 97 -5.369 -8.547 7.710 1.00 0.00 N ATOM 1521 CA ARG A 97 -6.317 -9.554 8.261 1.00 0.00 C ATOM 1522 C ARG A 97 -6.526 -10.661 7.226 1.00 0.00 C ATOM 1523 O ARG A 97 -6.732 -11.811 7.561 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.622 -8.798 8.510 1.00 0.00 C ATOM 1525 CG ARG A 97 -7.472 -7.902 9.741 1.00 0.00 C ATOM 1526 CD ARG A 97 -8.432 -6.716 9.630 1.00 0.00 C ATOM 1527 NE ARG A 97 -8.134 -5.868 10.817 1.00 0.00 N ATOM 1528 CZ ARG A 97 -9.026 -5.021 11.253 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -9.204 -3.886 10.635 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -9.737 -5.308 12.308 1.00 0.00 N ATOM 0 H ARG A 97 -5.800 -7.703 7.334 1.00 0.00 H new ATOM 0 HA ARG A 97 -5.951 -10.018 9.177 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.876 -8.195 7.638 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.439 -9.503 8.659 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.684 -8.471 10.646 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.445 -7.546 9.822 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -8.274 -6.166 8.702 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -9.471 -7.047 9.632 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.233 -5.949 11.289 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -8.646 -3.661 9.811 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -9.901 -3.224 10.975 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -9.596 -6.194 12.792 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -10.434 -4.646 12.649 1.00 0.00 H new ATOM 1544 N MET A 98 -6.449 -10.323 5.966 1.00 0.00 N ATOM 1545 CA MET A 98 -6.614 -11.354 4.907 1.00 0.00 C ATOM 1546 C MET A 98 -5.354 -12.205 4.865 1.00 0.00 C ATOM 1547 O MET A 98 -5.388 -13.383 4.569 1.00 0.00 O ATOM 1548 CB MET A 98 -6.780 -10.574 3.603 1.00 0.00 C ATOM 1549 CG MET A 98 -8.065 -9.748 3.664 1.00 0.00 C ATOM 1550 SD MET A 98 -7.916 -8.318 2.566 1.00 0.00 S ATOM 1551 CE MET A 98 -8.546 -9.117 1.070 1.00 0.00 C ATOM 0 H MET A 98 -6.279 -9.376 5.627 1.00 0.00 H new ATOM 0 HA MET A 98 -7.465 -12.013 5.080 1.00 0.00 H new ATOM 0 HB2 MET A 98 -5.922 -9.920 3.446 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.816 -11.261 2.758 1.00 0.00 H new ATOM 0 HG2 MET A 98 -8.917 -10.360 3.368 1.00 0.00 H new ATOM 0 HG3 MET A 98 -8.249 -9.417 4.686 1.00 0.00 H new ATOM 0 HE1 MET A 98 -8.526 -8.408 0.243 1.00 0.00 H new ATOM 0 HE2 MET A 98 -7.922 -9.977 0.826 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.570 -9.449 1.239 1.00 0.00 H new ATOM 1561 N VAL A 99 -4.240 -11.611 5.182 1.00 0.00 N ATOM 1562 CA VAL A 99 -2.969 -12.373 5.184 1.00 0.00 C ATOM 1563 C VAL A 99 -2.872 -13.182 6.477 1.00 0.00 C ATOM 1564 O VAL A 99 -2.368 -14.288 6.492 1.00 0.00 O ATOM 1565 CB VAL A 99 -1.873 -11.308 5.104 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.552 -11.874 5.631 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.694 -10.874 3.647 1.00 0.00 C ATOM 0 H VAL A 99 -4.157 -10.628 5.440 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.888 -13.081 4.360 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.162 -10.451 5.712 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.222 -11.109 5.570 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.677 -12.182 6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.259 -12.735 5.030 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.914 -10.115 3.587 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.410 -11.736 3.043 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.631 -10.462 3.272 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.380 -12.655 7.560 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.338 -13.425 8.832 1.00 0.00 C ATOM 1579 C ASP A 100 -4.222 -14.652 8.665 1.00 0.00 C ATOM 1580 O ASP A 100 -3.993 -15.691 9.251 1.00 0.00 O ATOM 1581 CB ASP A 100 -3.900 -12.482 9.898 1.00 0.00 C ATOM 1582 CG ASP A 100 -3.187 -12.727 11.229 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -1.985 -12.933 11.206 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -3.855 -12.704 12.250 1.00 0.00 O ATOM 0 H ASP A 100 -3.817 -11.735 7.617 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.338 -13.760 9.107 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -3.766 -11.446 9.588 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.972 -12.645 10.013 1.00 0.00 H new ATOM 1589 N LYS A 101 -5.218 -14.537 7.833 1.00 0.00 N ATOM 1590 CA LYS A 101 -6.114 -15.689 7.574 1.00 0.00 C ATOM 1591 C LYS A 