USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 688 hydrogens (22 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: T 69 SER OG : rot 103:sc= 1 USER MOD Set 1.2: T 71 THR OG1 : rot 180:sc= 0.871 USER MOD Single : T 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 1 MET N :NH3+ -160:sc= -0.0393 (180deg=-0.71) USER MOD Single : T 5 TYR OH : rot 180:sc= 0 USER MOD Single : T 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 11 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : T 13 THR OG1 : rot 180:sc= 0 USER MOD Single : T 16 GLN : amide:sc= -5.44! C(o=-5.4!,f=-8.4!) USER MOD Single : T 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 18 ASN : amide:sc= -0.988 X(o=-0.99,f=-0.59) USER MOD Single : T 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 35 SER OG : rot 1:sc= 0.751 USER MOD Single : T 37 SER OG : rot 180:sc= -0.121 USER MOD Single : T 38 THR OG1 : rot -160:sc= 0 USER MOD Single : T 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 43 LYS NZ :NH3+ 139:sc= -0.131 (180deg=-1.09) USER MOD Single : T 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 47 MET CE :methyl -161:sc= -0.111 (180deg=-0.843) USER MOD Single : T 50 GLN :FLIP amide:sc= -1.37! C(o=-1.9!,f=-1.4!) USER MOD Single : T 51 ASN : amide:sc= -1.46 X(o=-1.5,f=-1) USER MOD Single : T 53 THR OG1 : rot 180:sc= 0.157 USER MOD Single : T 58 GLN : amide:sc= -2.12 K(o=-2.1,f=-6.3!) USER MOD Single : T 60 MET CE :methyl -114:sc= -0.129 (180deg=-1.26) USER MOD Single : T 80 MET CE :methyl -176:sc= -0.491 (180deg=-0.511) USER MOD Single : T 81 MET CE :methyl 180:sc= -9.01! (180deg=-9.01!) USER MOD Single : T 84 SER OG : rot 180:sc= 0 USER MOD Single : T 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 86 LYS NZ :NH3+ -153:sc= -0.0697 (180deg=-0.713) USER MOD Single : T 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET T 1 76.951 -18.525 8.054 1.00 0.00 N ATOM 2 CA MET T 1 75.683 -18.679 7.286 1.00 0.00 C ATOM 3 C MET T 1 75.506 -17.482 6.357 1.00 0.00 C ATOM 4 O MET T 1 75.684 -17.593 5.145 1.00 0.00 O ATOM 5 CB MET T 1 74.507 -18.763 8.260 1.00 0.00 C ATOM 6 CG MET T 1 74.841 -19.749 9.381 1.00 0.00 C ATOM 7 SD MET T 1 73.363 -20.050 10.381 1.00 0.00 S ATOM 8 CE MET T 1 72.717 -21.438 9.417 1.00 0.00 C ATOM 0 H1 MET T 1 77.250 -19.452 8.419 1.00 0.00 H new ATOM 0 H2 MET T 1 77.690 -18.143 7.430 1.00 0.00 H new ATOM 0 H3 MET T 1 76.798 -17.872 8.849 1.00 0.00 H new ATOM 0 HA MET T 1 75.721 -19.591 6.691 1.00 0.00 H new ATOM 0 HB2 MET T 1 74.297 -17.779 8.678 1.00 0.00 H new ATOM 0 HB3 MET T 1 73.608 -19.085 7.734 1.00 0.00 H new ATOM 0 HG2 MET T 1 75.205 -20.686 8.959 1.00 0.00 H new ATOM 0 HG3 MET T 1 75.640 -19.349 10.005 1.00 0.00 H new ATOM 0 HE1 MET T 1 71.787 -21.790 9.864 1.00 0.00 H new ATOM 0 HE2 MET T 1 72.527 -21.113 8.394 1.00 0.00 H new ATOM 0 HE3 MET T 1 73.447 -22.248 9.411 1.00 0.00 H new ATOM 20 N ASP T 2 75.155 -16.338 6.935 1.00 0.00 N ATOM 21 CA ASP T 2 74.956 -15.126 6.149 1.00 0.00 C ATOM 22 C ASP T 2 74.044 -15.403 4.958 1.00 0.00 C ATOM 23 O ASP T 2 74.343 -15.010 3.831 1.00 0.00 O ATOM 24 CB ASP T 2 76.304 -14.601 5.651 1.00 0.00 C ATOM 25 CG ASP T 2 77.103 -14.024 6.815 1.00 0.00 C ATOM 26 OD1 ASP T 2 76.513 -13.801 7.860 1.00 0.00 O ATOM 27 OD2 ASP T 2 78.292 -13.814 6.646 1.00 0.00 O ATOM 0 H ASP T 2 75.003 -16.225 7.937 1.00 0.00 H new ATOM 0 HA ASP T 2 74.486 -14.376 6.785 1.00 0.00 H new ATOM 0 HB2 ASP T 2 76.865 -15.407 5.179 1.00 0.00 H new ATOM 0 HB3 ASP T 2 76.147 -13.835 4.892 1.00 0.00 H new ATOM 32 N ASP T 3 72.932 -16.084 5.217 1.00 0.00 N ATOM 33 CA ASP T 3 71.982 -16.412 4.159 1.00 0.00 C ATOM 34 C ASP T 3 71.082 -15.218 3.855 1.00 0.00 C ATOM 35 O ASP T 3 70.938 -14.816 2.700 1.00 0.00 O ATOM 36 CB ASP T 3 71.122 -17.605 4.582 1.00 0.00 C ATOM 37 CG ASP T 3 72.001 -18.686 5.202 1.00 0.00 C ATOM 38 OD1 ASP T 3 72.982 -19.056 4.578 1.00 0.00 O ATOM 39 OD2 ASP T 3 71.679 -19.129 6.292 1.00 0.00 O ATOM 0 H ASP T 3 72.667 -16.418 6.144 1.00 0.00 H new ATOM 0 HA ASP T 3 72.543 -16.667 3.260 1.00 0.00 H new ATOM 0 HB2 ASP T 3 70.366 -17.283 5.299 1.00 0.00 H new ATOM 0 HB3 ASP T 3 70.592 -18.006 3.718 1.00 0.00 H new ATOM 44 N ILE T 4 70.473 -14.660 4.897 1.00 0.00 N ATOM 45 CA ILE T 4 69.583 -13.516 4.729 1.00 0.00 C ATOM 46 C ILE T 4 70.184 -12.484 3.775 1.00 0.00 C ATOM 47 O ILE T 4 69.481 -11.601 3.284 1.00 0.00 O ATOM 48 CB ILE T 4 69.285 -12.865 6.088 1.00 0.00 C ATOM 49 CG1 ILE T 4 70.531 -12.144 6.638 1.00 0.00 C ATOM 50 CG2 ILE T 4 68.834 -13.938 7.081 1.00 0.00 C ATOM 51 CD1 ILE T 4 71.730 -13.099 6.708 1.00 0.00 C ATOM 0 H ILE T 4 70.578 -14.979 5.860 1.00 0.00 H new ATOM 0 HA ILE T 4 68.651 -13.879 4.296 1.00 0.00 H new ATOM 0 HB ILE T 4 68.493 -12.129 5.952 1.00 0.00 H new ATOM 0 HG12 ILE T 4 70.775 -11.294 6.001 1.00 0.00 H new ATOM 0 HG13 ILE T 4 70.318 -11.748 7.631 1.00 0.00 H new ATOM 0 HG21 ILE T 4 68.623 -13.476 8.045 1.00 0.00 H new ATOM 0 HG22 ILE T 4 67.933 -14.425 6.707 1.00 0.00 H new ATOM 0 HG23 ILE T 4 69.624 -14.679 7.200 1.00 0.00 H new ATOM 0 HD11 ILE T 4 72.597 -12.567 7.099 1.00 0.00 H new ATOM 0 HD12 ILE T 4 71.491 -13.935 7.365 1.00 0.00 H new ATOM 0 HD13 ILE T 4 71.955 -13.474 5.710 1.00 0.00 H new ATOM 63 N TYR T 5 71.484 -12.601 3.515 1.00 0.00 N ATOM 64 CA TYR T 5 72.166 -11.672 2.616 1.00 0.00 C ATOM 65 C TYR T 5 72.082 -12.166 1.175 1.00 0.00 C ATOM 66 O TYR T 5 71.781 -11.397 0.262 1.00 0.00 O ATOM 67 CB TYR T 5 73.635 -11.535 3.025 1.00 0.00 C ATOM 68 CG TYR T 5 73.731 -10.733 4.304 1.00 0.00 C ATOM 69 CD1 TYR T 5 73.421 -9.368 4.296 1.00 0.00 C ATOM 70 CD2 TYR T 5 74.129 -11.352 5.496 1.00 0.00 C ATOM 71 CE1 TYR T 5 73.508 -8.622 5.478 1.00 0.00 C ATOM 72 CE2 TYR T 5 74.216 -10.606 6.678 1.00 0.00 C ATOM 73 CZ TYR T 5 73.905 -9.241 6.669 1.00 0.00 C ATOM 74 OH TYR T 5 73.990 -8.506 7.833 1.00 0.00 O ATOM 0 H TYR T 5 72.084 -13.325 3.911 1.00 0.00 H new ATOM 0 HA TYR T 5 71.677 -10.700 2.686 1.00 0.00 H new ATOM 0 HB2 TYR T 5 74.077 -12.521 3.168 1.00 0.00 H new ATOM 0 HB3 TYR T 5 74.200 -11.044 2.232 1.00 0.00 H new ATOM 0 HD1 TYR T 5 73.114 -8.890 3.377 1.00 0.00 H new ATOM 0 HD2 TYR T 5 74.369 -12.405 5.503 1.00 0.00 H new ATOM 0 HE1 TYR T 5 73.269 -7.569 5.471 1.00 0.00 H new ATOM 0 HE2 TYR T 5 74.523 -11.084 7.597 1.00 0.00 H new ATOM 0 HH TYR T 5 74.279 -9.088 8.567 1.00 0.00 H new ATOM 84 N LYS T 6 72.352 -13.452 0.980 1.00 0.00 N ATOM 85 CA LYS T 6 72.303 -14.039 -0.355 1.00 0.00 C ATOM 86 C LYS T 6 70.893 -13.942 -0.929 1.00 0.00 C ATOM 87 O LYS T 6 70.705 -13.958 -2.145 1.00 0.00 O ATOM 88 CB LYS T 6 72.733 -15.511 -0.299 1.00 0.00 C ATOM 89 CG LYS T 6 74.145 -15.636 0.306 1.00 0.00 C ATOM 90 CD LYS T 6 75.221 -15.445 -0.780 1.00 0.00 C ATOM 91 CE LYS T 6 75.195 -16.610 -1.790 1.00 0.00 C ATOM 92 NZ LYS T 6 76.582 -16.874 -2.266 1.00 0.00 N ATOM 0 H LYS T 6 72.605 -14.104 1.722 1.00 0.00 H new ATOM 0 HA LYS T 6 72.987 -13.486 -0.999 1.00 0.00 H new ATOM 0 HB2 LYS T 6 72.022 -16.081 0.299 1.00 0.00 H new ATOM 0 HB3 LYS T 6 72.721 -15.938 -1.302 1.00 0.00 H new ATOM 0 HG2 LYS T 6 74.277 -14.891 1.091 1.00 0.00 H new ATOM 0 HG3 LYS T 6 74.261 -16.614 0.772 1.00 0.00 H new ATOM 0 HD2 LYS T 6 75.054 -14.502 -1.301 1.00 0.00 H new ATOM 0 HD3 LYS T 6 76.205 -15.383 -0.316 1.00 0.00 H new ATOM 0 HE2 LYS T 6 74.781 -17.504 -1.323 1.00 0.00 H new ATOM 0 HE3 LYS T 6 74.549 -16.363 -2.632 1.00 0.00 H new ATOM 0 HZ1 LYS T 6 76.571 -17.659 -2.948 1.00 0.00 H new ATOM 0 HZ2 LYS T 6 76.959 -16.021 -2.726 1.00 0.00 H new ATOM 0 HZ3 LYS T 6 77.185 -17.126 -1.457 1.00 0.00 H new ATOM 106 N ALA T 7 69.906 -13.842 -0.045 1.00 0.00 N ATOM 107 CA ALA T 7 68.516 -13.744 -0.475 1.00 0.00 C ATOM 108 C ALA T 7 68.307 -12.503 -1.337 1.00 0.00 C ATOM 109 O ALA T 7 67.544 -12.528 -2.303 1.00 0.00 O ATOM 110 CB ALA T 7 67.595 -13.681 0.745 1.00 0.00 C ATOM 0 H ALA T 7 70.041 -13.827 0.966 1.00 0.00 H new ATOM 0 HA ALA T 7 68.276 -14.628 -1.066 1.00 0.00 H new ATOM 0 HB1 ALA T 7 66.559 -13.608 0.415 1.00 0.00 H new ATOM 0 HB2 ALA T 7 67.722 -14.583 1.344 1.00 0.00 H new ATOM 0 HB3 ALA T 7 67.847 -12.807 1.346 1.00 0.00 H new ATOM 116 N ALA T 8 68.990 -11.420 -0.981 1.00 0.00 N ATOM 117 CA ALA T 8 68.871 -10.174 -1.730 1.00 0.00 C ATOM 118 C ALA T 8 69.693 -10.239 -3.013 1.00 0.00 C ATOM 119 O ALA T 8 69.312 -9.668 -4.035 1.00 0.00 O ATOM 120 CB ALA T 8 69.353 -9.002 -0.873 1.00 0.00 C ATOM 0 H ALA T 8 69.627 -11.379 -0.185 1.00 0.00 H new ATOM 0 HA ALA T 8 67.823 -10.028 -1.990 1.00 0.00 H new ATOM 0 HB1 ALA T 8 69.261 -8.075 -1.439 1.00 0.00 H new ATOM 0 HB2 ALA T 8 68.746 -8.937 0.030 1.00 0.00 H new ATOM 0 HB3 ALA T 8 70.396 -9.157 -0.598 1.00 0.00 H new ATOM 126 N VAL T 9 70.822 -10.938 -2.953 1.00 0.00 N ATOM 127 CA VAL T 9 71.690 -11.071 -4.117 1.00 0.00 C ATOM 128 C VAL T 9 70.920 -11.654 -5.297 1.00 0.00 C ATOM 129 O VAL T 9 71.243 -11.387 -6.454 1.00 0.00 O ATOM 130 CB VAL T 9 72.877 -11.976 -3.782 1.00 0.00 C ATOM 131 CG1 VAL T 9 73.756 -12.146 -5.023 1.00 0.00 C ATOM 132 CG2 VAL T 9 73.700 -11.341 -2.659 1.00 0.00 C ATOM 0 H VAL T 9 71.155 -11.418 -2.117 1.00 0.00 H new ATOM 0 HA VAL T 9 72.054 -10.081 -4.390 1.00 0.00 H new ATOM 0 HB VAL T 9 72.511 -12.951 -3.460 1.00 0.00 H new ATOM 0 HG11 VAL T 9 74.602 -12.791 -4.784 1.00 0.00 H new ATOM 0 HG12 VAL T 9 73.171 -12.597 -5.824 1.00 0.00 H new ATOM 0 HG13 VAL T 9 74.122 -11.171 -5.346 1.00 0.00 H new ATOM 0 HG21 VAL T 9 74.546 -11.985 -2.419 1.00 0.00 H new ATOM 0 HG22 VAL T 9 74.066 -10.366 -2.982 1.00 0.00 H new ATOM 0 HG23 VAL T 9 73.075 -11.219 -1.774 1.00 0.00 H new ATOM 142 N GLU T 10 69.899 -12.450 -4.996 1.00 0.00 N ATOM 143 CA GLU T 10 69.089 -13.066 -6.041 1.00 0.00 C ATOM 144 C GLU T 10 68.195 -12.026 -6.709 1.00 0.00 C ATOM 145 O GLU T 10 67.755 -12.209 -7.844 1.00 0.00 O ATOM 146 CB GLU T 10 68.224 -14.178 -5.444 1.00 0.00 C ATOM 147 CG GLU T 10 69.120 -15.324 -4.971 1.00 0.00 C ATOM 148 CD GLU T 10 69.678 -16.080 -6.173 1.00 0.00 C ATOM 149 OE1 GLU T 10 68.895 -16.446 -7.033 1.00 0.00 O ATOM 150 OE2 GLU T 10 70.881 -16.281 -6.215 1.00 0.00 O ATOM 0 H GLU T 10 69.614 -12.682 -4.045 1.00 0.00 H new ATOM 0 HA GLU T 10 69.757 -13.489 -6.791 1.00 0.00 H new ATOM 0 HB2 GLU T 10 67.640 -13.790 -4.609 1.00 0.00 H new ATOM 0 HB3 GLU T 10 67.515 -14.540 -6.188 1.00 0.00 H new ATOM 0 HG2 GLU T 10 69.938 -14.932 -4.366 1.00 0.00 H new ATOM 0 HG3 GLU T 10 68.551 -16.003 -4.336 1.00 0.00 H new ATOM 157 N GLN T 11 67.931 -10.935 -5.997 1.00 0.00 N ATOM 158 CA GLN T 11 67.088 -9.872 -6.532 1.00 0.00 C ATOM 159 C GLN T 11 67.873 -9.007 -7.512 1.00 0.00 C ATOM 160 O GLN T 11 67.307 -8.442 -8.448 1.00 0.00 O ATOM 161 CB GLN T 11 66.559 -9.001 -5.390 1.00 0.00 C ATOM 162 CG GLN T 11 65.813 -9.878 -4.383 1.00 0.00 C ATOM 163 CD GLN T 11 65.307 -9.026 -3.224 1.00 0.00 C ATOM 164 OE1 GLN T 11 65.860 -7.961 -2.947 1.00 0.00 O ATOM 165 NE2 GLN T 11 64.283 -9.433 -2.525 1.00 0.00 N ATOM 0 H GLN T 11 68.285 -10.764 -5.056 1.00 0.00 H new ATOM 0 HA GLN T 11 66.250 -10.329 -7.059 1.00 0.00 H new ATOM 0 HB2 GLN T 11 67.385 -8.486 -4.899 1.00 0.00 H new ATOM 0 HB3 GLN T 11 65.893 -8.233 -5.783 1.00 0.00 H new ATOM 0 HG2 GLN T 11 64.976 -10.376 -4.872 1.00 0.00 H new ATOM 0 HG3 GLN T 11 66.474 -10.660 -4.009 1.00 0.00 H new ATOM 0 HE21 GLN T 11 63.826 -10.315 -2.756 1.00 0.00 H new ATOM 0 HE22 GLN T 11 63.939 -8.869 -1.748 1.00 0.00 H new ATOM 174 N LEU T 12 69.180 -8.907 -7.291 1.00 0.00 N ATOM 175 CA LEU T 12 70.033 -8.108 -8.162 1.00 0.00 C ATOM 176 C LEU T 12 70.200 -8.786 -9.519 1.00 0.00 C ATOM 177 O LEU T 12 70.633 -9.936 -9.600 1.00 0.00 O ATOM 178 CB LEU T 12 71.406 -7.911 -7.512 1.00 0.00 C ATOM 179 CG LEU T 12 71.229 -7.617 -6.021 1.00 0.00 C ATOM 180 CD1 LEU T 12 72.592 -7.310 -5.397 1.00 0.00 C ATOM 181 CD2 LEU T 12 70.302 -6.411 -5.842 1.00 0.00 C ATOM 0 H LEU T 12 69.668 -9.366 -6.522 1.00 0.00 H new ATOM 0 HA LEU T 12 69.560 -7.137 -8.311 1.00 0.00 H new ATOM 0 HB2 LEU T 12 72.015 -8.805 -7.647 1.00 0.00 H new ATOM 0 HB3 LEU T 12 71.934 -7.089 -7.995 1.00 0.00 H new ATOM 0 HG LEU T 12 70.791 -8.486 -5.530 1.00 0.00 H new ATOM 0 HD11 LEU T 12 72.467 -7.100 -4.335 1.00 0.00 H new ATOM 0 HD12 LEU T 12 73.251 -8.169 -5.522 1.00 0.00 H new ATOM 0 HD13 LEU T 12 73.030 -6.442 -5.889 1.00 0.00 H new ATOM 0 HD21 LEU T 12 70.177 -6.203 -4.779 1.00 0.00 H new ATOM 0 HD22 LEU T 12 70.738 -5.541 -6.333 1.00 0.00 H new ATOM 0 HD23 LEU T 12 69.331 -6.630 -6.286 1.00 0.00 H new ATOM 193 N THR T 13 69.852 -8.067 -10.581 1.00 0.00 N ATOM 194 CA THR T 13 69.967 -8.609 -11.930 1.00 0.00 C ATOM 195 C THR T 13 71.430 -8.633 -12.372 1.00 0.00 C ATOM 196 O THR T 13 72.293 -9.142 -11.657 1.00 0.00 O ATOM 197 CB THR T 13 69.134 -7.761 -12.902 1.00 0.00 C ATOM 198 OG1 THR T 13 67.904 -7.413 -12.282 1.00 0.00 O ATOM 199 CG2 THR T 13 68.852 -8.554 -14.183 1.00 0.00 C ATOM 0 H THR T 13 69.491 -7.114 -10.535 1.00 0.00 H new ATOM 0 HA THR T 13 69.589 -9.631 -11.933 1.00 0.00 H new ATOM 0 HB THR T 13 69.689 -6.858 -13.158 1.00 0.00 H new ATOM 0 HG1 THR T 13 67.369 -6.870 -12.898 1.00 0.00 H new ATOM 0 HG21 THR T 13 68.261 -7.944 -14.866 1.00 0.00 H new ATOM 0 HG22 THR T 13 69.795 -8.822 -14.660 1.00 0.00 H new ATOM 0 HG23 THR T 13 68.300 -9.461 -13.936 1.00 0.00 H new ATOM 207 N GLU T 14 71.705 -8.079 -13.554 1.00 0.00 N ATOM 208 CA GLU T 14 73.069 -8.039 -14.088 1.00 0.00 C ATOM 209 C GLU T 14 73.399 -6.638 -14.590 1.00 0.00 C ATOM 210 O GLU T 14 74.568 -6.281 -14.739 1.00 0.00 O ATOM 211 CB GLU T 14 73.207 -9.039 -15.237 1.00 0.00 C ATOM 212 CG GLU T 14 73.213 -10.463 -14.678 1.00 0.00 C ATOM 213 CD GLU T 14 73.309 -11.471 -15.819 1.00 0.00 C ATOM 214 OE1 GLU T 14 73.825 -11.106 -16.863 1.00 0.00 O ATOM 215 OE2 GLU T 14 72.866 -12.592 -15.632 1.00 0.00 O ATOM 0 H GLU T 14 71.004 -7.652 -14.159 1.00 0.00 H new ATOM 0 HA GLU T 14 73.764 -8.304 -13.291 1.00 0.00 H new ATOM 0 HB2 GLU T 14 72.383 -8.917 -15.940 1.00 0.00 H new ATOM 0 HB3 GLU T 14 74.128 -8.850 -15.789 1.00 0.00 H new ATOM 0 HG2 GLU T 14 74.054 -10.591 -13.997 1.00 0.00 H new ATOM 0 HG3 GLU T 14 72.305 -10.640 -14.101 1.00 0.00 H new ATOM 222 N GLU T 15 72.362 -5.848 -14.847 1.00 0.00 N ATOM 223 CA GLU T 15 72.554 -4.486 -15.330 1.00 0.00 C ATOM 224 C GLU T 15 73.093 -3.596 -14.214 1.00 0.00 C ATOM 225 O GLU T 15 73.950 -2.744 -14.447 1.00 0.00 O ATOM 226 CB GLU T 15 71.227 -3.919 -15.840 1.00 0.00 C ATOM 227 CG GLU T 15 70.524 -4.965 -16.708 1.00 0.00 C ATOM 228 CD GLU T 15 69.255 -4.373 -17.312 1.00 0.00 C ATOM 229 OE1 GLU T 15 68.833 -3.327 -16.846 1.00 0.00 O ATOM 230 OE2 GLU T 15 68.724 -4.974 -18.231 1.00 0.00 O ATOM 0 H GLU T 15 71.387 -6.125 -14.730 1.00 0.00 H new ATOM 0 HA GLU T 15 73.276 -4.508 -16.146 1.00 0.00 H new ATOM 0 HB2 GLU T 15 70.591 -3.642 -14.999 1.00 0.00 H new ATOM 0 HB3 GLU T 15 71.405 -3.012 -16.418 1.00 0.00 H new ATOM 0 HG2 GLU T 15 71.192 -5.300 -17.501 1.00 0.00 H new ATOM 0 HG3 GLU T 15 70.277 -5.841 -16.108 1.00 0.00 H new ATOM 237 N GLN T 16 72.587 -3.803 -13.003 1.00 0.00 N ATOM 238 CA GLN T 16 73.027 -3.014 -11.857 1.00 0.00 C ATOM 239 C GLN T 16 74.367 -3.527 -11.339 1.00 0.00 C ATOM 240 O GLN T 16 75.030 -2.863 -10.542 1.00 0.00 O ATOM 241 CB GLN T 16 71.980 -3.082 -10.739 1.00 0.00 C ATOM 242 CG GLN T 16 71.747 -4.542 -10.327 1.00 0.00 C ATOM 243 CD GLN T 16 72.862 -5.012 -9.397 1.00 0.00 C ATOM 244 OE1 GLN T 16 73.708 -5.812 -9.795 1.00 0.00 O ATOM 245 NE2 GLN T 16 72.912 -4.560 -8.174 1.00 0.00 N ATOM 0 H GLN T 16 71.878 -4.504 -12.790 1.00 0.00 H new ATOM 0 HA GLN T 16 73.146 -1.978 -12.176 1.00 0.00 H new ATOM 0 HB2 GLN T 16 72.316 -2.502 -9.879 1.00 0.00 H new ATOM 0 HB3 GLN T 16 71.044 -2.637 -11.078 1.00 0.00 H new ATOM 0 HG2 GLN T 16 70.783 -4.637 -9.828 1.00 0.00 H new ATOM 0 HG3 GLN T 16 71.711 -5.176 -11.213 1.00 0.00 H new ATOM 0 HE21 GLN T 16 72.210 -3.897 -7.846 1.00 0.00 H new ATOM 0 HE22 GLN T 16 73.653 -4.870 -7.546 1.00 0.00 H new ATOM 254 N LYS T 17 74.759 -4.711 -11.797 1.00 0.00 N ATOM 255 CA LYS T 17 76.022 -5.304 -11.375 1.00 0.00 C ATOM 256 C LYS T 17 77.197 -4.598 -12.045 1.00 0.00 C ATOM 257 O LYS T 17 78.164 -4.218 -11.384 1.00 0.00 O ATOM 258 CB LYS T 17 76.045 -6.790 -11.735 1.00 0.00 C ATOM 259 CG LYS T 17 77.197 -7.478 -11.001 1.00 0.00 C ATOM 260 CD LYS T 17 77.175 -8.977 -11.309 1.00 0.00 C ATOM 261 CE LYS T 17 78.081 -9.715 -10.322 1.00 0.00 C ATOM 262 NZ LYS T 17 78.297 -11.112 -10.796 1.00 0.00 N ATOM 0 H LYS T 17 74.224 -5.276 -12.457 1.00 0.00 H new ATOM 0 HA LYS T 17 76.113 -5.189 -10.295 1.00 0.00 H new ATOM 0 HB2 LYS T 17 75.098 -7.255 -11.463 1.00 0.00 H new ATOM 0 HB3 LYS T 17 76.162 -6.912 -12.812 1.00 0.00 H new ATOM 0 HG2 LYS T 17 78.149 -7.046 -11.310 1.00 0.00 H new ATOM 0 HG3 LYS T 17 77.107 -7.315 -9.927 1.00 0.00 H new ATOM 0 HD2 LYS T 17 76.156 -9.358 -11.239 1.00 0.00 H new ATOM 0 HD3 LYS T 17 77.512 -9.154 -12.330 1.00 0.00 H new ATOM 0 HE2 LYS T 17 79.036 -9.198 -10.232 1.00 0.00 H new ATOM 0 HE3 LYS T 17 77.628 -9.722 -9.331 1.00 0.00 H new ATOM 0 HZ1 LYS T 17 78.913 -11.615 -10.126 1.00 0.00 H new ATOM 0 HZ2 LYS T 17 77.382 -11.602 -10.860 1.00 0.00 H new ATOM 0 HZ3 LYS T 17 78.747 -11.095 -11.733 1.00 0.00 H new ATOM 276 N ASN T 18 77.106 -4.426 -13.360 1.00 0.00 N ATOM 277 CA ASN T 18 78.169 -3.764 -14.108 1.00 0.00 C ATOM 278 C ASN T 18 78.390 -2.348 -13.587 1.00 0.00 C ATOM 279 O ASN T 18 79.422 -1.732 -13.854 1.00 0.00 O ATOM 280 CB ASN T 18 77.809 -3.713 -15.594 1.00 0.00 C ATOM 281 CG ASN T 18 77.694 -5.128 -16.152 1.00 0.00 C ATOM 282 OD1 ASN T 18 78.703 -5.752 -16.478 1.00 0.00 O ATOM 283 ND2 ASN T 18 76.516 -5.674 -16.281 1.00 0.00 N ATOM 0 H ASN T 18 76.315 -4.733 -13.926 1.00 0.00 H new ATOM 0 HA ASN T 18 79.089 -4.334 -13.977 1.00 0.00 H new ATOM 0 HB2 ASN T 18 76.867 -3.182 -15.730 1.00 0.00 H new ATOM 0 HB3 ASN T 18 78.570 -3.158 -16.142 1.00 0.00 H new ATOM 0 HD21 ASN T 18 76.430 -6.620 -16.653 1.00 0.00 H new ATOM 0 HD22 ASN T 18 75.681 -5.155 -16.010 1.00 0.00 H new ATOM 290 N GLU T 19 77.414 -1.837 -12.843 1.00 0.00 N ATOM 291 CA GLU T 19 77.514 -0.492 -12.289 1.00 0.00 C ATOM 292 C GLU T 19 78.506 -0.463 -11.131 1.00 0.00 C ATOM 293 O GLU T 19 79.319 0.455 -11.021 1.00 0.00 O ATOM 294 CB GLU T 19 76.142 -0.024 -11.800 1.00 0.00 C ATOM 295 CG GLU T 19 75.150 -0.045 -12.965 1.00 0.00 C ATOM 296 CD GLU T 19 75.481 1.067 -13.953 1.00 0.00 C ATOM 297 OE1 GLU T 19 76.266 0.818 -14.854 1.00 0.00 O ATOM 298 OE2 GLU T 19 74.946 2.152 -13.795 1.00 0.00 O ATOM 0 H GLU T 19 76.551 -2.330 -12.611 1.00 0.00 H new ATOM 0 HA GLU T 19 77.867 0.178 -13.073 1.00 0.00 H new ATOM 0 HB2 GLU T 19 75.790 -0.672 -10.997 1.00 0.00 H new ATOM 0 HB3 GLU T 19 76.215 0.983 -11.389 1.00 0.00 H new ATOM 0 HG2 GLU T 19 75.187 -1.012 -13.467 1.00 0.00 H new ATOM 0 HG3 GLU T 19 74.134 0.081 -12.590 1.00 0.00 H new ATOM 305 N PHE T 20 78.434 -1.473 -10.271 1.00 0.00 N ATOM 306 CA PHE T 20 79.332 -1.553 -9.125 1.00 0.00 C ATOM 307 C PHE T 20 80.729 -1.976 -9.569 1.00 0.00 C ATOM 308 O PHE T 20 81.710 -1.282 -9.304 1.00 0.00 O ATOM 309 CB PHE T 20 78.792 -2.556 -8.104 1.00 0.00 C ATOM 310 CG PHE T 20 77.504 -2.029 -7.515 1.00 0.00 C ATOM 311 CD1 PHE T 20 77.536 -0.975 -6.595 1.00 0.00 C ATOM 312 CD2 PHE T 20 76.277 -2.594 -7.888 1.00 0.00 C ATOM 313 CE1 PHE T 20 76.344 -0.485 -6.048 1.00 0.00 C ATOM 314 CE2 PHE T 20 75.085 -2.104 -7.342 1.00 0.00 C ATOM 315 CZ PHE T 20 75.119 -1.049 -6.422 1.00 0.00 C ATOM 0 H PHE T 20 77.768 -2.242 -10.344 1.00 0.00 H new ATOM 0 HA PHE T 20 79.392 -0.567 -8.665 1.00 0.00 H new ATOM 0 HB2 PHE T 20 78.618 -3.520 -8.582 1.00 0.00 H new ATOM 0 HB3 PHE T 20 79.526 -2.719 -7.315 1.00 0.00 H new ATOM 0 HD1 PHE T 20 78.481 -0.539 -6.307 1.00 0.00 H new ATOM 0 HD2 PHE T 20 76.251 -3.408 -8.597 1.00 0.00 H new ATOM 0 HE1 PHE T 20 76.370 0.328 -5.338 1.00 0.00 H new ATOM 0 HE2 PHE T 20 74.140 -2.539 -7.630 1.00 0.00 H new ATOM 0 HZ PHE T 20 74.199 -0.670 -6.001 1.00 0.00 H new ATOM 325 N LYS T 21 80.810 -3.118 -10.246 1.00 0.00 N ATOM 326 CA LYS T 21 