USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 864 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0132 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= -0.187 X(o=-0.19,f=-0.0077) USER MOD Single : A 16 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.744 K(o=-0.74,f=-2.3) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -76:sc= 1.03 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 32:sc= 0.617 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 7:sc= 1.22 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -146:sc= -0.459 (180deg=-2.01!) USER MOD Single : A 61 HIS : no HD1:sc= -4.59! C(o=-4.6!,f=-6.6!) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.684 K(o=-0.68,f=-6.8!) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.0042) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 GLN : amide:sc= -1.16 K(o=-1.2,f=-4.4!) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 165:sc= -0.269 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ -127:sc= -0.429 (180deg=-1.48) USER MOD Single : A 101 HIS :FLIP no HE2:sc= -1.22 F(o=-1.9!,f=-1.2) USER MOD Single : A 102 LYS NZ :NH3+ 159:sc= -0.0225 (180deg=-0.214) USER MOD Single : A 103 MET CE :methyl 172:sc= -3.47! (180deg=-4.23!) USER MOD Single : A 105 GLN : amide:sc= -0.0268 K(o=-0.027,f=-0.62) USER MOD Single : A 110 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.108) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot -48:sc= 0.866 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 26.502 -11.496 4.443 1.00 0.00 N ATOM 2 CA GLY A 1 26.480 -10.348 3.555 1.00 0.00 C ATOM 3 C GLY A 1 25.379 -10.438 2.517 1.00 0.00 C ATOM 4 O GLY A 1 25.259 -11.443 1.816 1.00 0.00 O ATOM 0 H1 GLY A 1 27.272 -11.386 5.133 1.00 0.00 H new ATOM 0 H2 GLY A 1 25.594 -11.564 4.945 1.00 0.00 H new ATOM 0 H3 GLY A 1 26.656 -12.362 3.888 1.00 0.00 H new ATOM 0 HA2 GLY A 1 26.347 -9.440 4.143 1.00 0.00 H new ATOM 0 HA3 GLY A 1 27.443 -10.263 3.052 1.00 0.00 H new ATOM 8 N SER A 2 24.573 -9.386 2.419 1.00 0.00 N ATOM 9 CA SER A 2 23.473 -9.353 1.462 1.00 0.00 C ATOM 10 C SER A 2 23.646 -8.203 0.474 1.00 0.00 C ATOM 11 O SER A 2 24.596 -7.426 0.570 1.00 0.00 O ATOM 12 CB SER A 2 22.137 -9.214 2.195 1.00 0.00 C ATOM 13 OG SER A 2 21.052 -9.546 1.345 1.00 0.00 O ATOM 0 H SER A 2 24.661 -8.545 2.990 1.00 0.00 H new ATOM 0 HA SER A 2 23.479 -10.290 0.906 1.00 0.00 H new ATOM 0 HB2 SER A 2 22.129 -9.864 3.070 1.00 0.00 H new ATOM 0 HB3 SER A 2 22.021 -8.192 2.556 1.00 0.00 H new ATOM 0 HG SER A 2 20.210 -9.451 1.837 1.00 0.00 H new ATOM 19 N SER A 3 22.721 -8.103 -0.475 1.00 0.00 N ATOM 20 CA SER A 3 22.773 -7.051 -1.484 1.00 0.00 C ATOM 21 C SER A 3 21.466 -6.265 -1.516 1.00 0.00 C ATOM 22 O SER A 3 20.415 -6.769 -1.122 1.00 0.00 O ATOM 23 CB SER A 3 23.054 -7.652 -2.863 1.00 0.00 C ATOM 24 OG SER A 3 23.300 -6.636 -3.820 1.00 0.00 O ATOM 0 H SER A 3 21.927 -8.737 -0.567 1.00 0.00 H new ATOM 0 HA SER A 3 23.581 -6.368 -1.221 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.915 -8.318 -2.805 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.204 -8.257 -3.180 1.00 0.00 H new ATOM 0 HG SER A 3 23.479 -7.045 -4.693 1.00 0.00 H new ATOM 30 N GLY A 4 21.540 -5.024 -1.988 1.00 0.00 N ATOM 31 CA GLY A 4 20.358 -4.186 -2.063 1.00 0.00 C ATOM 32 C GLY A 4 20.545 -2.855 -1.364 1.00 0.00 C ATOM 33 O GLY A 4 20.196 -1.806 -1.907 1.00 0.00 O ATOM 0 H GLY A 4 22.398 -4.584 -2.320 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.106 -4.011 -3.109 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.515 -4.712 -1.616 1.00 0.00 H new ATOM 37 N SER A 5 21.096 -2.895 -0.155 1.00 0.00 N ATOM 38 CA SER A 5 21.324 -1.682 0.622 1.00 0.00 C ATOM 39 C SER A 5 22.628 -1.008 0.206 1.00 0.00 C ATOM 40 O SER A 5 22.658 0.192 -0.070 1.00 0.00 O ATOM 41 CB SER A 5 21.359 -2.008 2.116 1.00 0.00 C ATOM 42 OG SER A 5 20.194 -2.709 2.513 1.00 0.00 O ATOM 0 H SER A 5 21.393 -3.754 0.308 1.00 0.00 H new ATOM 0 HA SER A 5 20.501 -0.994 0.427 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.242 -2.607 2.340 1.00 0.00 H new ATOM 0 HB3 SER A 5 21.446 -1.086 2.691 1.00 0.00 H new ATOM 0 HG SER A 5 20.242 -2.907 3.472 1.00 0.00 H new ATOM 48 N SER A 6 23.703 -1.787 0.164 1.00 0.00 N ATOM 49 CA SER A 6 25.011 -1.266 -0.215 1.00 0.00 C ATOM 50 C SER A 6 24.889 -0.284 -1.376 1.00 0.00 C ATOM 51 O SER A 6 23.949 -0.353 -2.165 1.00 0.00 O ATOM 52 CB SER A 6 25.950 -2.412 -0.597 1.00 0.00 C ATOM 53 OG SER A 6 25.705 -2.851 -1.922 1.00 0.00 O ATOM 0 H SER A 6 23.694 -2.782 0.388 1.00 0.00 H new ATOM 0 HA SER A 6 25.426 -0.737 0.643 1.00 0.00 H new ATOM 0 HB2 SER A 6 26.985 -2.084 -0.505 1.00 0.00 H new ATOM 0 HB3 SER A 6 25.816 -3.243 0.096 1.00 0.00 H new ATOM 0 HG SER A 6 26.319 -3.582 -2.143 1.00 0.00 H new ATOM 59 N GLY A 7 25.850 0.631 -1.473 1.00 0.00 N ATOM 60 CA GLY A 7 25.832 1.614 -2.539 1.00 0.00 C ATOM 61 C GLY A 7 25.158 2.907 -2.125 1.00 0.00 C ATOM 62 O GLY A 7 23.949 2.939 -1.897 1.00 0.00 O ATOM 0 H GLY A 7 26.640 0.708 -0.832 1.00 0.00 H new ATOM 0 HA2 GLY A 7 26.855 1.825 -2.852 1.00 0.00 H new ATOM 0 HA3 GLY A 7 25.314 1.198 -3.403 1.00 0.00 H new ATOM 66 N ARG A 8 25.941 3.976 -2.026 1.00 0.00 N ATOM 67 CA ARG A 8 25.413 5.277 -1.634 1.00 0.00 C ATOM 68 C ARG A 8 25.040 6.105 -2.860 1.00 0.00 C ATOM 69 O ARG A 8 25.466 5.807 -3.977 1.00 0.00 O ATOM 70 CB ARG A 8 26.439 6.033 -0.787 1.00 0.00 C ATOM 71 CG ARG A 8 27.600 6.593 -1.593 1.00 0.00 C ATOM 72 CD ARG A 8 28.660 7.204 -0.691 1.00 0.00 C ATOM 73 NE ARG A 8 28.244 8.497 -0.154 1.00 0.00 N ATOM 74 CZ ARG A 8 27.489 8.633 0.930 1.00 0.00 C ATOM 75 NH1 ARG A 8 27.072 7.562 1.591 1.00 0.00 N ATOM 76 NH2 ARG A 8 27.152 9.844 1.357 1.00 0.00 N ATOM 0 H ARG A 8 26.944 3.967 -2.212 1.00 0.00 H new ATOM 0 HA ARG A 8 24.513 5.112 -1.041 1.00 0.00 H new ATOM 0 HB2 ARG A 8 25.938 6.852 -0.270 1.00 0.00 H new ATOM 0 HB3 ARG A 8 26.829 5.363 -0.021 1.00 0.00 H new ATOM 0 HG2 ARG A 8 28.045 5.799 -2.193 1.00 0.00 H new ATOM 0 HG3 ARG A 8 27.232 7.348 -2.287 1.00 0.00 H new ATOM 0 HD2 ARG A 8 28.873 6.521 0.132 1.00 0.00 H new ATOM 0 HD3 ARG A 8 29.587 7.326 -1.252 1.00 0.00 H new ATOM 0 HE ARG A 8 28.550 9.341 -0.638 1.00 0.00 H new ATOM 0 HH11 ARG A 8 27.331 6.630 1.267 1.00 0.00 H new ATOM 0 HH12 ARG A 8 26.492 7.670 2.423 1.00 0.00 H new ATOM 0 HH21 ARG A 8 27.473 10.670 0.852 1.00 0.00 H new ATOM 0 HH22 ARG A 8 26.572 9.948 2.190 1.00 0.00 H new ATOM 90 N LEU A 9 24.241 7.144 -2.645 1.00 0.00 N ATOM 91 CA LEU A 9 23.810 8.016 -3.732 1.00 0.00 C ATOM 92 C LEU A 9 23.706 9.463 -3.262 1.00 0.00 C ATOM 93 O LEU A 9 22.959 9.773 -2.332 1.00 0.00 O ATOM 94 CB LEU A 9 22.461 7.548 -4.282 1.00 0.00 C ATOM 95 CG LEU A 9 22.423 6.129 -4.851 1.00 0.00 C ATOM 96 CD1 LEU A 9 22.219 5.113 -3.738 1.00 0.00 C ATOM 97 CD2 LEU A 9 21.327 6.004 -5.899 1.00 0.00 C ATOM 0 H LEU A 9 23.878 7.403 -1.728 1.00 0.00 H new ATOM 0 HA LEU A 9 24.557 7.964 -4.524 1.00 0.00 H new ATOM 0 HB2 LEU A 9 21.722 