101 -5.555 -16.488 6.391 1.00 0.00 C ATOM 1592 O LYS A 101 -5.884 -17.636 6.195 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.487 -15.066 7.272 1.00 0.00 C ATOM 1594 CG LYS A 101 -7.737 -15.042 5.767 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.092 -16.445 5.299 1.00 0.00 C ATOM 1596 CE LYS A 101 -9.543 -16.476 4.818 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.357 -16.215 6.038 1.00 0.00 N ATOM 0 H LYS A 101 -5.449 -13.687 7.319 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.194 -16.385 8.409 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.271 -15.638 7.769 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.530 -14.053 7.671 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -8.546 -14.351 5.531 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -6.850 -14.684 5.244 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -7.425 -16.749 4.493 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -7.953 -17.156 6.113 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.722 -15.719 4.054 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.792 -17.441 4.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -11.317 -16.592 5.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -9.915 -16.681 6.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.408 -15.190 6.209 1.00 0.00 H new ATOM 1611 N ILE A 102 -4.696 -15.888 5.611 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.099 -16.624 4.464 1.00 0.00 C ATOM 1613 C ILE A 102 -3.035 -17.558 5.034 1.00 0.00 C ATOM 1614 O ILE A 102 -3.056 -18.754 4.823 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.513 -15.532 3.553 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -4.219 -15.571 2.200 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.006 -15.729 3.336 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.260 -14.159 1.613 1.00 0.00 C ATOM 0 H ILE A 102 -4.384 -14.923 5.720 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.798 -17.236 3.894 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.667 -14.568 4.039 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -3.695 -16.244 1.522 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.231 -15.959 2.315 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -1.626 -14.940 2.688 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.492 -15.689 4.296 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -1.829 -16.698 2.870 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.763 -14.181 0.646 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.803 -13.499 2.290 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.243 -13.789 1.484 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.136 -17.018 5.806 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.109 -17.874 6.444 1.00 0.00 C ATOM 1632 C VAL A 103 -1.844 -18.878 7.326 1.00 0.00 C ATOM 1633 O VAL A 103 -1.385 -19.977 7.568 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.266 -16.915 7.286 1.00 0.00 C ATOM 1635 CG1 VAL A 103 0.543 -17.708 8.313 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.688 -16.141 6.374 1.00 0.00 C ATOM 0 H VAL A 103 -2.070 -16.023 6.021 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.482 -18.423 5.742 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.923 -16.216 7.805 1.00 0.00 H new ATOM 0 HG11 VAL A 103 1.143 -17.022 8.912 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.136 -18.259 8.964 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.200 -18.408 7.797 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.289 -15.457 6.973 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.343 -16.841 5.855 1.00 0.00 H new ATOM 0 HG23 VAL A 103 0.112 -15.573 5.643 1.00 0.00 H new ATOM 1646 N SER A 104 -3.004 -18.493 7.792 1.00 0.00 N ATOM 1647 CA SER A 104 -3.817 -19.399 8.648 1.00 0.00 C ATOM 1648 C SER A 104 -4.611 -20.364 7.778 1.00 0.00 C ATOM 1649 O SER A 104 -4.457 -21.567 7.850 1.00 0.00 O ATOM 1650 CB SER A 104 -4.760 -18.471 9.408 1.00 0.00 C ATOM 1651 OG SER A 104 -5.474 -19.221 10.381 1.00 0.00 O ATOM 0 H SER A 104 -3.424 -17.581 7.613 1.00 0.00 H new ATOM 0 HA SER A 104 -3.204 -20.002 9.318 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.194 -17.674 9.890 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.456 -17.995 8.717 1.00 0.00 H new ATOM 0 HG SER A 104 -6.079 -18.627 10.872 1.00 0.00 H new ATOM 1657 N GLU A 105 -5.457 -19.834 6.957 1.00 0.00 N ATOM 1658 CA GLU A 105 -6.282 -20.698 6.060 1.00 0.00 C ATOM 1659 