82.093 -3.625 -10.722 1.00 0.00 C ATOM 327 C LYS T 21 82.913 -2.506 -11.358 1.00 0.00 C ATOM 328 O LYS T 21 84.136 -2.466 -11.221 1.00 0.00 O ATOM 329 CB LYS T 21 81.867 -4.740 -11.746 1.00 0.00 C ATOM 330 CG LYS T 21 81.144 -5.912 -11.076 1.00 0.00 C ATOM 331 CD LYS T 21 81.251 -7.157 -11.962 1.00 0.00 C ATOM 332 CE LYS T 21 80.517 -6.912 -13.283 1.00 0.00 C ATOM 333 NZ LYS T 21 80.289 -8.214 -13.972 1.00 0.00 N ATOM 0 H LYS T 21 80.009 -3.706 -10.476 1.00 0.00 H new ATOM 0 HA LYS T 21 82.643 -4.021 -9.868 1.00 0.00 H new ATOM 0 HB2 LYS T 21 81.277 -4.366 -12.582 1.00 0.00 H new ATOM 0 HB3 LYS T 21 82.822 -5.073 -12.153 1.00 0.00 H new ATOM 0 HG2 LYS T 21 81.582 -6.111 -10.098 1.00 0.00 H new ATOM 0 HG3 LYS T 21 80.096 -5.660 -10.911 1.00 0.00 H new ATOM 0 HD2 LYS T 21 82.298 -7.390 -12.154 1.00 0.00 H new ATOM 0 HD3 LYS T 21 80.822 -8.018 -11.450 1.00 0.00 H new ATOM 0 HE2 LYS T 21 79.565 -6.415 -13.096 1.00 0.00 H new ATOM 0 HE3 LYS T 21 81.103 -6.249 -13.920 1.00 0.00 H new ATOM 0 HZ1 LYS T 21 79.790 -8.049 -14.870 1.00 0.00 H new ATOM 0 HZ2 LYS T 21 81.204 -8.671 -14.163 1.00 0.00 H new ATOM 0 HZ3 LYS T 21 79.714 -8.832 -13.365 1.00 0.00 H new ATOM 347 N ALA T 22 82.233 -1.599 -12.051 1.00 0.00 N ATOM 348 CA ALA T 22 82.911 -0.484 -12.701 1.00 0.00 C ATOM 349 C ALA T 22 83.530 0.444 -11.660 1.00 0.00 C ATOM 350 O ALA T 22 84.550 1.085 -11.914 1.00 0.00 O ATOM 351 CB ALA T 22 81.921 0.301 -13.563 1.00 0.00 C ATOM 0 H ALA T 22 81.221 -1.613 -12.177 1.00 0.00 H new ATOM 0 HA ALA T 22 83.703 -0.884 -13.334 1.00 0.00 H new ATOM 0 HB1 ALA T 22 82.437 1.132 -14.044 1.00 0.00 H new ATOM 0 HB2 ALA T 22 81.501 -0.356 -14.325 1.00 0.00 H new ATOM 0 HB3 ALA T 22 81.118 0.687 -12.935 1.00 0.00 H new ATOM 357 N ALA T 23 82.906 0.510 -10.489 1.00 0.00 N ATOM 358 CA ALA T 23 83.404 1.362 -9.416 1.00 0.00 C ATOM 359 C ALA T 23 84.739 0.842 -8.893 1.00 0.00 C ATOM 360 O ALA T 23 85.702 1.598 -8.764 1.00 0.00 O ATOM 361 CB ALA T 23 82.389 1.411 -8.273 1.00 0.00 C ATOM 0 H ALA T 23 82.060 -0.012 -10.260 1.00 0.00 H new ATOM 0 HA ALA T 23 83.550 2.366 -9.814 1.00 0.00 H new ATOM 0 HB1 ALA T 23 82.769 2.050 -7.476 1.00 0.00 H new ATOM 0 HB2 ALA T 23 81.445 1.813 -8.641 1.00 0.00 H new ATOM 0 HB3 ALA T 23 82.228 0.405 -7.886 1.00 0.00 H new ATOM 367 N PHE T 24 84.790 -0.453 -8.594 1.00 0.00 N ATOM 368 CA PHE T 24 86.016 -1.062 -8.086 1.00 0.00 C ATOM 369 C PHE T 24 87.218 -0.609 -8.910 1.00 0.00 C ATOM 370 O PHE T 24 88.203 -0.111 -8.365 1.00 0.00 O ATOM 371 CB PHE T 24 85.905 -2.591 -8.137 1.00 0.00 C ATOM 372 CG PHE T 24 85.010 -3.075 -7.020 1.00 0.00 C ATOM 373 CD1 PHE T 24 83.619 -3.024 -7.165 1.00 0.00 C ATOM 374 CD2 PHE T 24 85.573 -3.575 -5.839 1.00 0.00 C ATOM 375 CE1 PHE T 24 82.790 -3.472 -6.130 1.00 0.00 C ATOM 376 CE2 PHE T 24 84.744 -4.024 -4.804 1.00 0.00 C ATOM 377 CZ PHE T 24 83.353 -3.972 -4.950 1.00 0.00 C ATOM 0 H PHE T 24 84.005 -1.096 -8.693 1.00 0.00 H new ATOM 0 HA PHE T 24 86.156 -0.745 -7.053 1.00 0.00 H new ATOM 0 HB2 PHE T 24 85.502 -2.904 -9.100 1.00 0.00 H new ATOM 0 HB3 PHE T 24 86.894 -3.040 -8.044 1.00 0.00 H new ATOM 0 HD1 PHE T 24 83.185 -2.639 -8.076 1.00 0.00 H new ATOM 0 HD2 PHE T 24 86.646 -3.614 -5.727 1.00 0.00 H new ATOM 0 HE1 PHE T 24 81.717 -3.432 -6.242 1.00 0.00 H new ATOM 0 HE2 PHE T 24 85.178 -4.410 -3.893 1.00 0.00 H new ATOM 0 HZ PHE T 24 82.713 -4.318 -4.151 1.00 0.00 H new ATOM 387 N ASP T 25 87.129 -0.782 -10.225 1.00 0.00 N ATOM 388 CA ASP T 25 88.216 -0.386 -11.115 1.00 0.00 C ATOM 389 C ASP T 25 88.772 0.977 -10.712 1.00 0.00 C ATOM 390 O ASP T 25 89.987 1.169 -10.649 1.00 0.00 O ATOM 391 CB ASP T 25 87.713 -0.327 -12.558 1.00 0.00 C ATOM 392 CG ASP T 25 86.882 -1.567 -12.871 1.00 0.00 C ATOM 393 OD1 ASP T 25 87.141 -2.597 -12.272 1.00 0.00 O ATOM 394 OD2 ASP T 25 85.998 -1.467 -13.706 1.00 0.00 O ATOM 0 H ASP T 25 86.322 -1.191 -10.696 1.00 0.00 H new ATOM 0 HA ASP T 25 89.012 -1.127 -11.037 1.00 0.00 H new ATOM 0 HB2 ASP T 25 87.112 0.570 -12.706 1.00 0.00 H new ATOM 0 HB3 ASP T 25 88.558 -0.262 -13.244 1.00 0.00 H new ATOM 399 N ILE T 26 87.876 1.919 -10.438 1.00 0.00 N ATOM 400 CA ILE T 26 88.289 3.260 -10.040 1.00 0.00 C ATOM 401 C ILE T 26 89.048 3.217 -8.717 1.00 0.00 C ATOM 402 O ILE T 26 90.153 3.748 -8.607 1.00 0.00 O ATOM 403 CB ILE T 26 87.061 4.165 -9.897 1.00 0.00 C ATOM 404 CG1 ILE T 26 86.105 3.933 -11.075 1.00 0.00 C ATOM 405 CG2 ILE T 26 87.502 5.631 -9.876 1.00 0.00 C ATOM 406 CD1 ILE T 26 86.868 4.038 -12.399 1.00 0.00 C ATOM 0 H ILE T 26 86.866 1.781 -10.484 1.00 0.00 H new ATOM 0 HA ILE T 26 88.947 3.660 -10.811 1.00 0.00 H new ATOM 0 HB ILE T 26 86.548 3.928 -8.965 1.00 0.00 H new ATOM 0 HG12 ILE T 26 85.642 2.950 -10.990 1.00 0.00 H new ATOM 0 HG13 ILE T 26 85.300 4.668 -11.051 1.00 0.00 H new ATOM 0 HG21 ILE T 26 86.627 6.273 -9.774 1.00 0.00 H new ATOM 0 HG22 ILE T 26 88.174 5.797 -9.034 1.00 0.00 H new ATOM 0 HG23 ILE T 26 88.020 5.868 -10.805 1.00 0.00 H new ATOM 0 HD11 ILE T 26 86.181 3.872 -13.229 1.00 0.00 H new ATOM 0 HD12 ILE T 26 87.310 5.031 -12.487 1.00 0.00 H new ATOM 0 HD13 ILE T 26 87.657 3.286 -12.425 1.00 0.00 H new ATOM 418 N PHE T 27 88.447 2.582 -7.716 1.00 0.00 N ATOM 419 CA PHE T 27 89.074 2.477 -6.403 1.00 0.00 C ATOM 420 C PHE T 27 90.403 1.732 -6.498 1.00 0.00 C ATOM 421 O PHE T 27 91.258 1.855 -5.621 1.00 0.00 O ATOM 422 CB PHE T 27 88.144 1.739 -5.436 1.00 0.00 C ATOM 423 CG PHE T 27 86.986 2.633 -5.057 1.00 0.00 C ATOM 424 CD1 PHE T 27 87.173 3.661 -4.126 1.00 0.00 C ATOM 425 CD2 PHE T 27 85.725 2.431 -5.633 1.00 0.00 C ATOM 426 CE1 PHE T 27 86.101 4.488 -3.771 1.00 0.00 C ATOM 427 CE2 PHE T 27 84.653 3.259 -5.278 1.00 0.00 C ATOM 428 CZ PHE T 27 84.841 4.287 -4.347 1.00 0.00 C ATOM 0 H PHE T 27 87.533 2.135 -7.787 1.00 0.00 H new ATOM 0 HA PHE T 27 89.261 3.485 -6.032 1.00 0.00 H new ATOM 0 HB2 PHE T 27 87.773 0.825 -5.900 1.00 0.00 H new ATOM 0 HB3 PHE T 27 88.694 1.443 -4.543 1.00 0.00 H new ATOM 0 HD1 PHE T 27 88.145 3.816 -3.681 1.00 0.00 H new ATOM 0 HD2 PHE T 27 85.580 1.637 -6.351 1.00 0.00 H new ATOM 0 HE1 PHE T 27 86.246 5.281 -3.053 1.00 0.00 H new ATOM 0 HE2 PHE T 27 83.681 3.104 -5.723 1.00 0.00 H new ATOM 0 HZ PHE T 27 84.014 4.925 -4.073 1.00 0.00 H new ATOM 438 N VAL T 28 90.571 0.958 -7.568 1.00 0.00 N ATOM 439 CA VAL T 28 91.801 0.192 -7.770 1.00 0.00 C ATOM 440 C VAL T 28 92.082 0.019 -9.261 1.00 0.00 C ATOM 441 O VAL T 28 91.930 -1.072 -9.809 1.00 0.00 O ATOM 442 CB VAL T 28 91.674 -1.185 -7.106 1.00 0.00 C ATOM 443 CG1 VAL T 28 91.826 -1.044 -5.589 1.00 0.00 C ATOM 444 CG2 VAL T 28 90.298 -1.779 -7.423 1.00 0.00 C ATOM 0 H VAL T 28 89.876 0.844 -8.306 1.00 0.00 H new ATOM 0 HA VAL T 28 92.629 0.737 -7.316 1.00 0.00 H new ATOM 0 HB VAL T 28 92.455 -1.842 -7.489 1.00 0.00 H new ATOM 0 HG11 VAL T 28 91.735 -2.024 -5.122 1.00 0.00 H new ATOM 0 HG12 VAL T 28 92.804 -0.622 -5.359 1.00 0.00 H new ATOM 0 HG13 VAL T 28 91.047 -0.385 -5.205 1.00 0.00 H new ATOM 0 HG21 VAL T 28 90.207 -2.758 -6.952 1.00 0.00 H new ATOM 0 HG22 VAL T 28 89.520 -1.118 -7.041 1.00 0.00 H new ATOM 0 HG23 VAL T 28 90.187 -1.884 -8.502 1.00 0.00 H new ATOM 454 N LEU T 29 92.494 1.107 -9.911 1.00 0.00 N ATOM 455 CA LEU T 29 92.797 1.075 -11.343 1.00 0.00 C ATOM 456 C LEU T 29 94.296 0.878 -11.571 1.00 0.00 C ATOM 457 O LEU T 29 94.822 1.225 -12.629 1.00 0.00 O ATOM 458 CB LEU T 29 92.334 2.386 -12.003 1.00 0.00 C ATOM 459 CG LEU T 29 92.543 3.558 -11.038 1.00 0.00 C ATOM 460 CD1 LEU T 29 94.006 3.608 -10.589 1.00 0.00 C ATOM 461 CD2 LEU T 29 92.182 4.865 -11.748 1.00 0.00 C ATOM 0 H LEU T 29 92.625 2.018 -9.472 1.00 0.00 H new ATOM 0 HA LEU T 29 92.265 0.237 -11.793 1.00 0.00 H new ATOM 0 HB2 LEU T 29 92.893 2.557 -12.923 1.00 0.00 H new ATOM 0 HB3 LEU T 29 91.282 2.313 -12.278 1.00 0.00 H new ATOM 0 HG LEU T 29 91.906 3.425 -10.164 1.00 0.00 H new ATOM 0 HD11 LEU T 29 94.148 4.443 -9.903 1.00 0.00 H new ATOM 0 HD12 LEU T 29 94.264 2.677 -10.085 1.00 0.00 H new ATOM 0 HD13 LEU T 29 94.649 3.740 -11.459 1.00 0.00 H new ATOM 0 HD21 LEU T 29 92.329 5.702 -11.066 1.00 0.00 H new ATOM 0 HD22 LEU T 29 92.821 4.993 -12.622 1.00 0.00 H new ATOM 0 HD23 LEU T 29 91.139 4.832 -12.063 1.00 0.00 H new ATOM 473 N GLY T 30 94.980 0.321 -10.575 1.00 0.00 N ATOM 474 CA GLY T 30 96.416 0.091 -10.690 1.00 0.00 C ATOM 475 C GLY T 30 96.933 -0.775 -9.545 1.00 0.00 C ATOM 476 O GLY T 30 98.133 -1.024 -9.439 1.00 0.00 O ATOM 0 H GLY T 30 94.569 0.024 -9.690 1.00 0.00 H new ATOM 0 HA2 GLY T 30 96.634 -0.393 -11.642 1.00 0.00 H new ATOM 0 HA3 GLY T 30 96.940 1.047 -10.691 1.00 0.00 H new ATOM 480 N ALA T 31 96.023 -1.230 -8.689 1.00 0.00 N ATOM 481 CA ALA T 31 96.409 -2.067 -7.557 1.00 0.00 C ATOM 482 C ALA T 31 96.660 -3.502 -8.011 1.00 0.00 C ATOM 483 O ALA T 31 96.168 -3.927 -9.057 1.00 0.00 O ATOM 484 CB ALA T 31 95.308 -2.048 -6.493 1.00 0.00 C ATOM 0 H ALA T 31 95.024 -1.036 -8.755 1.00 0.00 H new ATOM 0 HA ALA T 31 97.330 -1.668 -7.132 1.00 0.00 H new ATOM 0 HB1 ALA T 31 95.604 -2.675 -5.652 1.00 0.00 H new ATOM 0 HB2 ALA T 31 95.154 -1.026 -6.147 1.00 0.00 H new ATOM 0 HB3 ALA T 31 94.381 -2.430 -6.922 1.00 0.00 H new ATOM 490 N GLU T 32 97.427 -4.243 -7.219 1.00 0.00 N ATOM 491 CA GLU T 32 97.736 -5.630 -7.550 1.00 0.00 C ATOM 492 C GLU T 32 96.453 -6.433 -7.734 1.00 0.00 C ATOM 493 O GLU T 32 95.988 -6.631 -8.857 1.00 0.00 O ATOM 494 CB GLU T 32 98.579 -6.258 -6.439 1.00 0.00 C ATOM 495 CG GLU T 32 99.997 -5.685 -6.484 1.00 0.00 C ATOM 496 CD GLU T 32 100.873 -6.380 -5.448 1.00 0.00 C ATOM 497 OE1 GLU T 32 100.413 -7.348 -4.865 1.00 0.00 O ATOM 498 OE2 GLU T 32 101.992 -5.934 -5.252 1.00 0.00 O ATOM 0 H GLU T 32 97.844 -3.910 -6.350 1.00 0.00 H new ATOM 0 HA GLU T 32 98.299 -5.645 -8.483 1.00 0.00 H new ATOM 0 HB2 GLU T 32 98.126 -6.058 -5.468 1.00 0.00 H new ATOM 0 HB3 GLU T 32 98.610 -7.341 -6.560 1.00 0.00 H new ATOM 0 HG2 GLU T 32 100.421 -5.819 -7.479 1.00 0.00 H new ATOM 0 HG3 GLU T 32 99.971 -4.613 -6.290 1.00 0.00 H new ATOM 505 N ASP T 33 