7.618 -3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 9 22.151 8.240 -5.065 1.00 0.00 H new ATOM 0 HG LEU A 9 23.380 5.924 -5.330 1.00 0.00 H new ATOM 0 HD11 LEU A 9 22.195 4.109 -4.162 1.00 0.00 H new ATOM 0 HD12 LEU A 9 23.040 5.186 -3.024 1.00 0.00 H new ATOM 0 HD13 LEU A 9 21.276 5.315 -3.229 1.00 0.00 H new ATOM 0 HD21 LEU A 9 21.315 4.988 -6.293 1.00 0.00 H new ATOM 0 HD22 LEU A 9 20.362 6.229 -5.445 1.00 0.00 H new ATOM 0 HD23 LEU A 9 21.518 6.706 -6.711 1.00 0.00 H new ATOM 109 N LEU A 10 24.457 10.346 -3.910 1.00 0.00 N ATOM 110 CA LEU A 10 24.448 11.762 -3.560 1.00 0.00 C ATOM 111 C LEU A 10 23.319 12.493 -4.279 1.00 0.00 C ATOM 112 O LEU A 10 23.471 13.647 -4.681 1.00 0.00 O ATOM 113 CB LEU A 10 25.792 12.403 -3.912 1.00 0.00 C ATOM 114 CG LEU A 10 26.856 12.377 -2.814 1.00 0.00 C ATOM 115 CD1 LEU A 10 26.374 13.135 -1.587 1.00 0.00 C ATOM 116 CD2 LEU A 10 27.213 10.943 -2.451 1.00 0.00 C ATOM 0 H LEU A 10 25.080 10.106 -4.681 1.00 0.00 H new ATOM 0 HA LEU A 10 24.283 11.845 -2.486 1.00 0.00 H new ATOM 0 HB2 LEU A 10 26.193 11.899 -4.791 1.00 0.00 H new ATOM 0 HB3 LEU A 10 25.614 13.441 -4.193 1.00 0.00 H new ATOM 0 HG LEU A 10 27.753 12.869 -3.191 1.00 0.00 H new ATOM 0 HD11 LEU A 10 27.144 13.106 -0.816 1.00 0.00 H new ATOM 0 HD12 LEU A 10 26.169 14.171 -1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 10 25.463 12.672 -1.208 1.00 0.00 H new ATOM 0 HD21 LEU A 10 27.972 10.944 -1.668 1.00 0.00 H new ATOM 0 HD22 LEU A 10 26.323 10.426 -2.093 1.00 0.00 H new ATOM 0 HD23 LEU A 10 27.601 10.431 -3.331 1.00 0.00 H new ATOM 128 N ASP A 11 22.188 11.815 -4.436 1.00 0.00 N ATOM 129 CA ASP A 11 21.031 12.402 -5.103 1.00 0.00 C ATOM 130 C ASP A 11 19.835 11.457 -5.048 1.00 0.00 C ATOM 131 O ASP A 11 19.846 10.387 -5.657 1.00 0.00 O ATOM 132 CB ASP A 11 21.369 12.732 -6.558 1.00 0.00 C ATOM 133 CG ASP A 11 22.437 11.819 -7.127 1.00 0.00 C ATOM 134 OD1 ASP A 11 22.142 10.626 -7.349 1.00 0.00 O ATOM 135 OD2 ASP A 11 23.569 12.298 -7.350 1.00 0.00 O ATOM 0 H ASP A 11 22.047 10.859 -4.111 1.00 0.00 H new ATOM 0 HA ASP A 11 20.769 13.322 -4.581 1.00 0.00 H new ATOM 0 HB2 ASP A 11 20.467 12.652 -7.164 1.00 0.00 H new ATOM 0 HB3 ASP A 11 21.707 13.766 -6.624 1.00 0.00 H new ATOM 140 N LEU A 12 18.804 11.859 -4.312 1.00 0.00 N ATOM 141 CA LEU A 12 17.599 11.048 -4.175 1.00 0.00 C ATOM 142 C LEU A 12 16.667 11.253 -5.365 1.00 0.00 C ATOM 143 O LEU A 12 15.447 11.292 -5.209 1.00 0.00 O ATOM 144 CB LEU A 12 16.871 11.396 -2.876 1.00 0.00 C ATOM 145 CG LEU A 12 16.919 12.865 -2.453 1.00 0.00 C ATOM 146 CD1 LEU A 12 16.686 13.773 -3.650 1.00 0.00 C ATOM 147 CD2 LEU A 12 15.891 13.140 -1.365 1.00 0.00 C ATOM 0 H LEU A 12 18.779 12.741 -3.801 1.00 0.00 H new ATOM 0 HA LEU A 12 17.897 10.000 -4.147 1.00 0.00 H new ATOM 0 HB2 LEU A 12 15.826 11.102 -2.978 1.00 0.00 H new ATOM 0 HB3 LEU A 12 17.295 10.793 -2.073 1.00 0.00 H new ATOM 0 HG LEU A 12 17.910 13.075 -2.051 1.00 0.00 H new ATOM 0 HD11 LEU A 12 16.724 14.814 -3.330 1.00 0.00 H new ATOM 0 HD12 LEU A 12 17.459 13.595 -4.398 1.00 0.00 H new ATOM 0 HD13 LEU A 12 15.708 13.562 -4.082 1.00 0.00 H new ATOM 0 HD21 LEU A 12 15.939 14.190 -1.076 1.00 0.00 H new ATOM 0 HD22 LEU A 12 14.894 12.912 -1.741 1.00 0.00 H new ATOM 0 HD23 LEU A 12 16.103 12.515 -0.498 1.00 0.00 H new ATOM 159 N GLU A 13 17.250 11.382 -6.552 1.00 0.00 N ATOM 160 CA GLU A 13 16.471 11.581 -7.768 1.00 0.00 C ATOM 161 C GLU A 13 16.343 10.278 -8.553 1.00 0.00 C ATOM 162 O GLU A 13 16.537 10.252 -9.767 1.00 0.00 O ATOM 163 CB GLU A 13 17.117 12.656 -8.645 1.00 0.00 C ATOM 164 CG GLU A 13 16.690 14.070 -8.289 1.00 0.00 C ATOM 165 CD GLU A 13 17.152 15.093 -9.308 1.00 0.00 C ATOM 166 OE1 GLU A 13 18.333 15.496 -9.249 1.00 0.00 O ATOM 167 OE2 GLU A 13 16.334 15.491 -10.163 1.00 0.00 O ATOM 0 H GLU A 13 18.259 11.352 -6.698 1.00 0.00 H new ATOM 0 HA GLU A 13 15.473 11.910 -7.478 1.00 0.00 H new ATOM 0 HB2 GLU A 13 18.201 12.580 -8.559 1.00 0.00 H new ATOM 0 HB3 GLU A 13 16.866 12.461 -9.688 1.00 0.00 H new ATOM 0 HG2 GLU A 13 15.604 14.108 -8.208 1.00 0.00 H new ATOM 0 HG3 GLU A 13 17.092 14.331 -7.310 1.00 0.00 H new ATOM 174 N ASN A 14 16.016 9.200 -7.848 1.00 0.00 N ATOM 175 CA ASN A 14 15.864 7.893 -8.478 1.00 0.00 C ATOM 176 C ASN A 14 14.445 7.363 -8.293 1.00 0.00 C ATOM 177 O ASN A 14 13.758 7.049 -9.266 1.00 0.00 O ATOM 178 CB ASN A 14 16.871 6.901 -7.892 1.00 0.00 C ATOM 179 CG ASN A 14 17.202 5.777 -8.855 1.00 0.00 C ATOM 180 OD1 ASN A 14 17.018 4.602 -8.541 1.00 0.00 O ATOM 181 ND2 ASN A 14 17.694 6.135 -10.036 1.00 0.00 N ATOM 0 H ASN A 14 15.851 9.205 -6.841 1.00 0.00 H new ATOM 0 HA ASN A 14 16.055 8.007 -9.545 1.00 0.00 H new ATOM 0 HB2 ASN A 14 17.786 7.430 -7.627 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.468 6.480 -6.971 1.00 0.00 H new ATOM 0 HD21 ASN A 14 17.936 5.423 -10.725 1.00 0.00 H new ATOM 0 HD22 ASN A 14 17.830 7.122 -10.254 1.00 0.00 H new ATOM 188 N ILE A 15 14.014 7.266 -7.040 1.00 0.00 N ATOM 189 CA ILE A 15 12.677 6.775 -6.729 1.00 0.00 C ATOM 190 C ILE A 15 11.664 7.914 -6.711 1.00 0.00 C ATOM 191 O ILE A 15 11.946 9.000 -6.205 1.00 0.00 O ATOM 192 CB ILE A 15 12.645 6.053 -5.369 1.00 0.00 C ATOM 193 CG1 ILE A 15 13.671 4.918 -5.345 1.00 0.00 C ATOM 194 CG2 ILE A 15 11.249 5.519 -5.085 1.00 0.00 C ATOM 195 CD1 ILE A 15 13.407 3.844 -6.377 1.00 0.00 C ATOM 0 H ILE A 15 14.571 7.521 -6.224 1.00 0.00 H new ATOM 0 HA ILE A 15 12.410 6.067 -7.514 1.00 0.00 H new ATOM 0 HB ILE A 15 12.904 6.768 -4.589 1.00 0.00 H new ATOM 0 HG12 ILE A 15 14.665 5.334 -5.511 1.00 0.00 H new ATOM 0 HG13 ILE A 15 13.677 4.465 -4.354 1.00 0.00 H new ATOM 0 HG21 ILE A 15 11.243 5.011 -4.120 1.00 0.00 H new ATOM 0 HG22 ILE A 15 10.540 6.347 -5.064 1.00 0.00 H new ATOM 0 HG23 ILE A 15 10.962 4.816 -5.867 1.00 0.00 H new ATOM 0 HD11 ILE A 15 14.173 3.072 -6.303 1.00 0.00 H new ATOM 0 HD12 ILE A 15 12.427 3.401 -6.199 1.00 0.00 H new ATOM 0 HD13 ILE A 15 13.431 4.284 -7.374 1.00 0.00 H new ATOM 207 N GLN A 16 10.483 7.658 -7.265 1.00 0.00 N ATOM 208 CA GLN A 16 9.427 8.662 -7.312 1.00 0.00 C ATOM 209 C GLN A 16 8.480 8.511 -6.127 1.00 0.00 C ATOM 210 O GLN A 16 7.271 8.706 -6.258 1.00 0.00 O ATOM 211 CB GLN A 16 8.646 8.551 -8.622 1.00 0.00 C ATOM 212 CG GLN A 16 9.408 9.072 -9.830 1.00 0.00 C ATOM 213 CD GLN A 16 9.255 10.569 -10.015 1.00 0.00 C ATOM 214 OE1 GLN A 16 8.743 11.266 -9.138 1.00 0.00 O ATOM 215 NE2 GLN A 16 9.701 11.073 -11.160 1.00 0.00 N ATOM 0 H GLN A 16 10.234 6.764 -7.688 1.00 0.00 H new ATOM 0 HA GLN A 16 9.893 9.646 -7.258 1.00 0.00 H new ATOM 0 HB2 GLN A 16 8.383 7.507 -8.791 1.00 0.00 H new ATOM 0 HB3 GLN A 16 7.711 9.104 -8.526 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.465 8.829 -9.720 1.00 0.00 H new ATOM 0 HG3 GLN A 16 9.055 8.561 -10.726 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.118 10.459 -11.859 1.00 0.00 H new ATOM 0 HE22 GLN A 16 9.626 12.074 -11.340 1.00 0.00 H new ATOM 224 N ILE A 17 9.036 8.161 -4.972 