C GLU A 105 -5.686 -20.705 4.653 1.00 0.00 C ATOM 1660 O GLU A 105 -5.610 -21.728 4.002 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.676 -20.061 6.042 1.00 0.00 C ATOM 1662 CG GLU A 105 -8.038 -19.545 7.437 1.00 0.00 C ATOM 1663 CD GLU A 105 -9.547 -19.670 7.652 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -10.224 -20.092 6.729 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -10.001 -19.341 8.735 1.00 0.00 O ATOM 0 H GLU A 105 -5.621 -18.832 6.861 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.316 -21.731 6.407 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.700 -19.240 5.325 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.414 -20.793 5.714 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.503 -20.115 8.197 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.730 -18.505 7.543 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.263 -19.566 4.181 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.669 -19.497 2.816 1.00 0.00 C ATOM 1674 C GLY A 106 -5.617 -18.753 1.875 1.00 0.00 C ATOM 1675 O GLY A 106 -5.577 -18.929 0.674 1.00 0.00 O ATOM 0 H GLY A 106 -5.303 -18.678 4.682 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -3.706 -18.988 2.854 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.483 -20.503 2.439 1.00 0.00 H new ATOM 1679 N SER A 107 -6.475 -17.923 2.406 1.00 0.00 N ATOM 1680 CA SER A 107 -7.424 -17.177 1.523 1.00 0.00 C ATOM 1681 C SER A 107 -7.510 -15.706 1.914 1.00 0.00 C ATOM 1682 O SER A 107 -7.809 -15.357 3.033 1.00 0.00 O ATOM 1683 CB SER A 107 -8.776 -17.850 1.725 1.00 0.00 C ATOM 1684 OG SER A 107 -8.709 -19.191 1.260 1.00 0.00 O ATOM 0 H SER A 107 -6.561 -17.729 3.404 1.00 0.00 H new ATOM 0 HA SER A 107 -7.096 -17.203 0.484 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.050 -17.832 2.780 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.550 -17.305 1.186 1.00 0.00 H new ATOM 0 HG SER A 107 -9.577 -19.626 1.391 1.00 0.00 H new ATOM 1690 N ASP A 108 -7.290 -14.834 0.981 1.00 0.00 N ATOM 1691 CA ASP A 108 -7.398 -13.384 1.293 1.00 0.00 C ATOM 1692 C ASP A 108 -8.873 -12.991 1.353 1.00 0.00 C ATOM 1693 O ASP A 108 -9.213 -11.836 1.516 1.00 0.00 O ATOM 1694 CB ASP A 108 -6.710 -12.665 0.136 1.00 0.00 C ATOM 1695 CG ASP A 108 -7.391 -13.047 -1.180 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -7.783 -14.194 -1.310 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -7.509 -12.185 -2.033 1.00 0.00 O ATOM 0 H ASP A 108 -7.041 -15.057 0.017 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.942 -13.130 2.250 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.759 -11.586 0.283 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.654 -12.934 0.103 1.00 0.00 H new ATOM 1702 N ASP A 109 -9.753 -13.947 1.214 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.209 -13.630 1.254 1.00 0.00 C ATOM 1704 C ASP A 109 -11.683 -13.469 2.701 1.00 0.00 C ATOM 1705 O ASP A 109 -11.813 -14.431 3.431 1.00 0.00 O ATOM 1706 CB ASP A 109 -11.891 -14.829 0.598 1.00 0.00 C ATOM 1707 CG ASP A 109 -11.231 -15.118 -0.752 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -10.915 -14.169 -1.450 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -11.055 -16.283 -1.065 1.00 0.00 O ATOM 0 H ASP A 109 -9.526 -14.932 1.075 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.440 -12.696 0.742 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -11.816 -15.703 1.246 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -12.953 -14.626 0.459 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.951 -12.263 3.118 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.428 -12.050 4.515 1.00 0.00 C ATOM 1716 C ILE A 110 -13.747 -11.273 4.506 1.00 0.00 C ATOM 1717 O ILE A 110 -14.087 -10.594 5.454 1.00 0.00 O ATOM 1718 CB ILE A 110 -11.326 -11.238 5.202 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -11.219 -9.865 4.535 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -9.986 -11.971 5.084 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -10.440 -8.915 5.448 1.00 0.00 C ATOM 0 H ILE A 110 -11.861 -11.417 2.555 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.615 -12.990 5.034 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.573 -11.116 6.257 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.717 -9.955 3.572 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -12.214 -9.465 4.340 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.207 -11.387 5.575 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.062 -12.948 5.561 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.733 -12.100 4.032 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -10.363 -7.936 4.974 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.961 -8.817 6.400 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.441 -9.314 5.621 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.496 -11.372 3.440 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.795 -10.644 3.368 1.00 0.00 C ATOM 1735 C GLY A 111 -15.560 -9.208 2.897 1.00 0.00 C ATOM 1736 O GLY A 111 -16.490 -8.465 2.652 1.00 0.00 O ATOM 0 H GLY A 111 -14.264 -11.926 2.616 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.471 -11.155 2.682 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.275 -10.641 4.346 1.00 0.00 H new ATOM 1740 N GLU A 112 -14.324 -8.809 2.770 1.00 0.00 N ATOM 1741 CA GLU A 112 -14.034 -7.417 2.316 1.00 0.00 C ATOM 1742 C GLU A 112 -14.319 -7.269 0.819 1.00 0.00 C ATOM 1743 O GLU A 112 -14.577 -8.235 0.128 1.00 0.00 O ATOM 1744 CB GLU A 112 -12.546 -7.209 2.601 1.00 0.00 C ATOM 1745 CG GLU A 112 -12.348 -6.927 4.090 1.00 0.00 C ATOM 1746 CD GLU A 112 -13.015 -5.600 4.450 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -13.413 -4.892 3.539 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -13.120 -5.313 5.632 1.00 0.00 O ATOM 0 H GLU A 112 -13.503 -9.384 2.960 1.00 0.00 H new ATOM 0 HA GLU A 112 -14.656 -6.682 2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.981 -8.095 2.309 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -12.164 -6.378 2.008 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -12.776 -7.734 4.684 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -11.284 -6.887 4.325 1.00 0.00 H new ATOM 1755 N ASN A 113 -14.277 -6.066 0.315 1.00 0.00 N ATOM 1756 CA ASN A 113 -14.549 -5.853 -1.137 1.00 0.00 C ATOM 1757 C ASN A 113 -13.384 -5.116 -1.799 1.00 0.00 C ATOM 1758 O ASN A 113 -12.586 -4.480 -1.144 1.00 0.00 O ATOM 1759 CB ASN A 113 -15.818 -5.002 -1.180 1.00 0.00 C ATOM 1760 CG ASN A 113 -16.843 -5.555 -0.188 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -16.705 -5.384 1.007 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -17.875 -6.216 -0.637 1.00 0.00 N ATOM 0 H ASN A 113 -14.066 -5.221 0.845 1.00 0.00 H new ATOM 0 HA ASN A 113 -14.669 -6.794 -1.674 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.582 -3.967 -0.934 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -16.235 -5.004 -2.187 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.565 -6.589 0.015 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.991 -6.360 -1.640 1.00 0.00 H new ATOM 1769 N ILE A 114 -13.289 -5.193 -3.100 1.00 0.00 N ATOM 1770 CA ILE A 114 -12.186 -4.487 -3.813 1.00 0.00 C ATOM 1771 C ILE A 114 -12.789 -3.455 -4.762 1.00 0.00 C ATOM 1772 O ILE A 114 -12.786 -2.271 -4.489 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.432 -5.579 -4.589 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.375 -6.209 -3.682 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -10.738 -4.970 -5.812 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -11.031 -6.692 -2.390 1.00 0.00 C ATOM 0 H ILE A 114 -13.928 -5.715 -3.700 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.514 -3.958 -3.137 1.00 0.00 H new ATOM 0 HB ILE A 114 -12.144 -6.337 -4.916 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -9.894 -7.044 -4.192 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -9.595 -5.482 -3.456 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -10.206 -5.751 -6.355 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -11.484 -4.517 -6.465 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -10.030 -4.208 -5.487 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.276 -7.141 -1.744 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -11.491 -5.847 -1.877 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.795 -7.433 -2.625 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.327 -3.889 -5.868 1.00 0.00 N ATOM 1789 CA ASP A 115 -13.944 -2.916 -6.805 1.00 0.00 C ATOM 1790 C ASP A 115 -14.845 -1.983 -6.010 1.00 0.00 C ATOM 1791 O ASP A 115 -15.086 -0.852 -6.380 1.00 0.00 O ATOM 1792 CB ASP A 115 -14.759 -3.755 -7.791 1.00 0.00 C ATOM 1793 CG ASP A 115 -15.632 -2.833 -8.643 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -15.081 -2.126 -9.471 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -16.837 -2.849 -8.452 1.00 0.00 O ATOM 0 H ASP A 115 -13.365 -4.866 -6.160 1.00 0.00 H new ATOM 0 