95.886 -6.895 -6.624 1.00 0.00 N ATOM 506 CA ASP T 33 94.655 -7.676 -6.674 1.00 0.00 C ATOM 507 C ASP T 33 93.449 -6.761 -6.863 1.00 0.00 C ATOM 508 O ASP T 33 92.819 -6.760 -7.920 1.00 0.00 O ATOM 509 CB ASP T 33 94.494 -8.480 -5.382 1.00 0.00 C ATOM 510 CG ASP T 33 94.760 -7.586 -4.175 1.00 0.00 C ATOM 511 OD1 ASP T 33 95.843 -7.029 -4.103 1.00 0.00 O ATOM 512 OD2 ASP T 33 93.877 -7.472 -3.341 1.00 0.00 O ATOM 0 H ASP T 33 96.256 -6.744 -5.686 1.00 0.00 H new ATOM 0 HA ASP T 33 94.713 -8.360 -7.521 1.00 0.00 H new ATOM 0 HB2 ASP T 33 93.487 -8.893 -5.324 1.00 0.00 H new ATOM 0 HB3 ASP T 33 95.185 -9.323 -5.380 1.00 0.00 H new ATOM 517 N GLY T 34 93.134 -5.985 -5.830 1.00 0.00 N ATOM 518 CA GLY T 34 92.000 -5.068 -5.893 1.00 0.00 C ATOM 519 C GLY T 34 91.529 -4.688 -4.494 1.00 0.00 C ATOM 520 O GLY T 34 90.347 -4.422 -4.277 1.00 0.00 O ATOM 0 H GLY T 34 93.643 -5.972 -4.946 1.00 0.00 H new ATOM 0 HA2 GLY T 34 92.283 -4.170 -6.442 1.00 0.00 H new ATOM 0 HA3 GLY T 34 91.182 -5.533 -6.443 1.00 0.00 H new ATOM 524 N SER T 35 92.462 -4.663 -3.546 1.00 0.00 N ATOM 525 CA SER T 35 92.131 -4.313 -2.168 1.00 0.00 C ATOM 526 C SER T 35 92.047 -2.799 -2.007 1.00 0.00 C ATOM 527 O SER T 35 93.026 -2.086 -2.228 1.00 0.00 O ATOM 528 CB SER T 35 93.191 -4.871 -1.219 1.00 0.00 C ATOM 529 OG SER T 35 94.393 -4.126 -1.367 1.00 0.00 O ATOM 0 H SER T 35 93.446 -4.879 -3.705 1.00 0.00 H new ATOM 0 HA SER T 35 91.162 -4.748 -1.924 1.00 0.00 H new ATOM 0 HB2 SER T 35 92.839 -4.815 -0.189 1.00 0.00 H new ATOM 0 HB3 SER T 35 93.373 -5.923 -1.437 1.00 0.00 H new ATOM 0 HG SER T 35 94.260 -3.420 -2.034 1.00 0.00 H new ATOM 535 N ILE T 36 90.870 -2.315 -1.622 1.00 0.00 N ATOM 536 CA ILE T 36 90.663 -0.881 -1.435 1.00 0.00 C ATOM 537 C ILE T 36 91.127 -0.449 -0.048 1.00 0.00 C ATOM 538 O ILE T 36 91.159 -1.253 0.884 1.00 0.00 O ATOM 539 CB ILE T 36 89.180 -0.541 -1.611 1.00 0.00 C ATOM 540 CG1 ILE T 36 88.671 -1.149 -2.924 1.00 0.00 C ATOM 541 CG2 ILE T 36 89.010 0.981 -1.646 1.00 0.00 C ATOM 542 CD1 ILE T 36 87.161 -0.929 -3.046 1.00 0.00 C ATOM 0 H ILE T 36 90.049 -2.890 -1.434 1.00 0.00 H new ATOM 0 HA ILE T 36 91.249 -0.347 -2.183 1.00 0.00 H new ATOM 0 HB ILE T 36 88.607 -0.950 -0.778 1.00 0.00 H new ATOM 0 HG12 ILE T 36 89.184 -0.692 -3.770 1.00 0.00 H new ATOM 0 HG13 ILE T 36 88.896 -2.215 -2.953 1.00 0.00 H new ATOM 0 HG21 ILE T 36 87.955 1.227 -1.771 1.00 0.00 H new ATOM 0 HG22 ILE T 36 89.374 1.409 -0.712 1.00 0.00 H new ATOM 0 HG23 ILE T 36 89.580 1.392 -2.480 1.00 0.00 H new ATOM 0 HD11 ILE T 36 86.804 -1.363 -3.980 1.00 0.00 H new ATOM 0 HD12 ILE T 36 86.655 -1.407 -2.207 1.00 0.00 H new ATOM 0 HD13 ILE T 36 86.947 0.140 -3.037 1.00 0.00 H new ATOM 554 N SER T 37 91.485 0.825 0.082 1.00 0.00 N ATOM 555 CA SER T 37 91.947 1.356 1.360 1.00 0.00 C ATOM 556 C SER T 37 91.762 2.870 1.409 1.00 0.00 C ATOM 557 O SER T 37 91.513 3.507 0.386 1.00 0.00 O ATOM 558 CB SER T 37 93.423 1.015 1.565 1.00 0.00 C ATOM 559 OG SER T 37 93.815 1.392 2.878 1.00 0.00 O ATOM 0 H SER T 37 91.464 1.506 -0.678 1.00 0.00 H new ATOM 0 HA SER T 37 91.356 0.902 2.155 1.00 0.00 H new ATOM 0 HB2 SER T 37 93.585 -0.053 1.417 1.00 0.00 H new ATOM 0 HB3 SER T 37 94.034 1.535 0.827 1.00 0.00 H new ATOM 0 HG SER T 37 94.761 1.173 3.013 1.00 0.00 H new ATOM 565 N THR T 38 91.886 3.437 2.604 1.00 0.00 N ATOM 566 CA THR T 38 91.729 4.878 2.778 1.00 0.00 C ATOM 567 C THR T 38 92.615 5.641 1.798 1.00 0.00 C ATOM 568 O THR T 38 92.513 6.862 1.677 1.00 0.00 O ATOM 569 CB THR T 38 92.093 5.273 4.211 1.00 0.00 C ATOM 570 OG1 THR T 38 93.506 5.362 4.330 1.00 0.00 O ATOM 571 CG2 THR T 38 91.563 4.219 5.185 1.00 0.00 C ATOM 0 H THR T 38 92.093 2.926 3.462 1.00 0.00 H new ATOM 0 HA THR T 38 90.688 5.135 2.582 1.00 0.00 H new ATOM 0 HB THR T 38 91.645 6.238 4.447 1.00 0.00 H new ATOM 0 HG1 THR T 38 93.759 5.297 5.274 1.00 0.00 H new ATOM 0 HG21 THR T 38 91.823 4.502 6.205 1.00 0.00 H new ATOM 0 HG22 THR T 38 90.479 4.151 5.093 1.00 0.00 H new ATOM 0 HG23 THR T 38 92.008 3.252 4.952 1.00 0.00 H new ATOM 579 N LYS T 39 93.486 4.916 1.104 1.00 0.00 N ATOM 580 CA LYS T 39 94.388 5.539 0.142 1.00 0.00 C ATOM 581 C LYS T 39 93.658 5.854 -1.161 1.00 0.00 C ATOM 582 O LYS T 39 93.604 7.007 -1.589 1.00 0.00 O ATOM 583 CB LYS T 39 95.568 4.608 -0.145 1.00 0.00 C ATOM 584 CG LYS T 39 96.378 4.400 1.136 1.00 0.00 C ATOM 585 CD LYS T 39 97.721 3.753 0.792 1.00 0.00 C ATOM 586 CE LYS T 39 98.553 3.595 2.066 1.00 0.00 C ATOM 587 NZ LYS T 39 99.963 3.277 1.702 1.00 0.00 N ATOM 0 H LYS T 39 93.586 3.904 1.188 1.00 0.00 H new ATOM 0 HA LYS T 39 94.754 6.472 0.571 1.00 0.00 H new ATOM 0 HB2 LYS T 39 95.206 3.650 -0.519 1.00 0.00 H new ATOM 0 HB3 LYS T 39 96.201 5.035 -0.923 1.00 0.00 H new ATOM 0 HG2 LYS T 39 96.540 5.355 1.635 1.00 0.00 H new ATOM 0 HG3 LYS T 39 95.825 3.767 1.830 1.00 0.00 H new ATOM 0 HD2 LYS T 39 97.560 2.780 0.327 1.00 0.00 H new ATOM 0 HD3 LYS T 39 98.258 4.367 0.068 1.00 0.00 H new ATOM 0 HE2 LYS T 39 98.516 4.512 2.654 1.00 0.00 H new ATOM 0 HE3 LYS T 39 98.139 2.801 2.688 1.00 0.00 H new ATOM 0 HZ1 LYS T 39 100.529 3.169 2.568 1.00 0.00 H new ATOM 0 HZ2 LYS T 39 99.990 2.391 1.158 1.00 0.00 H new ATOM 0 HZ3 LYS T 39 100.355 4.049 1.126 1.00 0.00 H new ATOM 601 N GLU T 40 93.103 4.822 -1.791 1.00 0.00 N ATOM 602 CA GLU T 40 92.383 4.999 -3.051 1.00 0.00 C ATOM 603 C GLU T 40 90.933 5.401 -2.797 1.00 0.00 C ATOM 604 O GLU T 40 90.157 5.580 -3.736 1.00 0.00 O ATOM 605 CB GLU T 40 92.419 3.700 -3.858 1.00 0.00 C ATOM 606 CG GLU T 40 93.828 3.108 -3.809 1.00 0.00 C ATOM 607 CD GLU T 40 94.845 4.143 -4.278 1.00 0.00 C ATOM 608 OE1 GLU T 40 94.963 4.328 -5.478 1.00 0.00 O ATOM 609 OE2 GLU T 40 95.489 4.738 -3.429 1.00 0.00 O ATOM 0 H GLU T 40 93.137 3.860 -1.453 1.00 0.00 H new ATOM 0 HA GLU T 40 92.871 5.794 -3.614 1.00 0.00 H new ATOM 0 HB2 GLU T 40 91.700 2.988 -3.453 1.00 0.00 H new ATOM 0 HB3 GLU T 40 92.130 3.893 -4.891 1.00 0.00 H new ATOM 0 HG2 GLU T 40 94.063 2.790 -2.793 1.00 0.00 H new ATOM 0 HG3 GLU T 40 93.881 2.221 -4.441 1.00 0.00 H new ATOM 616 N LEU T 41 90.571 5.539 -1.526 1.00 0.00 N ATOM 617 CA LEU T 41 89.209 5.919 -1.169 1.00 0.00 C ATOM 618 C LEU T 41 88.977 7.400 -1.466 1.00 0.00 C ATOM 619 O LEU T 41 88.172 7.751 -2.329 1.00 0.00 O ATOM 620 CB LEU T 41 88.965 5.629 0.324 1.00 0.00 C ATOM 621 CG LEU T 41 87.469 5.386 0.607 1.00 0.00 C ATOM 622 CD1 LEU T 41 86.632 6.533 0.030 1.00 0.00 C ATOM 623 CD2 LEU T 41 87.007 4.044 -0.004 1.00 0.00 C ATOM 0 H LEU T 41 91.195 5.395 -0.732 1.00 0.00 H new ATOM 0 HA LEU T 41 88.508 5.334 -1.765 1.00 0.00 H new ATOM 0 HB2 LEU T 41 89.542 4.755 0.626 1.00 0.00 H new ATOM 0 HB3 LEU T 41 89.320 6.468 0.923 1.00 0.00 H new ATOM 0 HG LEU T 41 87.327 5.344 1.687 1.00 0.00 H new ATOM 0 HD11 LEU T 41 85.577 6.352 0.235 1.00 0.00 H new ATOM 0 HD12 LEU T 41 86.935 7.473 0.491 1.00 0.00 H new ATOM 0 HD13 LEU T 41 86.788 6.591 -1.047 1.00 0.00 H new ATOM 0 HD21 LEU T 41 85.948 3.893 0.208 1.00 0.00 H new ATOM 0 HD22 LEU T 41 87.162 4.063 -1.083 1.00 0.00 H new ATOM 0 HD23 LEU T 41 87.584 3.228 0.431 1.00 0.00 H new ATOM 635 N GLY T 42 89.686 8.262 -0.745 1.00 0.00 N ATOM 636 CA GLY T 42 89.548 9.702 -0.938 1.00 0.00 C ATOM 637 C GLY T 42 89.795 10.084 -2.394 1.00 0.00 C ATOM 638 O GLY T 42 89.588 11.233 -2.786 1.00 0.00 O ATOM 0 H GLY T 42 90.358 7.992 -0.026 1.00 0.00 H new ATOM 0 HA2 GLY T 42 88.549 10.018 -0.640 1.00 0.00 H new ATOM 0 HA3 GLY T 42 90.254 10.228 -0.295 1.00 0.00 H new ATOM 642 N LYS T 43 90.237 9.116 -3.189 1.00 0.00 N ATOM 643 CA LYS T 43 90.508 9.365 -4.601 1.00 0.00 C ATOM 644 C LYS T 43 89.204 9.475 -5.386 1.00 0.00 C ATOM 645 O LYS T 43 89.058 10.343 -6.247 1.00 0.00 O ATOM 646 CB LYS T 43 91.360 8.233 -5.178 1.00 0.00 C ATOM 647 CG LYS T 43 91.855 8.625 -6.571 1.00 0.00 C ATOM 648 CD LYS T 43 92.817 7.555 -7.093 1.00 0.00 C ATOM 649 CE LYS T 43 93.251 7.909 -8.516 1.00 0.00 C ATOM 650 NZ LYS T 43 94.216 6.887 -9.012 1.00 0.00 N ATOM 0 H LYS T 43 90.414 8.159 -2.884 1.00 0.00 H new ATOM 0 HA LYS T 43 91.051 10.306 -4.686 1.00 0.00 H new ATOM 0 HB2 LYS T 43 92.207 8.031 -4.523 1.00 0.00 H new ATOM 0 HB3 LYS T 43 90.775 7.315 -5.234 1.00 0.00 H new ATOM 0 HG2 LYS T 43 91.010 8.732 -7.251 1.00 0.00 H new ATOM 0 HG3 LYS T 43 92.357 9.592 -6.531 1.00 0.00 H new ATOM 0 HD2 LYS T 43 93.689 7.486 -6.442 1.00 0.00 H new ATOM 0 HD3 LYS T 43 92.333 6.579 -7.082 1.00 0.00 H new ATOM 0 HE2 LYS T 43 92.382 7.952 -9.172 1.00 0.00 H new ATOM 0 HE3 LYS T 43 93.712 8.897 -8.532 1.00 0.00 H new ATOM 0 HZ1 LYS T 43 94.005 6.664 -10.006 1.00 0.00 H new ATOM 0 HZ2 LYS T 43 95.184 7.259 -8.938 1.00 0.00 H new ATOM 0 HZ3 LYS T 43 94.132 6.023 -8.438 1.00 0.00 H new ATOM 664 N VAL T 44 88.261 8.589 -5.083 1.00 0.00 N ATOM 665 CA VAL T 44 86.972 8.594 -5.767 1.00 0.00 C ATOM 666 C VAL T 44 86.078 9.699 -5.215 1.00 0.00 C ATOM 667 O VAL T 44 85.427 10.420 -5.971 1.00 0.00 O ATOM 668 CB VAL T 44 86.283 7.240 -5.592 1.00 0.00 C ATOM 669 CG1 VAL T 44 84.977 7.220 -6.389 1.00 0.00 C ATOM 670 CG2 VAL T 44 87.207 6.131 -6.102 1.00 0.00 C ATOM 0 H VAL T 44 88.363 7.863 -4.374 1.00 0.00 H new ATOM 0 HA VAL T 44 87.144 8.778 -6.827 1.00 0.00 H new ATOM 0 HB VAL T 44 86.064 7.079 -4.536 1.00 0.00 H new ATOM 0 HG11 VAL T 44 84.488 6.254 -6.262 1.00 0.00 H new ATOM 0 HG12 VAL T 44 84.318 8.010 -6.028 1.00 0.00 H new ATOM 0 HG13 VAL T 44 85.193 7.382 -7.445 1.00 0.00 H new ATOM 0 HG21 VAL T 44 86.718 5.165 -5.978 1.00 0.00 H new ATOM 0 HG22 VAL T 44 87.424 6.295 -7.157 1.00 0.00 H new ATOM 0 HG23 VAL T 44 88.137 6.142 -5.534 1.00 0.00 H new ATOM 680 N MET T 45 86.051 9.827 -3.892 1.00 0.00 N ATOM 681 CA MET T 45 85.233 10.849 -3.250 1.00 0.00 C ATOM 682 C MET T 45 85.643 12.240 -3.725 1.00 0.00 C ATOM 683 O MET T 45 84.942 13.222 -3.482 1.00 0.00 O ATOM 684 CB MET T 45 85.385 10.761 -1.730 1.00 0.00 C ATOM 685 CG MET T 45 84.705 9.488 -1.222 1.00 0.00 C ATOM 686 SD MET T 45 82.908 9.684 -1.322 1.00 0.00 S ATOM 687 CE MET T 45 82.487 7.924 -1.305 1.00 0.00 C ATOM 0 H MET T 45 86.582 9.240 -3.248 1.00 0.00 H new ATOM 0 HA MET T 45 84.191 10.677 -3.521 1.00 0.00 H new ATOM 0 HB2 MET T 45 86.441 10.755 -1.459 1.00 0.00 H new ATOM 0 HB3 MET T 45 84.940 11.637 -1.258 1.00 0.00 H new ATOM 0 HG2 MET T 45 85.022 8.631 -1.817 1.00 0.00 H new ATOM 0 HG3 MET T 45 85.003 9.289 -0.193 1.00 0.00 H new ATOM 0 HE1 MET T 45 81.405 7.808 -1.360 1.00 0.00 H new ATOM 0 HE2 MET T 45 82.949 7.431 -2.161 1.00 0.00 H new ATOM 0 HE3 MET T 45 82.854 7.471 -0.384 1.00 0.00 H new ATOM 697 N ARG T 46 86.784 12.314 -4.403 1.00 0.00 N ATOM 698 CA ARG T 46 87.280 13.590 -4.907 1.00 0.00 C ATOM 699 C ARG T 46 86.464 14.044 -6.113 1.00 0.00 C ATOM 700 O ARG T 46 86.118 15.220 -6.233 1.00 0.00 O ATOM 701 CB ARG T 46 88.751 13.455 -5.306 1.00 0.00 C ATOM 702 CG ARG T 46 89.359 14.845 -5.500 1.00 0.00 C ATOM 703 CD ARG T 46 90.802 14.707 -5.987 1.00 0.00 C ATOM 704 NE ARG T 46 91.451 16.012 -6.023 1.00 0.00 N ATOM 705 CZ ARG T 46 92.741 16.131 -6.320 1.00 0.00 C ATOM 706 NH1 ARG T 46 93.450 15.067 -6.583 1.00 0.00 N ATOM 707 NH2 ARG T 46 93.299 17.310 -6.348 1.00 0.00 N ATOM 0 H ARG T 46 87.378 11.513 -4.615 1.00 0.00 H new ATOM 0 HA ARG T 46 87.183 14.335 -4.117 1.00 0.00 H new ATOM 0 HB2 ARG T 46 89.299 12.912 -4.536 1.00 0.00 H new ATOM 0 HB3 ARG T 46 88.837 12.877 -6.226 1.00 0.00 H new ATOM 0 HG2 ARG T 46 88.773 15.412 -6.223 1.00 0.00 H new ATOM 0 HG3 ARG T 46 89.332 15.400 -4.562 1.00 0.00 H new ATOM 0 HD2 ARG T 46 91.353 14.037 -5.327 1.00 0.00 H new ATOM 0 HD3 ARG T 46 90.816 14.259 -6.980 1.00 0.00 H new ATOM 0 HE ARG T 46 90.905 16.849 -5.817 1.00 0.00 H new ATOM 0 HH11 ARG T 46 93.014 14.145 -6.561 1.00 0.00 H new ATOM 0 HH12 ARG T 46 94.440 15.157 -6.811 1.00 0.00 H new ATOM 0 HH21 ARG T 46 92.745 18.141 -6.142 1.00 0.00 H new ATOM 0 HH22 ARG T 46 94.289 17.400 -6.576 1.00 0.00 H new ATOM 721 N MET T 47 86.161 13.107 -7.005 1.00 0.00 N ATOM 722 CA MET T 47 85.385 13.424 -8.198 1.00 0.00 C ATOM 723 C MET T 47 84.015 13.975 -7.816 1.00 0.00 C ATOM 724 O MET T 47 83.423 14.760 -8.557 1.00 0.00 O ATOM 725 CB MET T 47 85.213 12.170 -9.057 1.00 0.00 C ATOM 726 CG MET T 47 86.585 11.665 -9.505 1.00 0.00 C ATOM 727 SD MET T 47 86.379 10.450 -10.831 1.00 0.00 S ATOM 728 CE MET T 47 85.516 9.194 -9.856 1.00 0.00 C ATOM 0 H MET T 47 86.439 12.129 -6.926 1.00 0.00 H new ATOM 0 HA MET T 47 85.922 14.183 -8.767 1.00 0.00 H new ATOM 0 HB2 MET T 47 84.697 11.396 -8.489 1.00 0.00 H new ATOM 0 HB3 MET T 47 84.595 12.394 -9.926 1.00 0.00 H new ATOM 0 HG2 MET T 47 87.195 12.499 -9.853 1.00 0.00 H new ATOM 0 HG3 MET T 47 87.111 11.215 -8.663 1.00 0.00 H new ATOM 0 HE1 MET T 47 85.583 8.231 -10.362 1.00 0.00 H new ATOM 0 HE2 MET T 47 85.976 9.119 -8.871 1.00 0.00 H new ATOM 0 HE3 MET T 47 84.468 9.474 -9.747 1.00 0.00 H new ATOM 738 N LEU T 48 83.518 13.560 -6.656 1.00 0.00 N ATOM 739 CA LEU T 48 82.217 14.020 -6.185 1.00 0.00 C ATOM 740 C LEU T 48 82.310 15.462 -5.690 1.00 0.00 C ATOM 741 O LEU T 48 81.919 16.395 -6.391 1.00 0.00 O ATOM 742 CB LEU T 48 81.721 13.115 -5.049 1.00 0.00 C ATOM 743 CG LEU T 48 81.186 11.799 -5.626 1.00 0.00 C ATOM 744 CD1 LEU T 48 82.240 11.167 -6.540 1.00 0.00 C ATOM 745 CD2 LEU T 48 80.863 10.839 -4.478 1.00 0.00 C ATOM 0 H LEU T 48 83.992 12.911 -6.028 1.00 0.00 H new ATOM 0 HA LEU T 48 81.512 13.976 -7.015 1.00 0.00 H new ATOM 0 HB2 LEU T 48 82.534 12.913 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU T 48 80.937 13.621 -4.486 1.00 0.00 H new ATOM 0 HG LEU T 48 80.284 11.997 -6.204 1.00 0.00 H new ATOM 0 HD11 LEU T 48 81.855 10.232 -6.947 1.00 0.00 H new ATOM 0 HD12 LEU T 48 82.471 11.851 -7.357 1.00 0.00 H new ATOM 0 HD13 LEU T 48 83.146 10.967 -5.967 1.00 0.00 H new ATOM 0 HD21 LEU T 48 80.482 9.902 -4.884 1.00 0.00 H new ATOM 0 HD22 LEU T 48 81.767 10.644 -3.901 1.00 0.00 H new ATOM 0 HD23 LEU T 48 80.109 11.287 -3.830 1.00 0.00 H new ATOM 757 N GLY T 49 82.830 15.634 -4.479 1.00 0.00 N ATOM 758 CA GLY T 49 82.969 16.965 -3.901 1.00 0.00 C ATOM 759 C GLY T 49 83.372 16.880 -2.433 1.00 0.00 C ATOM 760 O GLY T 49 82.998 17.731 -1.626 1.00 0.00 O ATOM 0 H GLY T 49 83.160 14.875 -3.883 1.00 0.00 H new ATOM 0 HA2 GLY T 49 83.718 17.531 -4.456 1.00 0.00 H new ATOM 0 HA3 GLY T 49 82.027 17.506 -3.993 1.00 0.00 H new ATOM 764 N GLN T 50 84.139 15.844 -2.092 1.00 0.00 N ATOM 765 CA GLN T 50 84.596 15.643 -0.715 1.00 0.00 C ATOM 766 C GLN T 50 86.067 15.236 -0.699 1.00 0.00 C ATOM 767 O GLN T 50 86.623 14.846 -1.725 1.00 0.00 O ATOM 768 CB GLN T 50 83.760 14.551 -0.042 1.00 0.00 C ATOM 769 CG GLN T 50 82.286 14.961 -0.037 1.00 0.00 C ATOM 770 CD GLN T 50 82.092 16.202 0.828 1.00 0.00 C ATOM 771 OE1 GLN T 50 82.316 16.133 2.112 1.00 0.00 O flip ATOM 772 NE2 GLN T 50 81.726 17.263 0.320 1.00 0.00 N flip ATOM 0 H GLN T 50 84.457 15.131 -2.749 1.00 0.00 H new ATOM 0 HA GLN T 50 84.478 16.580 -0.170 1.00 0.00 H new ATOM 0 HB2 GLN T 50 83.883 13.607 -0.572 1.00 0.00 H new ATOM 0 HB3 GLN T 50 84.107 14.391 0.979 1.00 0.00 H new ATOM 0 HG2 GLN T 50 81.953 15.162 -1.055 1.00 0.00 H new ATOM 0 HG3 GLN T 50 81.674 14.143 0.344 1.00 0.00 H new ATOM 0 HE21 GLN T 50 81.552 17.314 -0.684 1.00 0.00 H new ATOM 0 HE22 GLN T 50 81.597 18.090 0.903 1.00 0.00 H new ATOM 781 N ASN T 51 86.691 15.332 0.471 1.00 0.00 N ATOM 782 CA ASN T 51 88.098 14.972 0.606 1.00 0.00 C ATOM 783 C ASN T 51 88.526 15.013 2.071 1.00 0.00 C ATOM 784 O ASN T 51 89.400 15.793 2.450 1.00 0.00 O ATOM 785 CB ASN T 51 88.963 15.937 -0.206 1.00 0.00 C ATOM 786 CG ASN T 51 90.438 15.590 -0.029 1.00 0.00 C ATOM 787 OD1 ASN T 51 90.910 14.588 -0.565 1.00 0.00 O ATOM 788 ND2 ASN T 51 91.198 16.364 0.697 1.00 0.00 N ATOM 0 H ASN T 51 86.249 15.653 1.332 1.00 0.00 H new ATOM 0 HA ASN T 51 88.231 13.958 0.229 1.00 0.00 H new ATOM 0 HB2 ASN T 51 88.692 15.882 -1.260 1.00 0.00 H new ATOM 0 HB3 ASN T 51 88.781 16.962 0.117 1.00 0.00 H new ATOM 0 HD21 ASN T 51 92.185 16.139 0.821 1.00 0.00 H new ATOM 0 HD22 ASN T 51 90.805 17.194 1.140 1.00 0.00 H new ATOM 795 N PRO T 52 87.926 14.193 2.894 1.00 0.00 N ATOM 796 CA PRO T 52 88.248 14.133 4.350 1.00 0.00 C ATOM 797 C PRO T 52 89.553 13.381 4.619 1.00 0.00 C ATOM 798 O PRO T 52 90.223 12.929 3.690 1.00 0.00 O ATOM 799 CB PRO T 52 87.043 13.392 4.942 1.00 0.00 C ATOM 800 CG PRO T 52 86.574 12.493 3.841 1.00 0.00 C ATOM 801 CD PRO T 52 86.872 13.230 2.528 1.00 0.00 C ATOM 0 HA PRO T 52 88.405 15.119 4.787 1.00 0.00 H new ATOM 0 HB2 PRO T 52 87.324 12.821 5.827 1.00 0.00 H new ATOM 0 HB3 PRO T 52 86.261 14.087 5.246 1.00 0.00 H new ATOM 0 HG2 PRO T 52 87.091 11.534 3.875 1.00 0.00 H new ATOM 0 HG3 PRO T 52 85.508 12.284 3.937 1.00 0.00 H new ATOM 0 HD2 PRO T 52 87.210 12.543 1.752 1.00 0.00 H new ATOM 0 HD3 PRO T 52 85.986 13.735 2.143 1.00 0.00 H new ATOM 809 N THR T 53 89.903 13.254 5.895 1.00 0.00 N ATOM 810 CA THR T 53 91.127 12.557 6.279 1.00 0.00 C ATOM 811 C THR T 53 90.916 11.041 6.213 1.00 0.00 C ATOM 812 O THR T 53 89.793 10.563 6.365 1.00 0.00 O ATOM 813 CB THR T 53 91.536 12.960 7.707 1.00 0.00 C ATOM 814 OG1 THR T 53 92.183 11.867 8.344 1.00 0.00 O ATOM 815 CG2 THR T 53 90.293 13.347 8.513 1.00 0.00 C ATOM 0 H THR T 53 89.361 13.622 6.677 1.00 0.00 H new ATOM 0 HA THR T 53 91.920 12.836 5.585 1.00 0.00 H new ATOM 0 HB THR T 53 92.216 13.810 7.656 1.00 0.00 H new ATOM 0 HG1 THR T 53 92.444 12.126 9.252 1.00 0.00 H new ATOM 0 HG21 THR T 53 90.588 13.631 9.523 1.00 0.00 H new ATOM 0 HG22 THR T 53 89.794 14.187 8.031 1.00 0.00 H new ATOM 0 HG23 THR T 53 89.611 12.498 8.560 1.00 0.00 H new ATOM 823 N PRO T 54 91.963 10.280 5.993 1.00 0.00 N ATOM 824 CA PRO T 54 91.865 8.790 5.914 1.00 0.00 C ATOM 825 C PRO T 54 91.516 8.172 7.268 1.00 0.00 C ATOM 826 O PRO T 54 91.234 6.978 7.362 1.00 0.00 O ATOM 827 CB PRO T 54 93.262 8.357 5.439 1.00 0.00 C ATOM 828 CG PRO T 54 94.174 9.458 5.878 1.00 0.00 C ATOM 829 CD PRO T 54 93.350 10.743 5.796 1.00 0.00 C ATOM 0 HA PRO T 54 91.071 8.459 5.244 1.00 0.00 H new ATOM 0 HB2 PRO T 54 93.552 7.404 5.881 1.00 0.00 H new ATOM 0 HB3 PRO T 54 93.290 8.228 4.357 1.00 0.00 H new ATOM 0 HG2 PRO T 54 94.531 9.287 6.894 1.00 0.00 H new ATOM 0 HG3 PRO T 54 95.053 9.516 5.236 1.00 0.00 H new ATOM 0 HD2 PRO T 54 93.646 11.459 6.563 1.00 0.00 H new ATOM 0 HD3 PRO T 54 93.474 11.238 4.833 1.00 0.00 H new ATOM 837 N GLU T 55 91.535 8.996 8.312 1.00 0.00 N ATOM 838 CA GLU T 55 91.217 8.522 9.654 1.00 0.00 C ATOM 839 C GLU T 55 89.706 8.437 9.846 1.00 0.00 C ATOM 840 O GLU T 55 89.210 7.575 10.571 1.00 0.00 O ATOM 841 CB GLU T 55 91.813 9.471 10.697 1.00 0.00 C ATOM 842 CG GLU T 55 91.493 8.952 12.101 1.00 0.00 C ATOM 843 CD GLU T 55 92.267 9.755 13.141 1.00 0.00 C ATOM 844 OE1 GLU T 55 92.354 10.962 12.985 1.00 0.00 O ATOM 845 OE2 GLU T 55 92.761 9.151 14.079 1.00 0.00 O ATOM 0 H GLU T 55 91.766 9.988 8.255 1.00 0.00 H new ATOM 0 HA GLU T 55 91.645 7.528 9.780 1.00 0.00 H new ATOM 0 HB2 GLU T 55 92.892 9.545 10.562 1.00 0.00 H new ATOM 0 HB3 GLU T 55 91.406 10.474 10.567 1.00 0.00 H new ATOM 0 HG2 GLU T 55 90.423 9.030 12.292 1.00 0.00 H new ATOM 0 HG3 GLU T 55 91.754 7.896 12.176 1.00 0.00 H new ATOM 852 N GLU T 56 88.981 9.339 9.191 1.00 0.00 N ATOM 853 CA GLU T 56 87.526 9.359 9.295 1.00 0.00 C ATOM 854 C GLU T 56 86.907 8.300 8.388 1.00 0.00 C ATOM 855 O GLU T 56 86.022 7.552 8.805 1.00 0.00 O ATOM 856 CB GLU T 56 86.994 10.740 8.905 1.00 0.00 C ATOM 857 CG GLU T 56 87.325 11.746 10.008 1.00 0.00 C ATOM 858 CD GLU T 56 86.898 13.147 9.582 1.00 0.00 C ATOM 859 OE1 GLU T 56 87.369 13.600 8.551 1.00 0.00 O ATOM 860 OE2 GLU T 56 86.107 13.746 10.291 1.00 0.00 O ATOM 0 H GLU T 56 89.374 10.061 8.587 1.00 0.00 H new ATOM 0 HA GLU T 56 87.252 9.141 10.327 1.00 0.00 H new ATOM 0 HB2 GLU T 56 87.438 11.059 7.962 1.00 0.00 H new ATOM 0 HB3 GLU T 56 85.916 10.696 8.751 1.00 0.00 H new ATOM 0 HG2 GLU T 56 86.816 11.467 10.931 1.00 0.00 H new ATOM 0 HG3 GLU T 56 88.395 11.731 10.216 1.00 0.00 H new ATOM 867 N LEU T 57 87.375 8.244 7.145 1.00 0.00 N ATOM 