1.00 0.00 N ATOM 225 CA ILE A 17 8.239 7.984 -3.764 1.00 0.00 C ATOM 226 C ILE A 17 8.426 9.156 -2.806 1.00 0.00 C ATOM 227 O ILE A 17 9.533 9.656 -2.605 1.00 0.00 O ATOM 228 CB ILE A 17 8.604 6.678 -3.035 1.00 0.00 C ATOM 229 CG1 ILE A 17 8.354 5.474 -3.946 1.00 0.00 C ATOM 230 CG2 ILE A 17 7.806 6.549 -1.746 1.00 0.00 C ATOM 231 CD1 ILE A 17 8.849 4.166 -3.368 1.00 0.00 C ATOM 0 H ILE A 17 10.035 7.994 -4.847 1.00 0.00 H new ATOM 0 HA ILE A 17 7.196 7.936 -4.078 1.00 0.00 H new ATOM 0 HB ILE A 17 9.664 6.705 -2.781 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.285 5.393 -4.143 1.00 0.00 H new ATOM 0 HG13 ILE A 17 8.843 5.646 -4.905 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.076 5.621 -1.243 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.029 7.393 -1.094 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.741 6.540 -1.977 1.00 0.00 H new ATOM 0 HD11 ILE A 17 8.639 3.357 -4.067 1.00 0.00 H new ATOM 0 HD12 ILE A 17 9.924 4.227 -3.197 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.342 3.971 -2.423 1.00 0.00 H new ATOM 243 N PRO A 18 7.318 9.605 -2.197 1.00 0.00 N ATOM 244 CA PRO A 18 7.333 10.722 -1.248 1.00 0.00 C ATOM 245 C PRO A 18 8.024 10.360 0.062 1.00 0.00 C ATOM 246 O PRO A 18 8.460 9.224 0.252 1.00 0.00 O ATOM 247 CB PRO A 18 5.848 11.005 -1.009 1.00 0.00 C ATOM 248 CG PRO A 18 5.165 9.713 -1.298 1.00 0.00 C ATOM 249 CD PRO A 18 5.965 9.057 -2.389 1.00 0.00 C ATOM 0 HA PRO A 18 7.887 11.578 -1.634 1.00 0.00 H new ATOM 0 HB2 PRO A 18 5.667 11.328 0.016 1.00 0.00 H new ATOM 0 HB3 PRO A 18 5.486 11.799 -1.662 1.00 0.00 H new ATOM 0 HG2 PRO A 18 5.128 9.084 -0.409 1.00 0.00 H new ATOM 0 HG3 PRO A 18 4.135 9.878 -1.615 1.00 0.00 H new ATOM 0 HD2 PRO A 18 5.955 7.971 -2.297 1.00 0.00 H new ATOM 0 HD3 PRO A 18 5.571 9.297 -3.376 1.00 0.00 H new ATOM 257 N ASP A 19 8.120 11.331 0.963 1.00 0.00 N ATOM 258 CA ASP A 19 8.757 11.114 2.257 1.00 0.00 C ATOM 259 C ASP A 19 7.749 10.594 3.278 1.00 0.00 C ATOM 260 O ASP A 19 8.047 9.684 4.050 1.00 0.00 O ATOM 261 CB ASP A 19 9.390 12.411 2.762 1.00 0.00 C ATOM 262 CG ASP A 19 10.618 12.804 1.965 1.00 0.00 C ATOM 263 OD1 ASP A 19 10.646 12.533 0.747 1.00 0.00 O ATOM 264 OD2 ASP A 19 11.552 13.383 2.560 1.00 0.00 O ATOM 0 H ASP A 19 7.765 12.277 0.821 1.00 0.00 H new ATOM 0 HA ASP A 19 9.538 10.364 2.129 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.655 13.214 2.711 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.663 12.294 3.811 1.00 0.00 H new ATOM 269 N ALA A 20 6.556 11.179 3.275 1.00 0.00 N ATOM 270 CA ALA A 20 5.505 10.774 4.200 1.00 0.00 C ATOM 271 C ALA A 20 4.358 10.091 3.462 1.00 0.00 C ATOM 272 O ALA A 20 4.188 10.243 2.253 1.00 0.00 O ATOM 273 CB ALA A 20 4.993 11.978 4.976 1.00 0.00 C ATOM 0 H ALA A 20 6.293 11.935 2.642 1.00 0.00 H new ATOM 0 HA ALA A 20 5.929 10.056 4.902 1.00 0.00 H new ATOM 0 HB1 ALA A 20 4.208 11.661 5.663 1.00 0.00 H new ATOM 0 HB2 ALA A 20 5.813 12.422 5.541 1.00 0.00 H new ATOM 0 HB3 ALA A 20 4.591 12.715 4.281 1.00 0.00 H new ATOM 279 N PRO A 21 3.551 9.320 4.206 1.00 0.00 N ATOM 280 CA PRO A 21 2.406 8.598 3.643 1.00 0.00 C ATOM 281 C PRO A 21 1.281 9.536 3.220 1.00 0.00 C ATOM 282 O PRO A 21 0.606 10.148 4.048 1.00 0.00 O ATOM 283 CB PRO A 21 1.950 7.702 4.797 1.00 0.00 C ATOM 284 CG PRO A 21 2.411 8.403 6.027 1.00 0.00 C ATOM 285 CD PRO A 21 3.695 9.093 5.654 1.00 0.00 C ATOM 0 HA PRO A 21 2.673 8.050 2.740 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.867 7.576 4.796 1.00 0.00 H new ATOM 0 HB3 PRO A 21 2.387 6.706 4.722 1.00 0.00 H new ATOM 0 HG2 PRO A 21 1.666 9.122 6.369 1.00 0.00 H new ATOM 0 HG3 PRO A 21 2.570 7.697 6.842 1.00 0.00 H new ATOM 0 HD2 PRO A 21 3.821 10.030 6.197 1.00 0.00 H new ATOM 0 HD3 PRO A 21 4.564 8.475 5.880 1.00 0.00 H new ATOM 293 N PRO A 22 1.072 9.652 1.900 1.00 0.00 N ATOM 294 CA PRO A 22 0.028 10.513 1.337 1.00 0.00 C ATOM 295 C PRO A 22 -1.374 9.979 1.611 1.00 0.00 C ATOM 296 O PRO A 22 -1.567 8.803 1.921 1.00 0.00 O ATOM 297 CB PRO A 22 0.323 10.494 -0.165 1.00 0.00 C ATOM 298 CG PRO A 22 1.041 9.208 -0.393 1.00 0.00 C ATOM 299 CD PRO A 22 1.839 8.952 0.856 1.00 0.00 C ATOM 0 HA PRO A 22 0.043 11.511 1.775 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -0.596 10.544 -0.750 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.935 11.347 -0.459 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.338 8.396 -0.580 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.692 9.274 -1.265 1.00 0.00 H new ATOM 0 HD2 PRO A 22 1.925 7.886 1.067 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.853 9.343 0.772 1.00 0.00 H new ATOM 307 N PRO A 23 -2.378 10.861 1.495 1.00 0.00 N ATOM 308 CA PRO A 23 -3.780 10.500 1.725 1.00 0.00 C ATOM 309 C PRO A 23 -4.329 9.584 0.636 1.00 0.00 C ATOM 310 O PRO A 23 -4.462 9.988 -0.519 1.00 0.00 O ATOM 311 CB PRO A 23 -4.502 11.850 1.702 1.00 0.00 C ATOM 312 CG PRO A 23 -3.632 12.731 0.872 1.00 0.00 C ATOM 313 CD PRO A 23 -2.221 12.279 1.128 1.00 0.00 C ATOM 0 HA PRO A 23 -3.911 9.946 2.655 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -5.499 11.758 1.271 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.625 12.250 2.708 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -3.884 12.644 -0.185 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -3.762 13.778 1.146 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -1.594 12.398 0.244 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -1.755 12.852 1.929 1.00 0.00 H new ATOM 321 N ILE A 24 -4.645 8.350 1.013 1.00 0.00 N ATOM 322 CA ILE A 24 -5.181 7.377 0.069 1.00 0.00 C ATOM 323 C ILE A 24 -6.201 8.021 -0.864 1.00 0.00 C ATOM 324 O ILE A 24 -7.034 8.828 -0.451 1.00 0.00 O ATOM 325 CB ILE A 24 -5.843 6.192 0.796 1.00 0.00 C ATOM 326 CG1 ILE A 24 -4.822 5.473 1.680 1.00 0.00 C ATOM 327 CG2 ILE A 24 -6.454 5.228 -0.210 1.00 0.00 C ATOM 328 CD1 ILE A 24 -5.452 4.606 2.747 1.00 0.00 C ATOM 0 H ILE A 24 -4.539 8.000 1.965 1.00 0.00 H new ATOM 0 HA ILE A 24 -4.339 7.008 -0.516 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.640 6.575 1.433 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.181 4.854 1.052 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.181 6.214 2.157 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.918 4.396 0.319 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.208 5.748 -0.801 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -5.674 4.849 -0.870 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.669 4.127 3.336 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -6.070 5.223 3.399 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -6.071 3.842 2.276 1.00 0.00 H new ATOM 340 N PRO A 25 -6.137 7.656 -2.153 1.00 0.00 N ATOM 341 CA PRO A 25 -7.050 8.184 -3.172 1.00 0.00 C ATOM 342 C PRO A 25 -8.475 7.671 -2.995 1.00 0.00 C ATOM 343 O PRO A 25 -8.749 6.861 -2.110 1.00 0.00 O ATOM 344 CB PRO A 25 -6.454 7.667 -4.484 1.00 0.00 C ATOM 345 CG PRO A 25 -5.698 6.442 -4.100 1.00 