HA ASP A 115 -13.210 -2.306 -7.331 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -14.093 -4.335 -8.429 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -15.383 -4.467 -7.251 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.323 -2.462 -4.904 1.00 0.00 N ATOM 1801 CA VAL A 116 -16.199 -1.631 -4.037 1.00 0.00 C ATOM 1802 C VAL A 116 -15.355 -0.875 -3.023 1.00 0.00 C ATOM 1803 O VAL A 116 -15.479 0.323 -2.859 1.00 0.00 O ATOM 1804 CB VAL A 116 -17.132 -2.615 -3.337 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -18.112 -1.848 -2.448 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -17.911 -3.414 -4.385 1.00 0.00 C ATOM 0 H VAL A 116 -15.144 -3.404 -4.557 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.759 -0.889 -4.606 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.544 -3.297 -2.723 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.778 -2.552 -1.949 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -17.558 -1.280 -1.701 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -18.700 -1.164 -3.060 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.577 -4.117 -3.885 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.498 -2.732 -5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.213 -3.963 -5.017 1.00 0.00 H new ATOM 1816 N PHE A 117 -14.490 -1.565 -2.350 1.00 0.00 N ATOM 1817 CA PHE A 117 -13.623 -0.876 -1.351 1.00 0.00 C ATOM 1818 C PHE A 117 -12.690 0.089 -2.078 1.00 0.00 C ATOM 1819 O PHE A 117 -12.177 1.031 -1.504 1.00 0.00 O ATOM 1820 CB PHE A 117 -12.827 -1.980 -0.663 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.009 -1.381 0.457 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -12.616 -1.075 1.681 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -10.646 -1.126 0.269 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -11.859 -0.516 2.717 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -9.889 -0.567 1.304 1.00 0.00 C ATOM 1826 CZ PHE A 117 -10.496 -0.261 2.529 1.00 0.00 C ATOM 0 H PHE A 117 -14.341 -2.570 -2.442 1.00 0.00 H new ATOM 0 HA PHE A 117 -14.198 -0.299 -0.627 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.502 -2.740 -0.270 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -12.174 -2.475 -1.381 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -13.668 -1.270 1.826 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.178 -1.361 -0.676 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -12.327 -0.281 3.662 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -8.837 -0.371 1.159 1.00 0.00 H new ATOM 0 HZ PHE A 117 -9.912 0.172 3.328 1.00 0.00 H new ATOM 1836 N SER A 118 -12.492 -0.123 -3.349 1.00 0.00 N ATOM 1837 CA SER A 118 -11.624 0.783 -4.126 1.00 0.00 C ATOM 1838 C SER A 118 -12.490 1.888 -4.684 1.00 0.00 C ATOM 1839 O SER A 118 -12.136 3.045 -4.669 1.00 0.00 O ATOM 1840 CB SER A 118 -11.040 -0.076 -5.246 1.00 0.00 C ATOM 1841 OG SER A 118 -10.453 0.767 -6.228 1.00 0.00 O ATOM 0 H SER A 118 -12.900 -0.892 -3.880 1.00 0.00 H new ATOM 0 HA SER A 118 -10.828 1.238 -3.537 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.293 -0.760 -4.843 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.822 -0.688 -5.696 1.00 0.00 H new ATOM 0 HG SER A 118 -9.477 0.702 -6.173 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.647 1.522 -5.141 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.590 2.531 -5.685 1.00 0.00 C ATOM 1849 C ASP A 119 -14.997 3.464 -4.563 1.00 0.00 C ATOM 1850 O ASP A 119 -15.282 4.625 -4.767 1.00 0.00 O ATOM 1851 CB ASP A 119 -15.790 1.737 -6.203 1.00 0.00 C ATOM 1852 CG ASP A 119 -16.868 2.704 -6.693 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -16.582 3.888 -6.776 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -17.962 2.246 -6.979 1.00 0.00 O ATOM 0 H ASP A 119 -13.984 0.560 -5.162 1.00 0.00 H new ATOM 0 HA ASP A 119 -14.157 3.136 -6.482 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.481 1.079 -7.015 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -16.188 1.102 -5.412 1.00 0.00 H new ATOM 1859 N THR A 120 -14.977 2.958 -3.373 1.00 0.00 N ATOM 1860 CA THR A 120 -15.311 3.798 -2.196 1.00 0.00 C ATOM 1861 C THR A 120 -14.221 4.845 -2.075 1.00 0.00 C ATOM 1862 O THR A 120 -14.459 6.036 -2.061 1.00 0.00 O ATOM 1863 CB THR A 120 -15.322 2.817 -1.009 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.667 2.519 -0.662 1.00 0.00 O ATOM 1865 CG2 THR A 120 -14.609 3.422 0.204 1.00 0.00 C ATOM 0 H THR A 120 -14.742 1.989 -3.159 1.00 0.00 H new ATOM 