868 CA LEU T 57 86.857 7.274 6.188 1.00 0.00 C ATOM 869 C LEU T 57 86.986 5.856 6.735 1.00 0.00 C ATOM 870 O LEU T 57 86.074 5.042 6.593 1.00 0.00 O ATOM 871 CB LEU T 57 87.620 7.384 4.863 1.00 0.00 C ATOM 872 CG LEU T 57 87.397 8.774 4.236 1.00 0.00 C ATOM 873 CD1 LEU T 57 88.525 9.078 3.244 1.00 0.00 C ATOM 874 CD2 LEU T 57 86.053 8.817 3.492 1.00 0.00 C ATOM 0 H LEU T 57 88.106 8.854 6.779 1.00 0.00 H new ATOM 0 HA LEU T 57 85.802 7.491 6.018 1.00 0.00 H new ATOM 0 HB2 LEU T 57 88.684 7.220 5.033 1.00 0.00 H new ATOM 0 HB3 LEU T 57 87.283 6.608 4.175 1.00 0.00 H new ATOM 0 HG LEU T 57 87.390 9.517 5.033 1.00 0.00 H new ATOM 0 HD11 LEU T 57 88.365 10.061 2.802 1.00 0.00 H new ATOM 0 HD12 LEU T 57 89.482 9.066 3.766 1.00 0.00 H new ATOM 0 HD13 LEU T 57 88.531 8.323 2.458 1.00 0.00 H new ATOM 0 HD21 LEU T 57 85.911 9.805 3.055 1.00 0.00 H new ATOM 0 HD22 LEU T 57 86.051 8.067 2.701 1.00 0.00 H new ATOM 0 HD23 LEU T 57 85.243 8.609 4.191 1.00 0.00 H new ATOM 886 N GLN T 58 88.123 5.565 7.361 1.00 0.00 N ATOM 887 CA GLN T 58 88.355 4.238 7.924 1.00 0.00 C ATOM 888 C GLN T 58 87.130 3.767 8.704 1.00 0.00 C ATOM 889 O GLN T 58 86.849 2.571 8.774 1.00 0.00 O ATOM 890 CB GLN T 58 89.585 4.271 8.844 1.00 0.00 C ATOM 891 CG GLN T 58 89.709 2.955 9.625 1.00 0.00 C ATOM 892 CD GLN T 58 89.580 1.760 8.684 1.00 0.00 C ATOM 893 OE1 GLN T 58 88.646 0.969 8.809 1.00 0.00 O ATOM 894 NE2 GLN T 58 90.468 1.581 7.744 1.00 0.00 N ATOM 0 H GLN T 58 88.892 6.223 7.491 1.00 0.00 H new ATOM 0 HA GLN T 58 88.536 3.538 7.109 1.00 0.00 H new ATOM 0 HB2 GLN T 58 90.485 4.435 8.252 1.00 0.00 H new ATOM 0 HB3 GLN T 58 89.504 5.107 9.539 1.00 0.00 H new ATOM 0 HG2 GLN T 58 90.670 2.919 10.138 1.00 0.00 H new ATOM 0 HG3 GLN T 58 88.936 2.906 10.392 1.00 0.00 H new ATOM 0 HE21 GLN T 58 91.242 2.238 7.642 1.00 0.00 H new ATOM 0 HE22 GLN T 58 90.388 0.784 7.112 1.00 0.00 H new ATOM 903 N GLU T 59 86.405 4.716 9.288 1.00 0.00 N ATOM 904 CA GLU T 59 85.213 4.385 10.060 1.00 0.00 C ATOM 905 C GLU T 59 84.177 3.696 9.177 1.00 0.00 C ATOM 906 O GLU T 59 83.430 2.833 9.638 1.00 0.00 O ATOM 907 CB GLU T 59 84.611 5.656 10.662 1.00 0.00 C ATOM 908 CG GLU T 59 85.657 6.354 11.532 1.00 0.00 C ATOM 909 CD GLU T 59 85.075 7.634 12.122 1.00 0.00 C ATOM 910 OE1 GLU T 59 83.864 7.706 12.249 1.00 0.00 O ATOM 911 OE2 GLU T 59 85.848 8.523 12.437 1.00 0.00 O ATOM 0 H GLU T 59 86.620 5.712 9.242 1.00 0.00 H new ATOM 0 HA GLU T 59 85.499 3.705 10.862 1.00 0.00 H new ATOM 0 HB2 GLU T 59 84.278 6.325 9.868 1.00 0.00 H new ATOM 0 HB3 GLU T 59 83.733 5.408 11.259 1.00 0.00 H new ATOM 0 HG2 GLU T 59 85.979 5.688 12.333 1.00 0.00 H new ATOM 0 HG3 GLU T 59 86.540 6.587 10.937 1.00 0.00 H new ATOM 918 N MET T 60 84.138 4.084 7.907 1.00 0.00 N ATOM 919 CA MET T 60 83.190 3.499 6.966 1.00 0.00 C ATOM 920 C MET T 60 83.630 2.095 6.561 1.00 0.00 C ATOM 921 O MET T 60 82.800 1.240 6.251 1.00 0.00 O ATOM 922 CB MET T 60 83.080 4.381 5.720 1.00 0.00 C ATOM 923 CG MET T 60 82.319 5.664 6.063 1.00 0.00 C ATOM 924 SD MET T 60 80.549 5.305 6.174 1.00 0.00 S ATOM 925 CE MET T 60 80.142 5.627 4.440 1.00 0.00 C ATOM 0 H MET T 60 84.748 4.797 7.507 1.00 0.00 H new ATOM 0 HA MET T 60 82.217 3.435 7.453 1.00 0.00 H new ATOM 0 HB2 MET T 60 84.074 4.625 5.346 1.00 0.00 H new ATOM 0 HB3 MET T 60 82.564 3.842 4.925 1.00 0.00 H new ATOM 0 HG2 MET T 60 82.678 6.071 7.008 1.00 0.00 H new ATOM 0 HG3 MET T 60 82.500 6.422 5.301 1.00 0.00 H new ATOM 0 HE1 MET T 60 79.491 6.499 4.375 1.00 0.00 H new ATOM 0 HE2 MET T 60 81.058 5.816 3.880 1.00 0.00 H new ATOM 0 HE3 MET T 60 79.632 4.761 4.019 1.00 0.00 H new ATOM 935 N ILE T 61 84.941 1.863 6.566 1.00 0.00 N ATOM 936 CA ILE T 61 85.486 0.557 6.197 1.00 0.00 C ATOM 937 C ILE T 61 85.604 -0.337 7.432 1.00 0.00 C ATOM 938 O ILE T 61 85.694 -1.559 7.318 1.00 0.00 O ATOM 939 CB ILE T 61 86.867 0.734 5.545 1.00 0.00 C ATOM 940 CG1 ILE T 61 86.704 1.361 4.153 1.00 0.00 C ATOM 941 CG2 ILE T 61 87.558 -0.627 5.398 1.00 0.00 C ATOM 942 CD1 ILE T 61 86.183 2.799 4.269 1.00 0.00 C ATOM 0 H ILE T 61 85.643 2.558 6.820 1.00 0.00 H new ATOM 0 HA ILE T 61 84.811 0.083 5.485 1.00 0.00 H new ATOM 0 HB ILE T 61 87.472 1.384 6.177 1.00 0.00 H new ATOM 0 HG12 ILE T 61 87.661 1.356 3.631 1.00 0.00 H new ATOM 0 HG13 ILE T 61 86.013 0.764 3.558 1.00 0.00 H new ATOM 0 HG21 ILE T 61 88.535 -0.491 4.935 1.00 0.00 H new ATOM 0 HG22 ILE T 61 87.682 -1.080 6.382 1.00 0.00 H new ATOM 0 HG23 ILE T 61 86.948 -1.279 4.773 1.00 0.00 H new ATOM 0 HD11 ILE T 61 86.074 3.228 3.273 1.00 0.00 H new ATOM 0 HD12 ILE T 61 85.216 2.796 4.771 1.00 0.00 H new ATOM 0 HD13 ILE T 61 86.889 3.396 4.846 1.00 0.00 H new ATOM 954 N ASP T 62 85.612 0.280 8.609 1.00 0.00 N ATOM 955 CA ASP T 62 85.730 -0.471 9.855 1.00 0.00 C ATOM 956 C ASP T 62 84.397 -1.104 10.246 1.00 0.00 C ATOM 957 O ASP T 62 84.359 -2.046 11.038 1.00 0.00 O ATOM 958 CB ASP T 62 86.202 0.455 10.977 1.00 0.00 C ATOM 959 CG ASP T 62 86.334 -0.328 12.279 1.00 0.00 C ATOM 960 OD1 ASP T 62 85.335 -0.471 12.965 1.00 0.00 O ATOM 961 OD2 ASP T 62 87.431 -0.772 12.572 1.00 0.00 O ATOM 0 H ASP T 62 85.539 1.291 8.727 1.00 0.00 H new ATOM 0 HA ASP T 62 86.458 -1.267 9.701 1.00 0.00 H new ATOM 0 HB2 ASP T 62 87.161 0.901 10.712 1.00 0.00 H new ATOM 0 HB3 ASP T 62 85.494 1.274 11.106 1.00 0.00 H new ATOM 966 N GLU T 63 83.307 -0.581 9.694 1.00 0.00 N ATOM 967 CA GLU T 63 81.980 -1.107 10.004 1.00 0.00 C ATOM 968 C GLU T 63 81.692 -2.370 9.194 1.00 0.00 C ATOM 969 O GLU T 63 81.047 -3.297 9.685 1.00 0.00 O ATOM 970 CB GLU T 63 80.914 -0.046 9.708 1.00 0.00 C ATOM 971 CG GLU T 63 81.221 0.630 8.371 1.00 0.00 C ATOM 972 CD GLU T 63 80.012 1.435 7.904 1.00 0.00 C ATOM 973 OE1 GLU T 63 79.059 0.824 7.448 1.00 0.00 O ATOM 974 OE2 GLU T 63 80.057 2.649 8.011 1.00 0.00 O ATOM 0 H GLU T 63 83.314 0.199 9.036 1.00 0.00 H new ATOM 0 HA GLU T 63 81.952 -1.362 11.063 1.00 0.00 H new ATOM 0 HB2 GLU T 63 79.927 -0.507 9.676 1.00 0.00 H new ATOM 0 HB3 GLU T 63 80.894 0.696 10.506 1.00 0.00 H new ATOM 0 HG2 GLU T 63 82.086 1.285 8.475 1.00 0.00 H new ATOM 0 HG3 GLU T 63 81.478 -0.122 7.625 1.00 0.00 H new ATOM 981 N VAL T 64 82.168 -2.400 7.951 1.00 0.00 N ATOM 982 CA VAL T 64 81.949 -3.555 7.081 1.00 0.00 C ATOM 983 C VAL T 64 83.053 -4.594 7.267 1.00 0.00 C ATOM 984 O VAL T 64 82.810 -5.795 7.149 1.00 0.00 O ATOM 985 CB VAL T 64 81.911 -3.104 5.619 1.00 0.00 C ATOM 986 CG1 VAL T 64 80.598 -2.368 5.344 1.00 0.00 C ATOM 987 CG2 VAL T 64 83.086 -2.163 5.345 1.00 0.00 C ATOM 0 H VAL T 64 82.704 -1.644 7.525 1.00 0.00 H new ATOM 0 HA VAL T 64 80.995 -4.010 7.349 1.00 0.00 H new ATOM 0 HB VAL T 64 81.982 -3.976 4.970 1.00 0.00 H new ATOM 0 HG11 VAL T 64 80.572 -2.047 4.303 1.00 0.00 H new ATOM 0 HG12 VAL T 64 79.759 -3.036 5.539 1.00 0.00 H new ATOM 0 HG13 VAL T 64 80.527 -1.496 5.994 1.00 0.00 H new ATOM 0 HG21 VAL T 64 83.059 -1.841 4.304 1.00 0.00 H new ATOM 0 HG22 VAL T 64 83.014 -1.292 5.996 1.00 0.00 H new ATOM 0 HG23 VAL T 64 84.023 -2.685 5.540 1.00 0.00 H new ATOM 997 N ASP T 65 84.263 -4.127 7.555 1.00 0.00 N ATOM 998 CA ASP T 65 85.391 -5.032 7.751 1.00 0.00 C ATOM 999 C ASP T 65 85.102 -6.008 8.887 1.00 0.00 C ATOM 1000 O ASP T 65 85.593 -5.840 10.003 1.00 0.00 O ATOM 1001 CB ASP T 65 86.661 -4.230 8.066 1.00 0.00 C ATOM 1002 CG ASP T 65 87.226 -3.615 6.789 1.00 0.00 C ATOM 1003 OD1 ASP T 65 86.487 -3.520 5.823 1.00 0.00 O ATOM 1004 OD2 ASP T 65 88.390 -3.249 6.797 1.00 0.00 O ATOM 0 H ASP T 65 84.487 -3.137 7.657 1.00 0.00 H new ATOM 0 HA ASP T 65 85.543 -5.598 6.832 1.00 0.00 H new ATOM 0 HB2 ASP T 65 86.434 -3.445 8.787 1.00 0.00 H new ATOM 0 HB3 ASP T 65 87.406 -4.880 8.526 1.00 0.00 H new ATOM 1009 N GLU T 66 84.307 -7.031 8.593 1.00 0.00 N ATOM 1010 CA GLU T 66 83.963 -8.032 9.596 1.00 0.00 C ATOM 1011 C GLU T 66 85.102 -9.034 9.753 1.00 0.00 C ATOM 1012 O GLU T 66 84.873 -10.214 10.021 1.00 0.00 O ATOM 1013 CB GLU T 66 82.686 -8.768 9.184 1.00 0.00 C ATOM 1014 CG GLU T 66 81.481 -7.843 9.369 1.00 0.00 C ATOM 1015 CD GLU T 66 81.183 -7.664 10.853 1.00 0.00 C ATOM 1016 OE1 GLU T 66 81.656 -8.472 11.635 1.00 0.00 O ATOM 1017 OE2 GLU T 66 80.485 -6.720 11.187 1.00 0.00 O ATOM 0 H GLU T 66 83.891 -7.189 7.675 1.00 0.00 H new ATOM 0 HA GLU T 66 83.798 -7.529 10.549 1.00 0.00 H new ATOM 0 HB2 GLU T 66 82.757 -9.087 8.144 1.00 0.00 H new ATOM 0 HB3 GLU T 66 82.562 -9.668 9.786 1.00 0.00 H new ATOM 0 HG2 GLU T 66 81.682 -6.875 8.911 1.00 0.00 H new ATOM 0 HG3 GLU T 66 80.611 -8.261 8.863 1.00 0.00 H new ATOM 1024 N ASP T 67 86.331 -8.554 9.583 1.00 0.00 N ATOM 1025 CA ASP T 67 87.505 -9.413 9.705 1.00 0.00 C ATOM 1026 C ASP T 67 88.738 -8.588 10.059 1.00 0.00 C ATOM 1027 O ASP T 67 89.858 -9.099 10.063 1.00 0.00 O ATOM 1028 CB ASP T 67 87.747 -10.155 8.388 1.00 0.00 C ATOM 1029 CG ASP T 67 88.160 -9.168 7.300 1.00 0.00 C ATOM 1030 OD1 ASP T 67 87.482 -8.165 7.147 1.00 0.00 O ATOM 1031 OD2 ASP T 67 89.149 -9.431 6.636 1.00 0.00 O ATOM 0 H ASP T 67 86.539 -7.580 9.362 1.00 0.00 H new ATOM 0 HA ASP T 67 87.323 -10.134 10.502 1.00 0.00 H new ATOM 0 HB2 ASP T 67 88.525 -10.907 8.522 1.00 0.00 H new ATOM 0 HB3 ASP T 67 86.842 -10.683 8.087 1.00 0.00 H new ATOM 1036 N GLY T 68 88.524 -7.310 10.356 1.00 0.00 N ATOM 1037 CA GLY T 68 89.627 -6.423 10.711 1.00 0.00 C ATOM 1038 C GLY T 68 90.807 -6.615 9.764 1.00 0.00 C ATOM 1039 O GLY T 68 91.762 -7.325 10.083 1.00 0.00 O ATOM 0 H GLY T 68 87.605 -6.868 10.358 1.00 0.00 H new ATOM 0 HA2 GLY T 68 89.291 -5.387 10.675 1.00 0.00 H new ATOM 0 HA3 GLY T 68 89.942 -6.620 11.736 1.00 0.00 H new ATOM 1043 N SER T 69 90.734 -5.979 8.596 1.00 0.00 N ATOM 1044 CA SER T 69 91.800 -6.083 7.599 1.00 0.00 C ATOM 1045 C SER T 69 91.976 -4.760 6.860 1.00 0.00 C ATOM 1046 O SER T 69 92.913 -4.596 6.078 1.00 0.00 O ATOM 1047 CB SER T 69 91.466 -7.187 6.595 1.00 0.00 C ATOM 1048 OG SER T 69 90.221 -6.895 5.973 1.00 0.00 O ATOM 0 H SER T 69 89.951 -5.388 8.317 1.00 0.00 H new ATOM 0 HA SER T 69 92.730 -6.325 8.113 1.00 0.00 H new ATOM 