0.00 C ATOM 346 CD PRO A 25 -5.170 6.698 -2.716 1.00 0.00 C ATOM 0 HA PRO A 25 -7.131 9.270 -3.124 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -7.234 7.439 -5.211 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.799 8.409 -4.941 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -6.344 5.564 -4.115 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -4.884 6.251 -4.799 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -5.124 5.781 -2.128 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -4.162 7.112 -2.741 1.00 0.00 H new ATOM 354 N LYS A 26 -9.379 8.148 -3.844 1.00 0.00 N ATOM 355 CA LYS A 26 -10.777 7.736 -3.783 1.00 0.00 C ATOM 356 C LYS A 26 -10.915 6.239 -4.038 1.00 0.00 C ATOM 357 O LYS A 26 -10.171 5.665 -4.832 1.00 0.00 O ATOM 358 CB LYS A 26 -11.604 8.517 -4.807 1.00 0.00 C ATOM 359 CG LYS A 26 -13.047 8.735 -4.385 1.00 0.00 C ATOM 360 CD LYS A 26 -13.599 10.039 -4.937 1.00 0.00 C ATOM 361 CE LYS A 26 -13.372 11.193 -3.974 1.00 0.00 C ATOM 362 NZ LYS A 26 -13.514 12.514 -4.647 1.00 0.00 N ATOM 0 H LYS A 26 -9.169 8.820 -4.582 1.00 0.00 H new ATOM 0 HA LYS A 26 -11.150 7.952 -2.782 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -11.134 9.486 -4.978 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -11.589 7.983 -5.757 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -13.659 7.903 -4.734 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -13.111 8.743 -3.297 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -13.123 10.262 -5.892 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -14.666 9.930 -5.131 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -14.085 11.126 -3.152 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -12.376 11.112 -3.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -13.352 13.275 -3.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -12.817 12.589 -5.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -14.473 12.602 -5.040 1.00 0.00 H new ATOM 376 N GLU A 27 -11.873 5.614 -3.360 1.00 0.00 N ATOM 377 CA GLU A 27 -12.107 4.183 -3.515 1.00 0.00 C ATOM 378 C GLU A 27 -13.021 3.907 -4.706 1.00 0.00 C ATOM 379 O GLU A 27 -13.944 4.666 -5.001 1.00 0.00 O ATOM 380 CB GLU A 27 -12.724 3.604 -2.240 1.00 0.00 C ATOM 381 CG GLU A 27 -11.701 3.258 -1.172 1.00 0.00 C ATOM 382 CD GLU A 27 -11.392 4.429 -0.259 1.00 0.00 C ATOM 383 OE1 GLU A 27 -11.631 5.583 -0.674 1.00 0.00 O ATOM 384 OE2 GLU A 27 -10.911 4.193 0.869 1.00 0.00 O ATOM 0 H GLU A 27 -12.498 6.075 -2.699 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.146 3.701 -3.697 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.434 4.323 -1.831 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.289 2.707 -2.495 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.072 2.425 -0.575 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -10.781 2.923 -1.651 1.00 0.00 H new ATOM 391 N PRO A 28 -12.758 2.794 -5.407 1.00 0.00 N ATOM 392 CA PRO A 28 -13.545 2.392 -6.577 1.00 0.00 C ATOM 393 C PRO A 28 -14.952 1.941 -6.202 1.00 0.00 C ATOM 394 O PRO A 28 -15.173 0.777 -5.867 1.00 0.00 O ATOM 395 CB PRO A 28 -12.746 1.222 -7.157 1.00 0.00 C ATOM 396 CG PRO A 28 -11.988 0.670 -5.999 1.00 0.00 C ATOM 397 CD PRO A 28 -11.674 1.843 -5.112 1.00 0.00 C ATOM 0 HA PRO A 28 -13.687 3.217 -7.275 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.404 0.471 -7.594 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.074 1.555 -7.948 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -12.578 -0.075 -5.466 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -11.075 0.176 -6.330 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -11.664 1.559 -4.060 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -10.695 2.267 -5.338 1.00 0.00 H new ATOM 405 N SER A 29 -15.902 2.869 -6.261 1.00 0.00 N ATOM 406 CA SER A 29 -17.288 2.567 -5.924 1.00 0.00 C ATOM 407 C SER A 29 -17.988 1.865 -7.084 1.00 0.00 C ATOM 408 O SER A 29 -19.094 2.238 -7.473 1.00 0.00 O ATOM 409 CB SER A 29 -18.038 3.851 -5.563 1.00 0.00 C ATOM 410 OG SER A 29 -17.671 4.310 -4.274 1.00 0.00 O ATOM 0 H SER A 29 -15.737 3.836 -6.539 1.00 0.00 H new ATOM 0 HA SER A 29 -17.290 1.899 -5.063 1.00 0.00 H new ATOM 0 HB2 SER A 29 -17.822 4.622 -6.302 1.00 0.00 H new ATOM 0 HB3 SER A 29 -19.112 3.670 -5.596 1.00 0.00 H new ATOM 0 HG SER A 29 -18.162 5.132 -4.067 1.00 0.00 H new ATOM 416 N ASN A 30 -17.335 0.846 -7.631 1.00 0.00 N ATOM 417 CA ASN A 30 -17.893 0.090 -8.747 1.00 0.00 C ATOM 418 C ASN A 30 -17.000 -1.095 -9.103 1.00 0.00 C ATOM 419 O ASN A 30 -15.941 -0.927 -9.707 1.00 0.00 O ATOM 420 CB ASN A 30 -18.068 0.996 -9.967 1.00 0.00 C ATOM 421 CG ASN A 30 -16.754 1.587 -10.441 1.00 0.00 C ATOM 422 OD1 ASN A 30 -16.085 2.313 -9.705 1.00 0.00 O ATOM 423 ND2 ASN A 30 -16.378 1.277 -11.677 1.00 0.00 N ATOM 0 H ASN A 30 -16.418 0.524 -7.320 1.00 0.00 H new ATOM 0 HA ASN A 30 -18.868 -0.291 -8.443 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -18.520 0.425 -10.778 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -18.759 1.803 -9.721 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -15.503 1.645 -12.051 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -16.964 0.671 -12.252 1.00 0.00 H new ATOM 430 N TYR A 31 -17.436 -2.291 -8.724 1.00 0.00 N ATOM 431 CA TYR A 31 -16.676 -3.504 -9.002 1.00 0.00 C ATOM 432 C TYR A 31 -17.144 -4.156 -10.299 1.00 0.00 C ATOM 433 O TYR A 31 -18.266 -3.928 -10.752 1.00 0.00 O ATOM 434 CB TYR A 31 -16.813 -4.493 -7.843 1.00 0.00 C ATOM 435 CG TYR A 31 -16.635 -3.859 -6.482 1.00 0.00 C ATOM 436 CD1 TYR A 31 -15.439 -3.245 -6.130 1.00 0.00 C ATOM 437 CD2 TYR A 31 -17.663 -3.875 -5.547 1.00 0.00 C ATOM 438 CE1 TYR A 31 -15.272 -2.665 -4.888 1.00 0.00 C ATOM 439 CE2 TYR A 31 -17.505 -3.296 -4.302 1.00 0.00 C ATOM 440 CZ TYR A 31 -16.308 -2.693 -3.977 1.00 0.00 C ATOM 441 OH TYR A 31 -16.146 -2.117 -2.738 1.00 0.00 O ATOM 0 H TYR A 31 -18.311 -2.447 -8.224 1.00 0.00 H new ATOM 0 HA TYR A 31 -15.628 -3.227 -9.114 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -17.796 -4.962 -7.891 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -16.075 -5.286 -7.964 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -14.626 -3.221 -6.840 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -18.601 -4.348 -5.797 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -14.336 -2.192 -4.631 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -18.315 -3.316 -3.587 1.00 0.00 H new ATOM 0 HH TYR A 31 -16.970 -2.223 -2.218 1.00 0.00 H new ATOM 451 N ASP A 32 -16.276 -4.968 -10.892 1.00 0.00 N ATOM 452 CA ASP A 32 -16.600 -5.655 -12.137 1.00 0.00 C ATOM 453 C ASP A 32 -16.815 -7.146 -11.895 1.00 0.00 C ATOM 454 O ASP A 32 -17.648 -7.778 -12.545 1.00 0.00 O ATOM 455 CB ASP A 32 -15.485 -5.448 -13.163 1.00 0.00 C ATOM 456 CG ASP A 32 -15.380 -6.600 -14.144 1.00 0.00 C ATOM 457 OD1 ASP A 32 -14.680 -7.585 -13.829 1.00 0.00 O ATOM 458 OD2 ASP A 32 -15.996 -6.516 -15.227 1.00 0.00 O ATOM 0 H