0 HA THR A 120 -16.266 4.320 -2.255 1.00 0.00 H new ATOM 0 HB THR A 120 -14.798 1.908 -1.303 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.679 1.893 0.092 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.629 2.711 1.030 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.575 3.646 -0.056 1.00 0.00 H new ATOM 0 HG23 THR A 120 -15.115 4.340 0.503 1.00 0.00 H new ATOM 1873 N ILE A 121 -13.018 4.383 -2.028 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.856 5.298 -1.953 1.00 0.00 C ATOM 1875 C ILE A 121 -11.805 6.123 -3.241 1.00 0.00 C ATOM 1876 O ILE A 121 -11.612 7.322 -3.222 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.656 4.351 -1.814 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -9.951 4.635 -0.490 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.667 4.513 -2.978 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -9.084 5.892 -0.618 1.00 0.00 C ATOM 0 H ILE A 121 -12.781 3.391 -2.038 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.887 6.012 -1.130 1.00 0.00 H new ATOM 0 HB ILE A 121 -11.022 3.325 -1.835 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -10.687 4.770 0.302 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -9.332 3.783 -0.208 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.831 3.826 -2.844 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -10.172 4.291 -3.918 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -9.295 5.537 -2.999 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.585 6.088 0.331 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -8.337 5.741 -1.397 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -9.713 6.743 -0.879 1.00 0.00 H new ATOM 1892 N LYS A 122 -11.997 5.479 -4.361 1.00 0.00 N ATOM 1893 CA LYS A 122 -11.986 6.206 -5.647 1.00 0.00 C ATOM 1894 C LYS A 122 -13.154 7.180 -5.661 1.00 0.00 C ATOM 1895 O LYS A 122 -13.077 8.263 -6.207 1.00 0.00 O ATOM 1896 CB LYS A 122 -12.161 5.118 -6.703 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.808 4.862 -7.359 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.319 3.454 -7.019 1.00 0.00 C ATOM 1899 CE LYS A 122 -9.045 3.550 -6.173 1.00 0.00 C ATOM 1900 NZ LYS A 122 -7.995 2.874 -6.983 1.00 0.00 N ATOM 0 H LYS A 122 -12.161 4.475 -4.433 1.00 0.00 H new ATOM 0 HA LYS A 122 -11.077 6.782 -5.820 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.540 4.204 -6.246 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.892 5.428 -7.450 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.892 4.976 -8.440 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -10.083 5.600 -7.016 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.091 2.910 -6.474 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.121 2.895 -7.933 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.781 4.588 -5.972 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.174 3.062 -5.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.108 2.838 -6.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.301 1.906 -7.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.841 3.404 -7.864 1.00 0.00 H new ATOM 1914 N SER A 123 -14.229 6.807 -5.029 1.00 0.00 N ATOM 1915 CA SER A 123 -15.400 7.711 -4.965 1.00 0.00 C ATOM 1916 C SER A 123 -15.120 8.810 -3.953 1.00 0.00 C ATOM 1917 O SER A 123 -15.773 9.835 -3.925 1.00 0.00 O ATOM 1918 CB SER A 123 -16.553 6.840 -4.492 1.00 0.00 C ATOM 1919 OG SER A 123 -17.068 6.101 -5.591 1.00 0.00 O ATOM 0 H SER A 123 -14.344 5.912 -4.554 1.00 0.00 H new ATOM 0 HA SER A 123 -15.622 8.183 -5.922 1.00 0.00 H new ATOM 0 HB2 SER A 123 -16.213 6.161 -3.710 1.00 0.00 H new ATOM 0 HB3 SER A 123 -17.337 7.460 -4.057 1.00 0.00 H new ATOM 0 HG SER A 123 -16.571 5.261 -5.682 1.00 0.00 H new ATOM 1925 N PHE A 124 -14.135 8.604 -3.132 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.784 9.639 -2.121 1.00 0.00 C ATOM 1927 C PHE A 124 -13.027 10.777 -2.798 1.00 0.00 C ATOM 1928 O PHE A 124 -12.644 11.747 -2.175 1.00 0.00 O ATOM 1929 CB PHE A 124 -12.887 8.930 -1.111 1.00 0.00 C ATOM 1930 CG PHE A 124 -12.544 9.885 0.008 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -13.438 10.073 1.068 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -11.332 10.586 -0.019 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -13.120 10.962 2.103 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -11.014 11.474 1.015 1.00 0.00 C ATOM 1935 CZ PHE A 124 -11.907 11.663 2.076 1.00 0.00 C ATOM 0 H PHE A 124 -13.556 7.765 -3.115 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.664 