0 HB2 SER T 69 92.252 -7.261 5.844 1.00 0.00 H new ATOM 0 HB3 SER T 69 91.416 -8.151 7.101 1.00 0.00 H new ATOM 0 HG SER T 69 90.380 -6.537 5.075 1.00 0.00 H new ATOM 1054 N GLY T 70 91.072 -3.819 7.111 1.00 0.00 N ATOM 1055 CA GLY T 70 91.142 -2.515 6.462 1.00 0.00 C ATOM 1056 C GLY T 70 91.057 -2.655 4.946 1.00 0.00 C ATOM 1057 O GLY T 70 91.921 -2.164 4.219 1.00 0.00 O ATOM 0 H GLY T 70 90.288 -3.933 7.754 1.00 0.00 H new ATOM 0 HA2 GLY T 70 90.329 -1.883 6.819 1.00 0.00 H new ATOM 0 HA3 GLY T 70 92.074 -2.019 6.734 1.00 0.00 H new ATOM 1061 N THR T 71 90.010 -3.327 4.475 1.00 0.00 N ATOM 1062 CA THR T 71 89.817 -3.527 3.041 1.00 0.00 C ATOM 1063 C THR T 71 88.335 -3.697 2.721 1.00 0.00 C ATOM 1064 O THR T 71 87.506 -3.821 3.623 1.00 0.00 O ATOM 1065 CB THR T 71 90.585 -4.768 2.576 1.00 0.00 C ATOM 1066 OG1 THR T 71 90.189 -5.886 3.359 1.00 0.00 O ATOM 1067 CG2 THR T 71 92.089 -4.537 2.738 1.00 0.00 C ATOM 0 H THR T 71 89.285 -3.741 5.062 1.00 0.00 H new ATOM 0 HA THR T 71 90.195 -2.649 2.517 1.00 0.00 H new ATOM 0 HB THR T 71 90.363 -4.959 1.526 1.00 0.00 H new ATOM 0 HG1 THR T 71 90.678 -6.682 3.063 1.00 0.00 H new ATOM 0 HG21 THR T 71 92.631 -5.423 2.406 1.00 0.00 H new ATOM 0 HG22 THR T 71 92.392 -3.679 2.137 1.00 0.00 H new ATOM 0 HG23 THR T 71 92.317 -4.344 3.786 1.00 0.00 H new ATOM 1075 N VAL T 72 88.009 -3.701 1.430 1.00 0.00 N ATOM 1076 CA VAL T 72 86.621 -3.855 0.991 1.00 0.00 C ATOM 1077 C VAL T 72 86.558 -4.637 -0.317 1.00 0.00 C ATOM 1078 O VAL T 72 86.517 -4.053 -1.400 1.00 0.00 O ATOM 1079 CB VAL T 72 85.982 -2.477 0.795 1.00 0.00 C ATOM 1080 CG1 VAL T 72 84.547 -2.641 0.285 1.00 0.00 C ATOM 1081 CG2 VAL T 72 85.966 -1.732 2.131 1.00 0.00 C ATOM 0 H VAL T 72 88.683 -3.600 0.671 1.00 0.00 H new ATOM 0 HA VAL T 72 86.074 -4.405 1.757 1.00 0.00 H new ATOM 0 HB VAL T 72 86.560 -1.910 0.066 1.00 0.00 H new ATOM 0 HG11 VAL T 72 84.095 -1.659 0.147 1.00 0.00 H new ATOM 0 HG12 VAL T 72 84.558 -3.173 -0.666 1.00 0.00 H new ATOM 0 HG13 VAL T 72 83.965 -3.209 1.011 1.00 0.00 H new ATOM 0 HG21 VAL T 72 85.512 -0.751 1.995 1.00 0.00 H new ATOM 0 HG22 VAL T 72 85.388 -2.302 2.858 1.00 0.00 H new ATOM 0 HG23 VAL T 72 86.987 -1.612 2.493 1.00 0.00 H new ATOM 1091 N ASP T 73 86.550 -5.962 -0.207 1.00 0.00 N ATOM 1092 CA ASP T 73 86.488 -6.818 -1.388 1.00 0.00 C ATOM 1093 C ASP T 73 85.049 -6.940 -1.880 1.00 0.00 C ATOM 1094 O ASP T 73 84.108 -6.605 -1.161 1.00 0.00 O ATOM 1095 CB ASP T 73 87.038 -8.207 -1.057 1.00 0.00 C ATOM 1096 CG ASP T 73 86.443 -8.706 0.255 1.00 0.00 C ATOM 1097 OD1 ASP T 73 85.493 -8.099 0.721 1.00 0.00 O ATOM 1098 OD2 ASP T 73 86.945 -9.689 0.775 1.00 0.00 O ATOM 0 H ASP T 73 86.585 -6.464 0.680 1.00 0.00 H new ATOM 0 HA ASP T 73 87.094 -6.369 -2.175 1.00 0.00 H new ATOM 0 HB2 ASP T 73 86.799 -8.903 -1.862 1.00 0.00 H new ATOM 0 HB3 ASP T 73 88.125 -8.168 -0.981 1.00 0.00 H new ATOM 1103 N PHE T 74 84.886 -7.419 -3.108 1.00 0.00 N ATOM 1104 CA PHE T 74 83.555 -7.578 -3.686 1.00 0.00 C ATOM 1105 C PHE T 74 82.662 -8.410 -2.769 1.00 0.00 C ATOM 1106 O PHE T 74 81.467 -8.562 -3.024 1.00 0.00 O ATOM 1107 CB PHE T 74 83.658 -8.255 -5.054 1.00 0.00 C ATOM 1108 CG PHE T 74 82.300 -8.263 -5.715 1.00 0.00 C ATOM 1109 CD1 PHE T 74 81.807 -7.098 -6.314 1.00 0.00 C ATOM 1110 CD2 PHE T 74 81.532 -9.435 -5.728 1.00 0.00 C ATOM 1111 CE1 PHE T 74 80.549 -7.104 -6.927 1.00 0.00 C ATOM 1112 CE2 PHE T 74 80.273 -9.440 -6.340 1.00 0.00 C ATOM 1113 CZ PHE T 74 79.781 -8.275 -6.940 1.00 0.00 C ATOM 0 H PHE T 74 85.652 -7.702 -3.719 1.00 0.00 H new ATOM 0 HA PHE T 74 83.111 -6.589 -3.801 1.00 0.00 H new ATOM 0 HB2 PHE T 74 84.376 -7.726 -5.680 1.00 0.00 H new ATOM 0 HB3 PHE T 74 84.025 -9.275 -4.940 1.00 0.00 H new ATOM 0 HD1 PHE T 74 82.398 -6.194 -6.303 1.00 0.00 H new ATOM 0 HD2 PHE T 74 81.911 -10.334 -5.266 1.00 0.00 H new ATOM 0 HE1 PHE T 74 80.170 -6.205 -7.390 1.00 0.00 H new ATOM 0 HE2 PHE T 74 79.681 -10.343 -6.349 1.00 0.00 H new ATOM 0 HZ PHE T 74 78.810 -8.279 -7.413 1.00 0.00 H new ATOM 1123 N ASP T 75 83.248 -8.949 -1.705 1.00 0.00 N ATOM 1124 CA ASP T 75 82.494 -9.767 -0.759 1.00 0.00 C ATOM 1125 C ASP T 75 81.710 -8.890 0.214 1.00 0.00 C ATOM 1126 O ASP T 75 80.582 -8.488 -0.068 1.00 0.00 O ATOM 1127 CB ASP T 75 83.448 -10.671 0.023 1.00 0.00 C ATOM 1128 CG ASP T 75 84.097 -11.682 -0.917 1.00 0.00 C ATOM 1129 OD1 ASP T 75 83.366 -12.403 -1.575 1.00 0.00 O ATOM 1130 OD2 ASP T 75 85.316 -11.719 -0.965 1.00 0.00 O ATOM 0 H ASP T 75 84.236 -8.836 -1.476 1.00 0.00 H new ATOM 0 HA ASP T 75 81.789 -10.378 -1.322 1.00 0.00 H new ATOM 0 HB2 ASP T 75 84.216 -10.069 0.509 1.00 0.00 H new ATOM 0 HB3 ASP T 75 82.904 -11.192 0.811 1.00 0.00 H new ATOM 1135 N GLU T 76 82.314 -8.605 1.363 1.00 0.00 N ATOM 1136 CA GLU T 76 81.663 -7.782 2.378 1.00 0.00 C ATOM 1137 C GLU T 76 81.066 -6.521 1.758 1.00 0.00 C ATOM 1138 O GLU T 76 80.285 -5.816 2.398 1.00 0.00 O ATOM 1139 CB GLU T 76 82.672 -7.398 3.466 1.00 0.00 C ATOM 1140 CG GLU T 76 83.695 -6.407 2.900 1.00 0.00 C ATOM 1141 CD GLU T 76 84.919 -6.344 3.808 1.00 0.00 C ATOM 1142 OE1 GLU T 76 85.720 -7.263 3.755 1.00 0.00 O ATOM 1143 OE2 GLU T 76 85.038 -5.377 4.543 1.00 0.00 O ATOM 0 H GLU T 76 83.248 -8.929 1.615 1.00 0.00 H new ATOM 0 HA GLU T 76 80.855 -8.363 2.822 1.00 0.00 H new ATOM 0 HB2 GLU T 76 82.153 -6.954 4.315 1.00 0.00 H new ATOM 0 HB3 GLU T 76 83.181 -8.289 3.834 1.00 0.00 H new ATOM 0 HG2 GLU T 76 83.992 -6.712 1.896 1.00 0.00 H new ATOM 0 HG3 GLU T 76 83.245 -5.418 2.813 1.00 0.00 H new ATOM 1150 N PHE T 77 81.436 -6.241 0.513 1.00 0.00 N ATOM 1151 CA PHE T 77 80.924 -5.060 -0.174 1.00 0.00 C ATOM 1152 C PHE T 77 79.412 -5.157 -0.351 1.00 0.00 C ATOM 1153 O PHE T 77 78.666 -4.298 0.120 1.00 0.00 O ATOM 1154 CB PHE T 77 81.593 -4.921 -1.544 1.00 0.00 C ATOM 1155 CG PHE T 77 81.002 -3.737 -2.276 1.00 0.00 C ATOM 1156 CD1 PHE T 77 81.278 -2.436 -1.838 1.00 0.00 C ATOM 1157 CD2 PHE T 77 80.180 -3.938 -3.393 1.00 0.00 C ATOM 1158 CE1 PHE T 77 80.734 -1.338 -2.515 1.00 0.00 C ATOM 1159 CE2 PHE T 77 79.635 -2.840 -4.070 1.00 0.00 C ATOM 1160 CZ PHE T 77 79.912 -1.540 -3.631 1.00 0.00 C ATOM 0 H PHE T 77 82.081 -6.808 -0.036 1.00 0.00 H new ATOM 0 HA PHE T 77 81.152 -4.183 0.432 1.00 0.00 H new ATOM 0 HB2 PHE T 77 82.668 -4.788 -1.424 1.00 0.00 H new ATOM 0 HB3 PHE T 77 81.448 -5.831 -2.126 1.00 0.00 H new ATOM 0 HD1 PHE T 77 81.911 -2.279 -0.977 1.00 0.00 H new ATOM 0 HD2 PHE T 77 79.967 -4.941 -3.732 1.00 0.00 H new ATOM 0 HE1 PHE T 77 80.948 -0.335 -2.177 1.00 0.00 H new ATOM 0 HE2 PHE T 77 79.001 -2.996 -4.930 1.00 0.00 H new ATOM 0 HZ PHE T 77 79.492 -0.693 -4.153 1.00 0.00 H new ATOM 1170 N LEU T 78 78.967 -6.208 -1.031 1.00 0.00 N ATOM 1171 CA LEU T 78 77.540 -6.407 -1.263 1.00 0.00 C ATOM 1172 C LEU T 78 76.760 -6.228 0.036 1.00 0.00 C ATOM 1173 O LEU T 78 75.707 -5.591 0.056 1.00 0.00 O ATOM 1174 CB LEU T 78 77.288 -7.810 -1.822 1.00 0.00 C ATOM 1175 CG LEU T 78 78.139 -8.036 -3.079 1.00 0.00 C ATOM 1176 CD1 LEU T 78 78.054 -9.510 -3.485 1.00 0.00 C ATOM 1177 CD2 LEU T 78 77.626 -7.157 -4.232 1.00 0.00 C ATOM 0 H LEU T 78 79.568 -6.930 -1.429 1.00 0.00 H new ATOM 0 HA LEU T 78 77.202 -5.665 -1.986 1.00 0.00 H new ATOM 0 HB2 LEU T 78 77.531 -8.559 -1.069 1.00 0.00 H new ATOM 0 HB3 LEU T 78 76.232 -7.930 -2.062 1.00 0.00 H new ATOM 0 HG LEU T 78 79.174 -7.769 -2.864 1.00 0.00 H new ATOM 0 HD11 LEU T 78 78.657 -9.677 -4.378 1.00 0.00 H new ATOM 0 HD12 LEU T 78 78.428 -10.133 -2.673 1.00 0.00 H new ATOM 0 HD13 LEU T 78 77.016 -9.771 -3.694 1.00 0.00 H new ATOM 0 HD21 LEU T 78 78.238 -7.326 -5.118 1.00 0.00 H new ATOM 0 HD22 LEU T 78 76.590 -7.414 -4.452 1.00 0.00 H new ATOM 0 HD23 LEU T 78 77.687 -6.107 -3.944 1.00 0.00 H new ATOM 1189 N VAL T 79 77.284 -6.794 1.118 1.00 0.00 N ATOM 1190 CA VAL T 79 76.628 -6.689 2.416 1.00 0.00 C ATOM 1191 C VAL T 79 76.307 -5.233 2.737 1.00 0.00 C ATOM 1192 O VAL T 79 75.182 -4.903 3.114 1.00 0.00 O ATOM 1193 CB VAL T 79 77.532 -7.268 3.506 1.00 0.00 C ATOM 1194 CG1 VAL T 79 76.802 -7.231 4.849 1.00 0.00 C ATOM 1195 CG2 VAL T 79 77.886 -8.715 3.158 1.00 0.00 C ATOM 0 H VAL T 79 78.154 -7.326 1.123 1.00 0.00 H new ATOM 0 HA VAL T 79 75.697 -7.254 2.379 1.00 0.00 H new ATOM 0 HB VAL T 79 78.445 -6.676 3.573 1.00 0.00 H new ATOM 0 HG11 VAL T 79 77.447 -7.644 5.625 1.00 0.00 H new ATOM 0 HG12 VAL T 79 76.549 -6.200 5.097 1.00 0.00 H new ATOM 0 HG13 VAL T 79 75.889 -7.823 4.783 1.00 0.00 H new ATOM 0 HG21 VAL T 79 78.530 -9.129 3.934 1.00 0.00 H new ATOM 0 HG22 VAL T 79 76.973 -9.307 3.091 1.00 0.00 H new ATOM 0 HG23 VAL T 79 78.407 -8.742 2.201 1.00 0.00 H new ATOM 1205 N MET T 80 77.302 -4.365 2.583 1.00 0.00 N ATOM 1206 CA MET T 80 77.115 -2.945 2.859 1.00 0.00 C ATOM 1207 C MET T 80 75.826 -2.439 2.215 1.00 0.00 C ATOM 1208 O MET T 80 74.954 -1.897 2.893 1.00 0.00 O ATOM 1209 CB MET T 80 78.306 -2.147 2.318 1.00 0.00 C ATOM 1210 CG MET T 80 78.267 -0.710 2.854 1.00 0.00 C ATOM 1211 SD MET T 80 79.197 0.372 1.740 1.00 0.00 S ATOM 1212 CE MET T 80 80.855 -0.087 2.300 1.00 0.00 C ATOM 0 H MET T 80 78.240 -4.617 2.271 1.00 0.00 H new ATOM 0 HA MET T 80 77.046 -2.809 3.938 1.00 0.00 H new ATOM 0 HB2 MET T 80 79.239 -2.628 2.612 1.00 0.00 H new ATOM 0 HB3 MET T 80 78.282 -2.137 1.228 1.00 0.00 H new ATOM 0 HG2 MET T 80 77.235 -0.368 2.934 1.00 0.00 H new ATOM 0 HG3 MET T 80 78.694 -0.672 3.856 1.00 0.00 H new ATOM 0 HE1 MET T 80 81.595 0.525 1.784 1.00 0.00 H new ATOM 0 HE2 MET T 80 80.934 0.076 3.375 1.00 0.00 H new ATOM 0 HE3 MET T 80 81.036 -1.139 2.079 1.00 0.00 H new ATOM 1222 N MET T 81 75.716 -2.618 0.902 1.00 0.00 N ATOM 1223 CA MET T 81 74.530 -2.172 0.177 1.00 0.00 C ATOM 1224 C MET T 81 73.277 -2.846 0.729 1.00 0.00 C ATOM 1225 O MET T 81 72.347 -2.175 1.177 1.00 0.00 O ATOM 1226 CB MET T 81 74.671 -2.499 -1.312 1.00 0.00 C ATOM 1227 CG MET T 81 75.712 -1.575 -1.948 1.00 0.00 C ATOM 1228 SD MET T 81 77.350 -1.962 -1.281 1.00 0.00 S ATOM 1229 CE MET T 81 78.021 -0.281 -1.305 1.00 0.00 C ATOM 0 H MET T 