ASP A 32 -15.343 -5.167 -10.531 1.00 0.00 H new ATOM 0 HA ASP A 32 -17.526 -5.231 -12.527 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -15.666 -4.523 -13.711 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -14.534 -5.329 -12.643 1.00 0.00 H new ATOM 463 N PHE A 33 -16.057 -7.703 -10.956 1.00 0.00 N ATOM 464 CA PHE A 33 -16.162 -9.120 -10.629 1.00 0.00 C ATOM 465 C PHE A 33 -17.617 -9.580 -10.666 1.00 0.00 C ATOM 466 O PHE A 33 -17.954 -10.554 -11.339 1.00 0.00 O ATOM 467 CB PHE A 33 -15.565 -9.392 -9.247 1.00 0.00 C ATOM 468 CG PHE A 33 -14.315 -8.607 -8.969 1.00 0.00 C ATOM 469 CD1 PHE A 33 -13.143 -8.880 -9.655 1.00 0.00 C ATOM 470 CD2 PHE A 33 -14.313 -7.597 -8.021 1.00 0.00 C ATOM 471 CE1 PHE A 33 -11.991 -8.159 -9.402 1.00 0.00 C ATOM 472 CE2 PHE A 33 -13.164 -6.872 -7.764 1.00 0.00 C ATOM 473 CZ PHE A 33 -12.001 -7.155 -8.454 1.00 0.00 C ATOM 0 H PHE A 33 -15.363 -7.194 -10.408 1.00 0.00 H new ATOM 0 HA PHE A 33 -15.602 -9.682 -11.376 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -16.309 -9.157 -8.486 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -15.344 -10.456 -9.159 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -13.129 -9.665 -10.396 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -15.219 -7.373 -7.477 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -11.084 -8.381 -9.945 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -13.176 -6.085 -7.024 1.00 0.00 H new ATOM 0 HZ PHE A 33 -11.102 -6.592 -8.252 1.00 0.00 H new ATOM 483 N SER A 34 -18.474 -8.871 -9.938 1.00 0.00 N ATOM 484 CA SER A 34 -19.892 -9.208 -9.884 1.00 0.00 C ATOM 485 C SER A 34 -20.094 -10.719 -9.954 1.00 0.00 C ATOM 486 O SER A 34 -20.855 -11.217 -10.783 1.00 0.00 O ATOM 487 CB SER A 34 -20.644 -8.528 -11.029 1.00 0.00 C ATOM 488 OG SER A 34 -20.174 -8.980 -12.287 1.00 0.00 O ATOM 0 H SER A 34 -18.211 -8.060 -9.378 1.00 0.00 H new ATOM 0 HA SER A 34 -20.289 -8.849 -8.935 1.00 0.00 H new ATOM 0 HB2 SER A 34 -21.711 -8.734 -10.940 1.00 0.00 H new ATOM 0 HB3 SER A 34 -20.521 -7.447 -10.958 1.00 0.00 H new ATOM 0 HG SER A 34 -19.308 -8.564 -12.481 1.00 0.00 H new ATOM 494 N GLY A 35 -19.407 -11.444 -9.077 1.00 0.00 N ATOM 495 CA GLY A 35 -19.524 -12.890 -9.055 1.00 0.00 C ATOM 496 C GLY A 35 -20.276 -13.393 -7.839 1.00 0.00 C ATOM 497 O GLY A 35 -21.022 -12.655 -7.195 1.00 0.00 O ATOM 0 H GLY A 35 -18.771 -11.055 -8.381 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -20.035 -13.224 -9.958 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.528 -13.332 -9.071 1.00 0.00 H new ATOM 501 N PRO A 36 -20.083 -14.679 -7.509 1.00 0.00 N ATOM 502 CA PRO A 36 -20.742 -15.308 -6.361 1.00 0.00 C ATOM 503 C PRO A 36 -20.211 -14.786 -5.030 1.00 0.00 C ATOM 504 O PRO A 36 -20.687 -15.178 -3.965 1.00 0.00 O ATOM 505 CB PRO A 36 -20.402 -16.792 -6.527 1.00 0.00 C ATOM 506 CG PRO A 36 -19.137 -16.805 -7.314 1.00 0.00 C ATOM 507 CD PRO A 36 -19.208 -15.617 -8.232 1.00 0.00 C ATOM 0 HA PRO A 36 -21.812 -15.101 -6.341 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -20.272 -17.279 -5.560 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -21.198 -17.325 -7.048 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -18.269 -16.740 -6.658 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -19.040 -17.731 -7.881 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -18.222 -15.189 -8.412 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -19.622 -15.885 -9.204 1.00 0.00 H new ATOM 515 N SER A 37 -19.224 -13.899 -5.099 1.00 0.00 N ATOM 516 CA SER A 37 -18.626 -13.325 -3.899 1.00 0.00 C ATOM 517 C SER A 37 -19.696 -13.008 -2.858 1.00 0.00 C ATOM 518 O SER A 37 -19.515 -13.265 -1.668 1.00 0.00 O ATOM 519 CB SER A 37 -17.847 -12.056 -4.249 1.00 0.00 C ATOM 520 OG SER A 37 -16.556 -12.371 -4.743 1.00 0.00 O ATOM 0 H SER A 37 -18.821 -13.562 -5.973 1.00 0.00 H new ATOM 0 HA SER A 37 -17.939 -14.059 -3.478 1.00 0.00 H new ATOM 0 HB2 SER A 37 -18.396 -11.483 -4.996 1.00 0.00 H new ATOM 0 HB3 SER A 37 -17.758 -11.425 -3.365 1.00 0.00 H new ATOM 0 HG SER A 37 -16.078 -11.544 -4.961 1.00 0.00 H new ATOM 526 N SER A 38 -20.810 -12.448 -3.316 1.00 0.00 N ATOM 527 CA SER A 38 -21.908 -12.091 -2.426 1.00 0.00 C ATOM 528 C SER A 38 -22.243 -13.246 -1.486 1.00 0.00 C ATOM 529 O SER A 38 -22.050 -14.412 -1.825 1.00 0.00 O ATOM 530 CB SER A 38 -23.146 -11.704 -3.237 1.00 0.00 C ATOM 531 OG SER A 38 -23.083 -10.350 -3.649 1.00 0.00 O ATOM 0 H SER A 38 -20.976 -12.231 -4.299 1.00 0.00 H new ATOM 0 HA SER A 38 -21.593 -11.236 -1.827 1.00 0.00 H new ATOM 0 HB2 SER A 38 -23.228 -12.350 -4.111 1.00 0.00 H new ATOM 0 HB3 SER A 38 -24.042 -11.864 -2.637 1.00 0.00 H new ATOM 0 HG SER A 38 -23.885 -10.128 -4.167 1.00 0.00 H new ATOM 537 N GLY A 39 -22.746 -12.911 -0.302 1.00 0.00 N ATOM 538 CA GLY A 39 -23.099 -13.929 0.669 1.00 0.00 C ATOM 539 C GLY A 39 -24.280 -14.769 0.225 1.00 0.00 C ATOM 540 O GLY A 39 -24.123 -15.941 -0.118 1.00 0.00 O ATOM 0 H GLY A 39 -22.915 -11.952 0.002 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -22.240 -14.577 0.840 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -23.333 -13.453 1.621 1.00 0.00 H new ATOM 544 N ILE A 40 -25.466 -14.170 0.232 1.00 0.00 N ATOM 545 CA ILE A 40 -26.678 -14.871 -0.173 1.00 0.00 C ATOM 546 C ILE A 40 -27.465 -14.062 -1.199 1.00 0.00 C ATOM 547 O ILE A 40 -27.047 -12.976 -1.599 1.00 0.00 O ATOM 548 CB ILE A 40 -27.587 -15.169 1.035 1.00 0.00 C ATOM 549 CG1 ILE A 40 -27.890 -13.881 1.802 1.00 0.00 C ATOM 550 CG2 ILE A 40 -26.933 -16.195 1.948 1.00 0.00 C ATOM 551 CD1 ILE A 40 -29.219 -13.907 2.525 1.00 0.00 C ATOM 0 H ILE A 40 -25.613 -13.201 0.514 1.00 0.00 H new ATOM 0 HA ILE A 40 -26.362 -15.813 -0.621 1.00 0.00 H new ATOM 0 HB ILE A 40 -28.528 -15.582 0.671 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -27.095 -13.703 2.526 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -27.880 -13.042 1.106 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -27.587 -16.396 2.797 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -26.763 -17.119 1.395 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -25.980 -15.807 2.308 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -29.368 -12.962 3.047 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -30.023 -14.053 1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -29.225 -14.725 3.246 1.00 0.00 H new ATOM 563 N GLU A 41 -28.606 -14.599 -1.619 1.00 0.00 N ATOM 564 CA GLU A 41 -29.452 -13.926 -2.598 1.00 0.00 C ATOM 565 C GLU A 41 -30.784 -13.517 -1.976 1.00 0.00 C ATOM 566 O GLU A 41 -31.084 -13.870 -0.837 1.00 0.00 O ATOM 567 CB GLU A 41 -29.697 -14.835 -3.804 1.00 0.00 C ATOM 568 CG GLU A 41 -30.438 -16.116 -3.460 1.00 0.00 C ATOM 569 CD GLU A 41 -31.940 -15.922 -3.395 1.00 0.00 C ATOM 570 OE1 GLU A 41 -32.603 -16.061 -4.444 1.00 0.00 O ATOM 571 OE2 GLU A 41 -32.453 -15.631 -2.294 1.00 0.00 O ATOM 0 H GLU A 41 -28.966 -15.497 -1.297 1.00 0.00 H new ATOM 0 HA GLU A 41 -28.934 -13.026 -2.930 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -30.267 -14.285 -4.553 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -28.739 -15.090 -4.257 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -30.206 -16.877 -4.205 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -30.082 -16.491 -2.500 1.00 0.00 H new ATOM 578 N GLY A 42 -31.579 -12.768 -2.735 1.00 0.00 N ATOM 579 CA GLY A 42 -32.869 -12.322 -2.242 1.00 0.00 C ATOM 580 C GLY A 42 -33.835 -11.992 -3.363 1.00 0.00 C ATOM 581 O GLY A 42 -34.481 -12.881 -3.916 1.00 0.00 O ATOM 0 H GLY A 42 -31.353 -12.463 -3.682 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -33.301 -13.098 -1.610 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -32.730 -11.441 -1.615 1.00 0.00 H new ATOM 585 N ARG A 43 -33.935 -10.709 -3.697 1.00 0.00 N ATOM 586 CA ARG A 43 -34.832 -10.264 -4.756 1.00 0.00 C ATOM 587 C ARG A 43 -34.162 -10.385 -6.122 1.00 0.00 C ATOM 588 O ARG A 43 -34.306 -9.511 -6.976 1.00 0.00 O ATOM 589 CB ARG A 43 -35.262 -8.816 -4.514 1.00 0.00 C ATOM 590 CG ARG A 43 -36.507 -8.687 -3.652 1.00 0.00 C ATOM 591 CD ARG A 43 -37.295 -7.432 -3.996 1.00 0.00 C ATOM 592 NE ARG A 43 -38.508 -7.310 -3.191 1.00 0.00 N ATOM 593 CZ ARG A 43 -39.481 -6.445 -3.455 1.00 0.00 C ATOM 594 NH1 ARG A 43 -39.384 -5.631 -4.497 1.00 0.00 N ATOM 595 NH2 ARG A 43 -40.554 -6.393 -2.676 1.00 0.00 N ATOM 0 H ARG A 43 -33.406 -9.960 -3.250 1.00 0.00 H new ATOM 0 HA ARG A 43 -35.714 -10.905 -4.744 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -34.443 -8.277 -4.037 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -35.444 -8.334 -5.475 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -37.139 -9.564 -3.790 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -36.222 -8.662 -2.600 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -36.667 -6.555 -3.840 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -37.561 -7.449 -5.053 1.00 0.00 H new ATOM 0 HE ARG A 43 -38.614 -7.922 -2.382 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -38.561 -5.668 -5.098 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -40.133 -4.968 -4.697 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -40.632 -7.018 -1.873 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -41.300 -5.728 -2.880 1.00 0.00 H new ATOM 609 N GLY A 44 -33.427 -11.475 -6.321 1.00 0.00 N ATOM 610 CA GLY A 44 -32.745 -11.690 -7.583 1.00 0.00 C ATOM 611 C GLY A 44 -32.206 -13.101 -7.719 1.00 0.00 C ATOM 612 O GLY A 44 -31.870 -13.742 -6.723 1.00 0.00 O ATOM 0 H GLY A 44 -33.292 -12.213 -5.630 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -33.433 -11.487 -8.403 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -31.923 -10.980 -7.673 1.00 0.00 H new ATOM 616 N SER A 45 -32.126 -13.586 -8.953 1.00 0.00 N ATOM 617 CA SER A 45 -31.630 -14.932 -9.215 1.00 0.00 C ATOM 618 C SER A 45 -30.289 -14.885 -9.942 1.00 0.00 C ATOM 619 O SER A 45 -30.083 -14.062 -10.833 1.00 0.00 O ATOM 620 CB SER A 45 -32.645 -15.721 -10.044 1.00 0.00 C ATOM 621 OG SER A 45 -32.138 -16.997 -10.392 1.00 0.00 O ATOM 0 H SER A 45 -32.398 -13.067 -9.788 1.00 0.00 H new ATOM 0 HA SER A 45 -31.487 -15.432 -8.257 1.00 0.00 H new ATOM 0 HB2 SER A 45 -33.570 -15.836 -9.479 1.00 0.00 H new ATOM 0 HB3 SER A 45 -32.891 -15.165 -10.949 1.00 0.00 H new ATOM 0 HG SER A 45 -32.806 -17.482 -10.920 1.00 0.00 H new ATOM 627 N SER A 46 -29.381 -15.775 -9.554 1.00 0.00 N ATOM 628 CA SER A 46 -28.059 -15.834 -10.166 1.00 0.00 C ATOM 629 C SER A 46 -27.427 -17.208 -9.964 1.00 0.00 C ATOM 630 O SER A 46 -27.783 -17.937 -9.040 1.00 0.00 O ATOM 631 CB SER A 46 -27.152 -14.752 -9.575 1.00 0.00 C ATOM 632 OG SER A 46 -27.311 -13.522 -10.262 1.00 0.00 O ATOM 0 H SER A 46 -29.537 -16.465 -8.819 1.00 0.00 H new ATOM 0 HA SER A 46 -28.173 -15.659 -11.236 1.00 0.00 H new ATOM 0 HB2 SER A 46 -27.385 -14.615 -8.519 1.00 0.00 H new ATOM 0 HB3 SER A 46 -26.112 -15.073 -9.633 1.00 0.00 H new ATOM 0 HG SER A 46 -28.232 -13.445 -10.587 1.00 0.00 H new ATOM 638 N GLY A 47 -26.487 -17.554 -10.838 1.00 0.00 N ATOM 639 CA GLY A 47 -25.820 -18.840 -10.740 1.00 0.00 C ATOM 640 C GLY A 47 -24.592 -18.924 -11.623 1.00 0.00 C ATOM 641 O GLY A 47 -24.692 -19.241 -12.809 1.00 0.00 O ATOM 0 H GLY A 47 -26.175 -16.967 -11.612 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -25.532 -19.018 -9.704 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -26.518 -19.630 -11.017 1.00 0.00 H new ATOM 645 N SER A 48 -23.429 -18.639 -11.046 1.00 0.00 N ATOM 646 CA SER A 48 -22.176 -18.680 -11.791 1.00 0.00 C ATOM 647 C SER A 48 -21.190 -19.647 -11.143 1.00 0.00 C ATOM 648 O SER A 48 -21.426 -20.148 -10.044 1.00 0.00 O ATOM 649 CB SER A 48 -21.559 -17.281 -11.870 1.00 0.00 C ATOM 650 OG SER A 48 -22.050 -16.570 -12.993 1.00 0.00 O ATOM 0 H SER A 48 -23.328 -18.377 -10.065 1.00 0.00 H new ATOM 0 HA SER A 48 -22.393 -19.031 -12.800 1.00 0.00 H new ATOM 0 HB2 SER A 48 -21.785 -16.728 -10.958 1.00 0.00 H new ATOM 0 HB3 SER A 48 -20.474 -17.362 -11.933 1.00 0.00 H new ATOM 0 HG SER A 48 -21.642 -15.679 -13.020 1.00 0.00 H new ATOM 656 N SER A 49 -20.083 -19.904 -11.833 1.00 0.00 N ATOM 657 CA SER A 49 -19.061 -20.814 -11.328 1.00 0.00 C ATOM 658 C SER A 49 -17.673 -20.192 -11.448 1.00 0.00 C ATOM 659 O SER A 49 -17.500 -19.148 -12.074 1.00 0.00 O ATOM 660 CB SER A 49 -19.107 -22.139 -12.090 1.00 0.00 C ATOM 661 OG SER A 49 -20.090 -23.005 -11.550 1.00 0.00 O ATOM 0 H SER A 49 -19.871 -19.495 -12.743 1.00 0.00 H new ATOM 0 HA SER A 49 -19.265 -21.002 -10.274 1.00 0.00 H new ATOM 0 HB2 SER A 49 -19.323 -21.950 -13.142 1.00 0.00 H new ATOM 0 HB3 SER A 49 -18.130 -22.621 -12.047 1.00 0.00 H new ATOM 0 HG SER A 49 -20.100 -23.844 -12.056 1.00 0.00 H new ATOM 667 N GLY A 50 -16.685 -20.844 -10.842 1.00 0.00 N ATOM 668 CA GLY A 50 -15.325 -20.342 -10.891 1.00 0.00 C ATOM 669 C GLY A 50 -14.327 -21.409 -11.296 1.00 0.00 C ATOM 670 O GLY A 50 -13.602 -21.941 -10.455 1.00 0.00 O ATOM 0 H GLY A 50 -16.803 -21.711 -10.318 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -15.272 -19.513 -11.597 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -15.052 -19.946 -9.913 1.00 0.00 H new ATOM 674 N SER A 51 -14.291 -21.725 -12.586 1.00 0.00 N ATOM 675 CA SER A 51 -13.378 -22.740 -13.100 1.00 0.00 C ATOM 676 C SER A 51 -11.956 -22.194 -13.195 1.00 0.00 C ATOM 677 O SER A 51 -11.718 -21.158 -13.814 1.00 0.00 O ATOM 678 CB SER A 51 -13.843 -23.225 -14.474 1.00 0.00 C ATOM 679 OG SER A 51 -15.101 -23.872 -14.388 1.00 0.00 O ATOM 0 H SER A 51 -14.883 -21.293 -13.295 1.00 0.00 H new ATOM 0 HA SER A 51 -13.380 -23.580 -12.406 1.00 0.00 H new ATOM 0 HB2 SER A 51 -13.912 -22.379 -15.158 1.00 0.00 H new ATOM 0 HB3 SER A 51 -13.105 -23.911 -14.890 1.00 0.00 H new ATOM 0 HG SER A 51 -15.377 -24.171 -15.280 1.00 0.00 H new ATOM 685 N SER A 52 -11.016 -22.901 -12.576 1.00 0.00 N ATOM 686 CA SER A 52 -9.618 -22.487 -12.587 1.00 0.00 C ATOM 687 C SER A 52 -8.695 -23.683 -12.368 