10.068 -1.643 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -13.393 8.051 -0.712 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.977 8.580 -1.598 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -14.373 9.533 1.088 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -10.643 10.441 -0.838 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -13.810 11.107 2.921 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -10.079 12.014 0.994 1.00 0.00 H new ATOM 0 HZ PHE A 124 -11.661 12.349 2.873 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.814 10.658 -4.075 1.00 0.00 N ATOM 1946 CA ALA A 125 -12.082 11.723 -4.817 1.00 0.00 C ATOM 1947 C ALA A 125 -12.797 12.033 -6.134 1.00 0.00 C ATOM 1948 O ALA A 125 -12.263 12.695 -7.001 1.00 0.00 O ATOM 1949 CB ALA A 125 -10.695 11.138 -5.081 1.00 0.00 C ATOM 0 H ALA A 125 -13.116 9.866 -4.642 1.00 0.00 H new ATOM 0 HA ALA A 125 -12.029 12.657 -4.258 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -10.092 11.864 -5.626 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -10.212 10.904 -4.132 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.791 10.228 -5.673 1.00 0.00 H new ATOM 1955 N SER A 126 -14.003 11.558 -6.293 1.00 0.00 N ATOM 1956 CA SER A 126 -14.751 11.828 -7.554 1.00 0.00 C ATOM 1957 C SER A 126 -14.975 13.332 -7.721 1.00 0.00 C ATOM 1958 O SER A 126 -15.598 13.972 -6.897 1.00 0.00 O ATOM 1959 CB SER A 126 -16.085 11.102 -7.387 1.00 0.00 C ATOM 1960 OG SER A 126 -16.906 11.365 -8.517 1.00 0.00 O ATOM 0 H SER A 126 -14.502 10.995 -5.604 1.00 0.00 H new ATOM 0 HA SER A 126 -14.211 11.487 -8.437 1.00 0.00 H new ATOM 0 HB2 SER A 126 -15.919 10.030 -7.285 1.00 0.00 H new ATOM 0 HB3 SER A 126 -16.582 11.435 -6.476 1.00 0.00 H new ATOM 0 HG SER A 126 -17.762 10.900 -8.415 1.00 0.00 H new ATOM 1966 N SER A 127 -14.471 13.904 -8.781 1.00 0.00 N ATOM 1967 CA SER A 127 -14.655 15.368 -8.996 1.00 0.00 C ATOM 1968 C SER A 127 -15.889 15.627 -9.866 1.00 0.00 C ATOM 1969 O SER A 127 -15.922 15.283 -11.030 1.00 0.00 O ATOM 1970 CB SER A 127 -13.387 15.823 -9.714 1.00 0.00 C ATOM 1971 OG SER A 127 -13.170 17.204 -9.457 1.00 0.00 O ATOM 0 H SER A 127 -13.941 13.422 -9.506 1.00 0.00 H new ATOM 0 HA SER A 127 -14.810 15.906 -8.061 1.00 0.00 H new ATOM 0 HB2 SER A 127 -12.532 15.239 -9.372 1.00 0.00 H new ATOM 0 HB3 SER A 127 -13.481 15.652 -10.786 1.00 0.00 H new ATOM 0 HG SER A 127 -12.355 17.498 -9.916 1.00 0.00 H new ATOM 1977 N GLY A 128 -16.903 16.231 -9.308 1.00 0.00 N ATOM 1978 CA GLY A 128 -18.132 16.512 -10.100 1.00 0.00 C ATOM 1979 C GLY A 128 -18.178 17.999 -10.459 1.00 0.00 C ATOM 1980 O GLY A 128 -19.028 18.734 -9.998 1.00 0.00 O ATOM 0 H GLY A 128 -16.932 16.542 -8.337 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -18.139 15.907 -11.007 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -19.018 16.238 -9.527 1.00 0.00 H new ATOM 1984 N LYS A 129 -17.265 18.448 -11.278 1.00 0.00 N ATOM 1985 CA LYS A 129 -17.251 19.887 -11.668 1.00 0.00 C ATOM 1986 C LYS A 129 -17.456 20.773 -10.437 1.00 0.00 C ATOM 1987 O LYS A 129 -18.162 21.761 -10.482 1.00 0.00 O ATOM 1988 CB LYS A 129 -18.419 20.047 -12.642 1.00 0.00 C ATOM 1989 CG LYS A 129 -17.944 19.742 -14.064 1.00 0.00 C ATOM 1990 CD LYS A 129 -19.146 19.389 -14.941 1.00 0.00 C ATOM 1991 CE LYS A 129 -18.709 18.415 -16.039 1.00 0.00 C ATOM 1992 NZ LYS A 129 -19.443 18.857 -17.257 1.00 0.00 N ATOM 0 H LYS A 129 -16.528 17.879 -11.694 1.00 0.00 H new ATOM 0 HA LYS A 129 -16.302 20.182 -12.117 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -19.231 19.374 -12.366 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -18.814 21.062 -12.589 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -17.421 20.605 -14.476 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -17.234 18.915 -14.052 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -19.933 18.941 -14.335 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -19.563 20.292 -15.386 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -17.630 18.451 -16.193 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -18.960 17.387 -15.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -19.196 18.237 -18.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -20.467 18.806 -17.