81 76.427 -3.065 0.322 1.00 0.00 H new ATOM 0 HA MET T 81 74.436 -1.094 0.305 1.00 0.00 H new ATOM 0 HB2 MET T 81 74.969 -3.540 -1.439 1.00 0.00 H new ATOM 0 HB3 MET T 81 73.710 -2.379 -1.813 1.00 0.00 H new ATOM 0 HG2 MET T 81 75.710 -1.698 -3.031 1.00 0.00 H new ATOM 0 HG3 MET T 81 75.462 -0.534 -1.745 1.00 0.00 H new ATOM 0 HE1 MET T 81 79.043 -0.292 -0.926 1.00 0.00 H new ATOM 0 HE2 MET T 81 78.017 0.098 -2.327 1.00 0.00 H new ATOM 0 HE3 MET T 81 77.408 0.365 -0.676 1.00 0.00 H new ATOM 1239 N VAL T 82 73.257 -4.175 0.689 1.00 0.00 N ATOM 1240 CA VAL T 82 72.109 -4.930 1.183 1.00 0.00 C ATOM 1241 C VAL T 82 71.615 -4.361 2.511 1.00 0.00 C ATOM 1242 O VAL T 82 70.410 -4.246 2.737 1.00 0.00 O ATOM 1243 CB VAL T 82 72.491 -6.399 1.368 1.00 0.00 C ATOM 1244 CG1 VAL T 82 71.303 -7.168 1.948 1.00 0.00 C ATOM 1245 CG2 VAL T 82 72.872 -6.999 0.012 1.00 0.00 C ATOM 0 H VAL T 82 74.017 -4.749 0.322 1.00 0.00 H new ATOM 0 HA VAL T 82 71.307 -4.850 0.449 1.00 0.00 H new ATOM 0 HB VAL T 82 73.337 -6.471 2.051 1.00 0.00 H new ATOM 0 HG11 VAL T 82 71.576 -8.215 2.079 1.00 0.00 H new ATOM 0 HG12 VAL T 82 71.029 -6.741 2.913 1.00 0.00 H new ATOM 0 HG13 VAL T 82 70.456 -7.097 1.266 1.00 0.00 H new ATOM 0 HG21 VAL T 82 73.145 -8.046 0.141 1.00 0.00 H new ATOM 0 HG22 VAL T 82 72.024 -6.926 -0.669 1.00 0.00 H new ATOM 0 HG23 VAL T 82 73.719 -6.452 -0.403 1.00 0.00 H new ATOM 1255 N ARG T 83 72.551 -4.006 3.384 1.00 0.00 N ATOM 1256 CA ARG T 83 72.196 -3.451 4.685 1.00 0.00 C ATOM 1257 C ARG T 83 71.495 -2.105 4.520 1.00 0.00 C ATOM 1258 O ARG T 83 70.288 -1.993 4.734 1.00 0.00 O ATOM 1259 CB ARG T 83 73.453 -3.272 5.539 1.00 0.00 C ATOM 1260 CG ARG T 83 73.952 -4.641 6.008 1.00 0.00 C ATOM 1261 CD ARG T 83 75.303 -4.480 6.708 1.00 0.00 C ATOM 1262 NE ARG T 83 75.193 -3.523 7.803 1.00 0.00 N ATOM 1263 CZ ARG T 83 76.269 -2.925 8.304 1.00 0.00 C ATOM 1264 NH1 ARG T 83 77.450 -3.188 7.813 1.00 0.00 N ATOM 1265 NH2 ARG T 83 76.146 -2.073 9.285 1.00 0.00 N ATOM 0 H ARG T 83 73.554 -4.092 3.217 1.00 0.00 H new ATOM 0 HA ARG T 83 71.517 -4.144 5.181 1.00 0.00 H new ATOM 0 HB2 ARG T 83 74.229 -2.769 4.962 1.00 0.00 H new ATOM 0 HB3 ARG T 83 73.234 -2.639 6.399 1.00 0.00 H new ATOM 0 HG2 ARG T 83 73.229 -5.090 6.689 1.00 0.00 H new ATOM 0 HG3 ARG T 83 74.049 -5.315 5.157 1.00 0.00 H new ATOM 0 HD2 ARG T 83 75.640 -5.444 7.090 1.00 0.00 H new ATOM 0 HD3 ARG T 83 76.053 -4.141 5.993 1.00 0.00 H new ATOM 0 HE ARG T 83 74.274 -3.309 8.191 1.00 0.00 H new ATOM 0 HH11 ARG T 83 77.547 -3.852 7.045 1.00 0.00 H new ATOM 0 HH12 ARG T 83 78.276 -2.729 8.197 1.00 0.00 H new ATOM 0 HH21 ARG T 83 75.224 -1.866 9.668 1.00 0.00 H new ATOM 0 HH22 ARG T 83 76.972 -1.615 9.669 1.00 0.00 H new ATOM 1279 N SER T 84 72.261 -1.088 4.139 1.00 0.00 N ATOM 1280 CA SER T 84 71.704 0.246 3.949 1.00 0.00 C ATOM 1281 C SER T 84 70.408 0.179 3.147 1.00 0.00 C ATOM 1282 O SER T 84 69.489 0.968 3.368 1.00 0.00 O ATOM 1283 CB SER T 84 72.712 1.133 3.218 1.00 0.00 C ATOM 1284 OG SER T 84 73.939 1.139 3.936 1.00 0.00 O ATOM 0 H SER T 84 73.262 -1.161 3.957 1.00 0.00 H new ATOM 0 HA SER T 84 71.489 0.671 4.929 1.00 0.00 H new ATOM 0 HB2 SER T 84 72.872 0.763 2.205 1.00 0.00 H new ATOM 0 HB3 SER T 84 72.324 2.148 3.130 1.00 0.00 H new ATOM 0 HG SER T 84 74.588 1.705 3.469 1.00 0.00 H new ATOM 1290 N MET T 85 70.341 -0.766 2.216 1.00 0.00 N ATOM 1291 CA MET T 85 69.152 -0.925 1.387 1.00 0.00 C ATOM 1292 C MET T 85 67.976 -1.420 2.223 1.00 0.00 C ATOM 1293 O MET T 85 67.055 -0.662 2.527 1.00 0.00 O ATOM 1294 CB MET T 85 69.432 -1.919 0.257 1.00 0.00 C ATOM 1295 CG MET T 85 70.349 -1.269 -0.782 1.00 0.00 C ATOM 1296 SD MET T 85 69.401 -0.086 -1.769 1.00 0.00 S ATOM 1297 CE MET T 85 70.743 0.413 -2.876 1.00 0.00 C ATOM 0 H MET T 85 71.090 -1.429 2.017 1.00 0.00 H new ATOM 0 HA MET T 85 68.897 0.046 0.962 1.00 0.00 H new ATOM 0 HB2 MET T 85 69.899 -2.818 0.658 1.00 0.00 H new ATOM 0 HB3 MET T 85 68.497 -2.227 -0.210 1.00 0.00 H new ATOM 0 HG2 MET T 85 71.177 -0.763 -0.286 1.00 0.00 H new ATOM 0 HG3 MET T 85 70.783 -2.032 -1.428 1.00 0.00 H new ATOM 0 HE1 MET T 85 70.374 1.155 -3.584 1.00 0.00 H new ATOM 0 HE2 MET T 85 71.556 0.843 -2.291 1.00 0.00 H new ATOM 0 HE3 MET T 85 71.108 -0.458 -3.420 1.00 0.00 H new ATOM 1307 N LYS T 86 68.014 -2.697 2.591 1.00 0.00 N ATOM 1308 CA LYS T 86 66.945 -3.283 3.392 1.00 0.00 C ATOM 1309 C LYS T 86 66.696 -2.453 4.647 1.00 0.00 C ATOM 1310 O LYS T 86 65.630 -2.537 5.257 1.00 0.00 O ATOM 1311 CB LYS T 86 67.314 -4.713 3.789 1.00 0.00 C ATOM 1312 CG LYS T 86 66.082 -5.419 4.359 1.00 0.00 C ATOM 1313 CD LYS T 86 66.420 -6.882 4.651 1.00 0.00 C ATOM 1314 CE LYS T 86 65.154 -7.624 5.080 1.00 0.00 C ATOM 1315 NZ LYS T 86 64.450 -6.838 6.132 1.00 0.00 N ATOM 0 H LYS T 86 68.767 -3.341 2.350 1.00 0.00 H new ATOM 0 HA LYS T 86 66.034 -3.295 2.793 1.00 0.00 H new ATOM 0 HB2 LYS T 86 67.689 -5.257 2.922 1.00 0.00 H new ATOM 0 HB3 LYS T 86 68.114 -4.701 4.529 1.00 0.00 H new ATOM 0 HG2 LYS T 86 65.755 -4.921 5.272 1.00 0.00 H new ATOM 0 HG3 LYS T 86 65.256 -5.360 3.650 1.00 0.00 H new ATOM 0 HD2 LYS T 86 66.846 -7.351 3.764 1.00 0.00 H new ATOM 0 HD3 LYS T 86 67.173 -6.942 5.437 1.00 0.00 H new ATOM 0 HE2 LYS T 86 64.498 -7.773 4.222 1.00 0.00 H new ATOM 0 HE3 LYS T 86 65.410 -8.613 5.460 1.00 0.00 H new ATOM 0 HZ1 LYS T 86 63.896 -7.481 6.734 1.00 0.00 H new ATOM 0 HZ2 LYS T 86 65.149 -6.334 6.715 1.00 0.00 H new ATOM 0 HZ3 LYS T 86 63.813 -6.150 5.683 1.00 0.00 H new ATOM 1329 N ASP T 87 67.686 -1.651 5.028 1.00 0.00 N ATOM 1330 CA ASP T 87 67.561 -0.810 6.213 1.00 0.00 C ATOM 1331 C ASP T 87 68.573 0.331 6.171 1.00 0.00 C ATOM 1332 O ASP T 87 69.761 0.130 6.422 1.00 0.00 O ATOM 1333 CB ASP T 87 67.787 -1.648 7.473 1.00 0.00 C ATOM 1334 CG ASP T 87 66.607 -2.588 7.693 1.00 0.00 C ATOM 1335 OD1 ASP T 87 65.573 -2.115 8.136 1.00 0.00 O ATOM 1336 OD2 ASP T 87 66.754 -3.767 7.416 1.00 0.00 O ATOM 0 H ASP T 87 68.576 -1.566 4.538 1.00 0.00 H new ATOM 0 HA ASP T 87 66.556 -0.388 6.231 1.00 0.00 H new ATOM 0 HB2 ASP T 87 68.708 -2.223 7.377 1.00 0.00 H new ATOM 0 HB3 ASP T 87 67.908 -0.995 8.337 1.00 0.00 H new ATOM 1341 N ASP T 88 68.093 1.528 5.852 1.00 0.00 N ATOM 1342 CA ASP T 88 68.964 2.696 5.780 1.00 0.00 C ATOM 1343 C ASP T 88 69.259 3.230 7.179 1.00 0.00 C ATOM 1344 O ASP T 88 68.432 3.119 8.083 1.00 0.00 O ATOM 1345 CB ASP T 88 68.300 3.792 4.944 1.00 0.00 C ATOM 1346 CG ASP T 88 66.984 4.215 5.590 1.00 0.00 C ATOM 1347 OD1 ASP T 88 66.072 3.405 5.613 1.00 0.00 O ATOM 1348 OD2 ASP T 88 66.909 5.342 6.051 1.00 0.00 O ATOM 0 H ASP T 88 67.113 1.715 5.640 1.00 0.00 H new ATOM 0 HA ASP T 88 69.902 2.399 5.310 1.00 0.00 H new ATOM 0 HB2 ASP T 88 68.966 4.651 4.860 1.00 0.00 H new ATOM 0 HB3 ASP T 88 68.118 3.429 3.932 1.00 0.00 H new ATOM 1353 N SER T 89 70.444 3.808 7.348 1.00 0.00 N ATOM 1354 CA SER T 89 70.837 4.355 8.641 1.00 0.00 C ATOM 1355 C SER T 89 72.082 5.225 8.499 1.00 0.00 C ATOM 1356 O SER T 89 72.528 5.408 7.379 1.00 0.00 O ATOM 1357 CB SER T 89 71.116 3.219 9.625 1.00 0.00 C ATOM 1358 OG SER T 89 72.313 2.552 9.246 1.00 0.00 O ATOM 1359 OXT SER T 89 72.570 5.696 9.513 1.00 0.00 O ATOM 0 H SER T 89 71.143 3.909 6.612 1.00 0.00 H new ATOM 0 HA SER T 89 70.019 4.970 9.018 1.00 0.00 H new ATOM 0 HB2 SER T 89 71.211 3.614 10.637 1.00 0.00 H new ATOM 0 HB3 SER T 89 70.282 2.517 9.634 1.00 0.00 H new ATOM 0 HG SER T 89 72.495 1.824 9.876 1.00 0.00 H new TER 1365 SER T 89 HETATM 1366 CA CA T 90 87.635 -6.027 5.344 1.00 0.00 CA HETATM 1367 S1 WW7 T 91 80.512 3.546 -4.684 1.00 0.00 S HETATM 1368 O1 WW7 T 91 81.122 3.144 -5.908 1.00 0.00 O HETATM 1369 O2 WW7 T 91 80.001 4.894 -4.624 1.00 0.00 O HETATM 1370 N1 WW7 T 91 79.172 2.468 -4.424 1.00 0.00 N HETATM 1371 C4 WW7 T 91 83.531 3.074 -1.090 1.00 0.00 C HETATM 1372 C3 WW7 T 91 82.707 4.262 -1.239 1.00 0.00 C HETATM 1373 C2 WW7 T 91 81.780 4.397 -2.363 1.00 0.00 C HETATM 1374 C1 WW7 T 91 81.658 3.338 -3.357 1.00 0.00 C HETATM 1375 C9 WW7 T 91 82.473 2.137 -3.240 1.00 0.00 C HETATM 1376 C10 WW7 T 91 83.433 2.003 -2.075 1.00 0.00 C HETATM 1377 CL1 WW7 T 91 85.340 0.544 -0.648 1.00 0.00 CL HETATM 1378 C5 WW7 T 91 84.236 0.793 -1.953 1.00 0.00 C HETATM 1379 C6 WW7 T 91 84.116 -0.270 -2.940 1.00 0.00 C HETATM 1380 C7 WW7 T 91 83.188 -0.134 -4.065 1.00 0.00 C HETATM 1381 C8 WW7 T 91 82.369 1.060 -4.218 1.00 0.00 C HETATM 1382 C11 WW7 T 91 77.886 3.073 -4.085 1.00 0.00 C HETATM 1383 C12 WW7 T 91 77.457 2.847 -2.636 1.00 0.00 C HETATM 1384 C14 WW7 T 91 79.217 2.836 -0.856 1.00 0.00 C HETATM 1385 C13 WW7 T 91 78.296 3.717 -1.700 1.00 0.00 C HETATM 1386 C15 WW7 T 91 79.249 3.353 0.586 1.00 0.00 C HETATM 1387 C16 WW7 T 91 80.650 3.166 1.177 1.00 0.00 C HETATM 1388 N2 WW7 T 91 81.266 4.421 1.576 1.00 0.00 N HETATM 0 HN22 WW7 T 91 82.201 4.423 1.984 1.00 0.00 H new HETATM 0 HN21 WW7 T 91 80.763 5.299 1.448 1.00 0.00 H new HETATM 0 H162 WW7 T 91 80.589 2.505 2.042 1.00 0.00 H new HETATM 0 H161 WW7 T 91 81.286 2.672 0.443 1.00 0.00 H new HETATM 0 H152 WW7 T 91 78.973 4.407 0.610 1.00 0.00 H new HETATM 0 H151 WW7 T 91 78.516 2.818 1.190 1.00 0.00 H new HETATM 0 H142 WW7 T 91 78.866 1.804 -0.875 1.00 0.00 H new HETATM 0 H141 WW7 T 91 80.223 2.838 -1.276 1.00 0.00 H new HETATM 0 H132 WW7 T 91 78.887 4.425 -2.280 1.00 0.00 H new HETATM 0 H131 WW7 T 91 77.644 4.302 -1.052 1.00 0.00 H new HETATM 0 H122 WW7 T 91 76.400 3.087 -2.519 1.00 0.00 H new HETATM 0 H121 WW7 T 91 77.576 1.796 -2.373 1.00 0.00 H new HETATM 0 H112 WW7 T 91 77.939 4.145 -4.275 1.00 0.00 H new HETATM 0 H111 WW7 T 91 77.120 2.669 -4.747 1.00 0.00 H new HETATM 0 HN1 WW7 T 91 79.279 1.457 -4.505 1.00 0.00 H new HETATM 0 H8 WW7 T 91 81.682 1.149 -5.059 1.00 0.00 H new HETATM 0 H7 WW7 T 91 83.109 -0.937 -4.797 1.00 0.00 H new HETATM 0 H6 WW7 T 91 84.720 -1.172 -2.841 1.00 0.00 H new HETATM 0 H4 WW7 T 91 84.217 2.984 -0.248 1.00 0.00 H new HETATM 0 H3 WW7 T 91 82.781 5.063 -0.504 1.00 0.00 H new HETATM 0 H2 WW7 T 91 81.175 5.298 -2.458 1.00 0.00 H new