1.00 0.00 C ATOM 688 O SER A 52 -8.593 -24.208 -11.260 1.00 0.00 O ATOM 689 CB SER A 52 -9.368 -21.432 -11.507 1.00 0.00 C ATOM 690 OG SER A 52 -8.287 -20.587 -11.860 1.00 0.00 O ATOM 0 H SER A 52 -11.197 -23.763 -12.061 1.00 0.00 H new ATOM 0 HA SER A 52 -9.400 -22.056 -13.564 1.00 0.00 H new ATOM 0 HB2 SER A 52 -10.268 -20.835 -11.362 1.00 0.00 H new ATOM 0 HB3 SER A 52 -9.155 -21.923 -10.557 1.00 0.00 H new ATOM 0 HG SER A 52 -8.149 -19.921 -11.155 1.00 0.00 H new ATOM 696 N GLY A 53 -8.026 -24.108 -13.435 1.00 0.00 N ATOM 697 CA GLY A 53 -7.121 -25.239 -13.341 1.00 0.00 C ATOM 698 C GLY A 53 -6.072 -25.235 -14.435 1.00 0.00 C ATOM 699 O GLY A 53 -6.302 -25.757 -15.526 1.00 0.00 O ATOM 0 H GLY A 53 -8.094 -23.690 -14.363 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -6.628 -25.226 -12.369 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -7.694 -26.164 -13.395 1.00 0.00 H new ATOM 703 N SER A 54 -4.918 -24.644 -14.144 1.00 0.00 N ATOM 704 CA SER A 54 -3.831 -24.570 -15.115 1.00 0.00 C ATOM 705 C SER A 54 -2.531 -24.141 -14.442 1.00 0.00 C ATOM 706 O SER A 54 -2.500 -23.870 -13.242 1.00 0.00 O ATOM 707 CB SER A 54 -4.187 -23.591 -16.236 1.00 0.00 C ATOM 708 OG SER A 54 -5.114 -24.167 -17.140 1.00 0.00 O ATOM 0 H SER A 54 -4.711 -24.210 -13.245 1.00 0.00 H new ATOM 0 HA SER A 54 -3.688 -25.563 -15.542 1.00 0.00 H new ATOM 0 HB2 SER A 54 -4.608 -22.681 -15.808 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.283 -23.302 -16.772 1.00 0.00 H new ATOM 0 HG SER A 54 -5.413 -25.034 -16.794 1.00 0.00 H new ATOM 714 N SER A 55 -1.459 -24.080 -15.226 1.00 0.00 N ATOM 715 CA SER A 55 -0.154 -23.688 -14.707 1.00 0.00 C ATOM 716 C SER A 55 0.614 -22.863 -15.735 1.00 0.00 C ATOM 717 O SER A 55 0.527 -23.111 -16.937 1.00 0.00 O ATOM 718 CB SER A 55 0.658 -24.925 -14.320 1.00 0.00 C ATOM 719 OG SER A 55 -0.030 -25.707 -13.359 1.00 0.00 O ATOM 0 H SER A 55 -1.469 -24.297 -16.223 1.00 0.00 H new ATOM 0 HA SER A 55 -0.313 -23.075 -13.820 1.00 0.00 H new ATOM 0 HB2 SER A 55 0.856 -25.526 -15.208 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.624 -24.619 -13.920 1.00 0.00 H new ATOM 0 HG SER A 55 0.509 -26.492 -13.130 1.00 0.00 H new ATOM 725 N GLY A 56 1.366 -21.878 -15.253 1.00 0.00 N ATOM 726 CA GLY A 56 2.139 -21.031 -16.142 1.00 0.00 C ATOM 727 C GLY A 56 1.575 -19.627 -16.240 1.00 0.00 C ATOM 728 O GLY A 56 0.985 -19.257 -17.255 1.00 0.00 O ATOM 0 H GLY A 56 1.453 -21.652 -14.262 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.169 -20.982 -15.788 1.00 0.00 H new ATOM 0 HA3 GLY A 56 2.164 -21.479 -17.135 1.00 0.00 H new ATOM 732 N ASP A 57 1.755 -18.844 -15.183 1.00 0.00 N ATOM 733 CA ASP A 57 1.259 -17.473 -15.153 1.00 0.00 C ATOM 734 C ASP A 57 2.349 -16.511 -14.690 1.00 0.00 C ATOM 735 O ASP A 57 2.943 -16.694 -13.627 1.00 0.00 O ATOM 736 CB ASP A 57 0.043 -17.367 -14.232 1.00 0.00 C ATOM 737 CG ASP A 57 -0.774 -16.117 -14.493 1.00 0.00 C ATOM 738 OD1 ASP A 57 -0.933 -15.749 -15.676 1.00 0.00 O ATOM 739 OD2 ASP A 57 -1.254 -15.507 -13.515 1.00 0.00 O ATOM 0 H ASP A 57 2.241 -19.135 -14.335 1.00 0.00 H new ATOM 0 HA ASP A 57 0.962 -17.198 -16.165 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.589 -18.245 -14.367 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.376 -17.370 -13.194 1.00 0.00 H new ATOM 744 N LYS A 58 2.607 -15.485 -15.494 1.00 0.00 N ATOM 745 CA LYS A 58 3.624 -14.493 -15.168 1.00 0.00 C ATOM 746 C LYS A 58 2.986 -13.213 -14.639 1.00 0.00 C ATOM 747 O LYS A 58 2.661 -12.308 -15.407 1.00 0.00 O ATOM 748 CB LYS A 58 4.474 -14.180 -16.401 1.00 0.00 C ATOM 749 CG LYS A 58 5.506 -13.090 -16.168 1.00 0.00 C ATOM 750 CD LYS A 58 6.625 -13.567 -15.257 1.00 0.00 C ATOM 751 CE LYS A 58 7.719 -14.275 -16.043 1.00 0.00 C ATOM 752 NZ LYS A 58 7.373 -15.697 -16.315 1.00 0.00 N ATOM 0 H LYS A 58 2.125 -15.319 -16.377 1.00 0.00 H new ATOM 0 HA LYS A 58 4.264 -14.908 -14.389 1.00 0.00 H new ATOM 0 HB2 LYS A 58 4.984 -15.089 -16.721 1.00 0.00 H new ATOM 0 HB3 LYS A 58 3.818 -13.879 -17.217 1.00 0.00 H new ATOM 0 HG2 LYS A 58 5.924 -12.773 -17.124 1.00 0.00 H new ATOM 0 HG3 LYS A 58 5.023 -12.218 -15.726 1.00 0.00 H new ATOM 0 HD2 LYS A 58 7.050 -12.716 -14.725 1.00 0.00 H new ATOM 0 HD3 LYS A 58 6.220 -14.244 -14.505 1.00 0.00 H new ATOM 0 HE2 LYS A 58 7.884 -13.754 -16.986 1.00 0.00 H new ATOM 0 HE3 LYS A 58 8.655 -14.229 -15.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.238 -16.274 -16.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.717 -16.040 -15.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 6.922 -15.772 -17.249 1.00 0.00 H new ATOM 766 N GLU A 59 2.811 -13.144 -13.323 1.00 0.00 N ATOM 767 CA GLU A 59 2.212 -11.973 -12.692 1.00 0.00 C ATOM 768 C GLU A 59 3.284 -10.963 -12.293 1.00 0.00 C ATOM 769 O GLU A 59 4.477 -11.200 -12.481 1.00 0.00 O ATOM 770 CB GLU A 59 1.402 -12.387 -11.462 1.00 0.00 C ATOM 771 CG GLU A 59 0.065 -13.025 -11.800 1.00 0.00 C ATOM 772 CD GLU A 59 -0.615 -12.362 -12.983 1.00 0.00 C ATOM 773 OE1 GLU A 59 -1.075 -11.210 -12.834 1.00 0.00 O ATOM 774 OE2 GLU A 59 -0.687 -12.995 -14.057 1.00 0.00 O ATOM 0 H GLU A 59 3.075 -13.885 -12.673 1.00 0.00 H new ATOM 0 HA GLU A 59 1.545 -11.503 -13.415 1.00 0.00 H new ATOM 0 HB2 GLU A 59 1.990 -13.088 -10.869 1.00 0.00 H new ATOM 0 HB3 GLU A 59 1.229 -11.509 -10.839 1.00 0.00 H new ATOM 0 HG2 GLU A 59 0.216 -14.082 -12.018 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -0.590 -12.969 -10.931 1.00 0.00 H new ATOM 781 N ARG A 60 2.848 -9.835 -11.741 1.00 0.00 N ATOM 782 CA ARG A 60 3.769 -8.787 -11.316 1.00 0.00 C ATOM 783 C ARG A 60 4.133 -8.947 -9.843 1.00 0.00 C ATOM 784 O ARG A 60 3.343 -9.461 -9.050 1.00 0.00 O ATOM 785 CB ARG A 60 3.150 -7.408 -11.553 1.00 0.00 C ATOM 786 CG ARG A 60 4.172 -6.285 -11.616 1.00 0.00 C ATOM 787 CD ARG A 60 3.690 -5.142 -12.497 1.00 0.00 C ATOM 788 NE ARG A 60 3.429 -5.579 -13.866 1.00 0.00 N ATOM 789 CZ ARG A 60 3.363 -4.750 -14.902 1.00 0.00 C ATOM 790 NH1 ARG A 60 3.538 -3.448 -14.725 1.00 0.00 N ATOM 791 NH2 ARG A 60 3.123 -5.223 -16.118 1.00 0.00 N ATOM 0 H ARG A 60 1.864 -9.623 -11.578 1.00 0.00 H new ATOM 0 HA ARG A 60 4.679 -8.876 -11.909 1.00 0.00 H new ATOM 0 HB2 ARG A 60 2.586 -7.428 -12.486 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.439 -7.196 -10.755 1.00 0.00 H new ATOM 0 HG2 ARG A 60 4.368 -5.913 -10.610 1.00 0.00 H new ATOM 0 HG3 ARG A 60 5.115 -6.671 -12.003 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.781 -4.716 -12.073 1.00 0.00 H new ATOM 0 HD3 ARG A 60 4.439 -4.350 -12.506 1.00 0.00 H new ATOM 0 HE ARG A 60 3.290 -6.575 -14.036 1.00 0.00 H new ATOM 0 HH11 ARG A 60 3.724 -3.081 -13.792 1.00 0.00 H new ATOM 0 HH12 ARG A 60 3.487 -2.814 -15.522 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.989 -6.224 -16.258 1.00 0.00 H new ATOM 0 HH22 ARG A 60 3.073 -4.585 -16.912 1.00 0.00 H new ATOM 805 N HIS A 61 5.333 -8.504 -9.484 1.00 0.00 N ATOM 806 CA HIS A 61 5.802 -8.598 -8.106 1.00 0.00 