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -19.179 19.837 -17.485 1.00 0.00 H new ATOM 2006 N GLU A 130 -16.842 20.431 -9.338 1.00 0.00 N ATOM 2007 CA GLU A 130 -17.004 21.258 -8.107 1.00 0.00 C ATOM 2008 C GLU A 130 -16.040 20.781 -7.017 1.00 0.00 C ATOM 2009 O GLU A 130 -16.332 19.866 -6.274 1.00 0.00 O ATOM 2010 CB GLU A 130 -18.455 21.047 -7.672 1.00 0.00 C ATOM 2011 CG GLU A 130 -19.174 22.397 -7.626 1.00 0.00 C ATOM 2012 CD GLU A 130 -20.650 22.177 -7.292 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -20.977 22.167 -6.116 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -21.430 22.022 -8.217 1.00 0.00 O ATOM 0 H GLU A 130 -16.236 19.617 -9.238 1.00 0.00 H new ATOM 0 HA GLU A 130 -16.783 22.310 -8.286 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -18.961 20.377 -8.367 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -18.487 20.572 -6.691 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -18.713 23.041 -6.878 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -19.079 22.905 -8.586 1.00 0.00 H new ATOM 2021 N LYS A 131 -14.893 21.396 -6.916 1.00 0.00 N ATOM 2022 CA LYS A 131 -13.912 20.978 -5.873 1.00 0.00 C ATOM 2023 C LYS A 131 -14.032 21.886 -4.644 1.00 0.00 C ATOM 2024 O LYS A 131 -13.135 21.964 -3.828 1.00 0.00 O ATOM 2025 CB LYS A 131 -12.540 21.137 -6.532 1.00 0.00 C ATOM 2026 CG LYS A 131 -11.668 19.925 -6.201 1.00 0.00 C ATOM 2027 CD LYS A 131 -10.928 20.174 -4.886 1.00 0.00 C ATOM 2028 CE LYS A 131 -10.170 18.907 -4.480 1.00 0.00 C ATOM 2029 NZ LYS A 131 -9.925 19.059 -3.018 1.00 0.00 N ATOM 0 H LYS A 131 -14.593 22.169 -7.510 1.00 0.00 H new ATOM 0 HA LYS A 131 -14.080 19.957 -5.530 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -12.653 21.232 -7.612 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.060 22.050 -6.180 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -12.286 19.031 -6.120 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -10.954 19.747 -7.005 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.233 21.006 -4.999 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -11.635 20.453 -4.105 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -10.755 18.012 -4.692 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -9.234 18.813 -5.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -9.409 18.228 -2.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -9.361 19.916 -2.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -10.835 19.139 -2.520 1.00 0.00 H new ATOM 2043 N LEU A 132 -15.134 22.571 -4.509 1.00 0.00 N ATOM 2044 CA LEU A 132 -15.316 23.472 -3.333 1.00 0.00 C ATOM 2045 C LEU A 132 -14.308 24.624 -3.382 1.00 0.00 C ATOM 2046 O LEU A 132 -13.374 24.612 -4.160 1.00 0.00 O ATOM 2047 CB LEU A 132 -15.061 22.588 -2.111 1.00 0.00 C ATOM 2048 CG LEU A 132 -15.941 23.053 -0.950 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -17.030 22.012 -0.683 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -15.081 23.222 0.305 1.00 0.00 C ATOM 0 H LEU A 132 -15.917 22.547 -5.162 1.00 0.00 H new ATOM 0 HA LEU A 132 -16.308 23.922 -3.311 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.278 21.547 -2.351 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -14.010 22.637 -1.827 1.00 0.00 H new ATOM 0 HG LEU A 132 -16.405 24.006 -1.206 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -17.656 22.345 0.145 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -17.643 21.890 -1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -16.567 21.059 -0.427 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -15.707 23.553 1.133 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.617 22.269 0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -14.305 23.964 0.117 1.00 0.00 H new ATOM 2062 N GLU A 133 -14.490 25.618 -2.556 1.00 0.00 N ATOM 2063 CA GLU A 133 -13.543 26.770 -2.550 1.00 0.00 C ATOM 2064 C GLU A 133 -13.393 27.342 -3.963 1.00 0.00 C ATOM 2065 O GLU A 133 -12.266 27.529 -4.389 1.00 0.00 O ATOM 2066 CB GLU A 133 -12.215 26.191 -2.060 1.00 0.00 C ATOM 2067 CG GLU A 133 -11.592 27.142 -1.037 1.00 0.00 C ATOM 2068 CD GLU A 133 -10.070 27.136 -1.194 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -9.610 26.953 -2.309 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -9.390 27.312 -0.196 1.00 0.00 O ATOM 0 H GLU A 133 -15.255 25.682 -1.884 1.00 0.00 H new ATOM 0 HA GLU A 133 -13.890 27.585 -1.915 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.377 25.211 -1.611 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.536 26.048 -2.901 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -11.979 28.151 -1.180 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -11.865 26.836 -0.027 1.00 0.00 H new TER 2077 GLU A 133