C ATOM 807 C HIS A 61 5.818 -7.224 -7.442 1.00 0.00 C ATOM 808 O HIS A 61 6.472 -6.300 -7.923 1.00 0.00 O ATOM 809 CB HIS A 61 7.200 -9.215 -8.061 1.00 0.00 C ATOM 810 CG HIS A 61 7.473 -9.991 -6.809 1.00 0.00 C ATOM 811 ND1 HIS A 61 8.450 -9.638 -5.903 1.00 0.00 N ATOM 812 CD2 HIS A 61 6.889 -11.108 -6.315 1.00 0.00 C ATOM 813 CE1 HIS A 61 8.456 -10.504 -4.905 1.00 0.00 C ATOM 814 NE2 HIS A 61 7.518 -11.406 -5.131 1.00 0.00 N ATOM 0 H HIS A 61 5.999 -8.076 -10.128 1.00 0.00 H new ATOM 0 HA HIS A 61 5.112 -9.239 -7.557 1.00 0.00 H new ATOM 0 HB2 HIS A 61 7.326 -9.873 -8.921 1.00 0.00 H new ATOM 0 HB3 HIS A 61 7.941 -8.422 -8.156 1.00 0.00 H new ATOM 0 HD2 HIS A 61 6.080 -11.661 -6.768 1.00 0.00 H new ATOM 0 HE1 HIS A 61 9.116 -10.479 -4.050 1.00 0.00 H new ATOM 0 HE2 HIS A 61 7.297 -12.196 -4.525 1.00 0.00 H new ATOM 823 N GLY A 62 5.093 -7.098 -6.335 1.00 0.00 N ATOM 824 CA GLY A 62 5.038 -5.834 -5.625 1.00 0.00 C ATOM 825 C GLY A 62 5.409 -5.974 -4.161 1.00 0.00 C ATOM 826 O GLY A 62 5.451 -7.083 -3.628 1.00 0.00 O ATOM 0 H GLY A 62 4.543 -7.849 -5.917 1.00 0.00 H new ATOM 0 HA2 GLY A 62 5.714 -5.124 -6.101 1.00 0.00 H new ATOM 0 HA3 GLY A 62 4.033 -5.420 -5.704 1.00 0.00 H new ATOM 830 N VAL A 63 5.679 -4.847 -3.511 1.00 0.00 N ATOM 831 CA VAL A 63 6.049 -4.849 -2.100 1.00 0.00 C ATOM 832 C VAL A 63 5.478 -3.632 -1.381 1.00 0.00 C ATOM 833 O VAL A 63 5.673 -2.496 -1.811 1.00 0.00 O ATOM 834 CB VAL A 63 7.579 -4.867 -1.921 1.00 0.00 C ATOM 835 CG1 VAL A 63 7.957 -4.423 -0.516 1.00 0.00 C ATOM 836 CG2 VAL A 63 8.134 -6.251 -2.220 1.00 0.00 C ATOM 0 H VAL A 63 5.649 -3.921 -3.938 1.00 0.00 H new ATOM 0 HA VAL A 63 5.629 -5.755 -1.664 1.00 0.00 H new ATOM 0 HB VAL A 63 8.019 -4.164 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 63 9.041 -4.442 -0.408 1.00 0.00 H new ATOM 0 HG12 VAL A 63 7.593 -3.410 -0.344 1.00 0.00 H new ATOM 0 HG13 VAL A 63 7.508 -5.098 0.212 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.216 -6.245 -2.089 1.00 0.00 H new ATOM 0 HG22 VAL A 63 7.689 -6.976 -1.538 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.895 -6.525 -3.248 1.00 0.00 H new ATOM 846 N ALA A 64 4.772 -3.879 -0.282 1.00 0.00 N ATOM 847 CA ALA A 64 4.174 -2.803 0.499 1.00 0.00 C ATOM 848 C ALA A 64 5.247 -1.921 1.129 1.00 0.00 C ATOM 849 O ALA A 64 6.145 -2.412 1.812 1.00 0.00 O ATOM 850 CB ALA A 64 3.261 -3.375 1.573 1.00 0.00 C ATOM 0 H ALA A 64 4.600 -4.814 0.087 1.00 0.00 H new ATOM 0 HA ALA A 64 3.581 -2.184 -0.175 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.821 -2.560 2.148 1.00 0.00 H new ATOM 0 HB2 ALA A 64 2.468 -3.957 1.104 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.839 -4.018 2.237 1.00 0.00 H new ATOM 856 N ILE A 65 5.147 -0.617 0.894 1.00 0.00 N ATOM 857 CA ILE A 65 6.109 0.333 1.438 1.00 0.00 C ATOM 858 C ILE A 65 5.530 1.074 2.640 1.00 0.00 C ATOM 859 O ILE A 65 6.266 1.530 3.515 1.00 0.00 O ATOM 860 CB ILE A 65 6.547 1.361 0.379 1.00 0.00 C ATOM 861 CG1 ILE A 65 5.324 2.032 -0.249 1.00 0.00 C ATOM 862 CG2 ILE A 65 7.397 0.690 -0.690 1.00 0.00 C ATOM 863 CD1 ILE A 65 5.673 3.074 -1.289 1.00 0.00 C ATOM 0 H ILE A 65 4.409 -0.194 0.330 1.00 0.00 H new ATOM 0 HA ILE A 65 6.978 -0.244 1.753 1.00 0.00 H new ATOM 0 HB ILE A 65 7.149 2.128 0.866 1.00 0.00 H new ATOM 0 HG12 ILE A 65 4.696 1.268 -0.708 1.00 0.00 H new ATOM 0 HG13 ILE A 65 4.732 2.500 0.538 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.699 1.429 -1.432 1.00 0.00 H new ATOM 0 HG22 ILE A 65 8.284 0.255 -0.229 1.00 0.00 H new ATOM 0 HG23 ILE A 65 6.818 -0.095 -1.176 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.757 3.508 -1.691 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.275 3.858 -0.830 1.00 0.00 H new ATOM 0 HD13 ILE A 65 6.238 2.608 -2.096 1.00 0.00 H new ATOM 875 N TYR A 66 4.207 1.188 2.676 1.00 0.00 N ATOM 876 CA TYR A 66 3.529 1.873 3.769 1.00 0.00 C ATOM 877 C TYR A 66 2.481 0.970 4.412 1.00 0.00 C ATOM 878 O TYR A 66 1.678 0.343 3.722 1.00 0.00 O ATOM 879 CB TYR A 66 2.870 3.158 3.264 1.00 0.00 C ATOM 880 CG TYR A 66 3.858 4.242 2.899 1.00 0.00 C ATOM 881 CD1 TYR A 66 4.586 4.904 3.880 1.00 0.00 C ATOM 882 CD2 TYR A 66 4.064 4.605 1.574 1.00 0.00 C ATOM 883 CE1 TYR A 66 5.490 5.896 3.552 1.00 0.00 C ATOM 884 CE2 TYR A 66 4.966 5.595 1.236 1.00 0.00 C ATOM 885 CZ TYR A 66 5.676 6.238 2.229 1.00 0.00 C ATOM 886 OH TYR A 66 6.576 7.225 1.898 1.00 0.00 O ATOM 0 H TYR A 66 3.583 0.815 1.961 1.00 0.00 H new ATOM 0 HA TYR A 66 4.275 2.127 4.522 1.00 0.00 H new ATOM 0 HB2 TYR A 66 2.260 2.925 2.391 1.00 0.00 H new ATOM 0 HB3 TYR A 66 2.195 3.536 4.032 1.00 0.00 H new ATOM 0 HD1 TYR A 66 4.443 4.638 4.917 1.00 0.00 H new ATOM 0 HD2 TYR A 66 3.509 4.104 0.794 1.00 0.00 H new ATOM 0 HE1 TYR A 66 6.048 6.401 4.327 1.00 0.00 H new ATOM 0 HE2 TYR A 66 5.115 5.864 0.201 1.00 0.00 H new ATOM 0 HH TYR A 66 6.589 7.343 0.925 1.00 0.00 H new ATOM 896 N ASN A 67 2.496 0.909 5.740 1.00 0.00 N ATOM 897 CA ASN A 67 1.547 0.083 6.477 1.00 0.00 C ATOM 898 C ASN A 67 0.112 0.507 6.183 1.00 0.00 C ATOM 899 O ASN A 67 -0.327 1.581 6.595 1.00 0.00 O ATOM 900 CB ASN A 67 1.820 0.175 7.980 1.00 0.00 C ATOM 901 CG ASN A 67 2.820 -0.863 8.451 1.00 0.00 C ATOM 902 OD1 ASN A 67 2.766 -2.023 8.044 1.00 0.00 O ATOM 903 ND2 ASN A 67 3.740 -0.448 9.314 1.00 0.00 N ATOM 0 H ASN A 67 3.154 1.421 6.327 1.00 0.00 H new ATOM 0 HA ASN A 67 1.675 -0.950 6.153 1.00 0.00 H new ATOM 0 HB2 ASN A 67 2.195 1.171 8.218 1.00 0.00 H new ATOM 0 HB3 ASN A 67 0.885 0.048 8.525 1.00 0.00 H new ATOM 0 HD21 ASN A 67 4.440 -1.101 9.667 1.00 0.00 H new ATOM 0 HD22 ASN A 67 3.747 0.524 9.624 1.00 0.00 H new ATOM 910 N PHE A 68 -0.616 -0.344 5.467 1.00 0.00 N ATOM 911 CA PHE A 68 -2.002 -0.057 5.116 1.00 0.00 C ATOM 912 C PHE A 68 -2.961 -0.740 6.087 1.00 0.00 C ATOM 913 O PHE A 68 -2.829 -1.930 6.372 1.00 0.00 O ATOM 914 CB PHE A 68 -2.294 -0.516 3.686 1.00 0.00 C ATOM 915 CG PHE A 68 -3.714 -0.277 3.258 1.00 0.00 C ATOM 916 CD1 PHE A 68 -4.716 -1.169 3.603 1.00 0.00 C ATOM 917 CD2 PHE A 68 -4.046 0.841 2.509 1.00 0.00 C ATOM 918 CE1 PHE A 68 -6.023 -0.951 3.210 1.00 0.00 C ATOM 919 CE2 PHE A 68 -5.351 1.064 2.114 1.00 0.00 C ATOM 920 CZ PHE A 68 -6.341 0.167 2.464 1.00 0.00 C ATOM 0 H PHE A 68 -0.269 -1.238 5.119 1.00 0.00 H new ATOM 0 HA PHE A 68 -2.152 1.021 5.182 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -1.624 0.005 3.002 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -2.072 -1.580 3.602 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -4.473 -2.045 4.186 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.276 1.546 2.231 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.795 -1.654 3.486 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -5.597 1.940 1.532 1.00 0.00 H new ATOM 0 HZ PHE A 68 -7.361 0.339 2.155 1.00 0.00 H new ATOM 930 N GLN A 69 -3.925 0.023 6.592 1.00 0.00 N ATOM 931 CA GLN A 69 -4.905 -0.508 7.532 1.00 0.00 C ATOM 932 C GLN A 69 -6.326 -0.273 7.029 1.00 0.00 C ATOM 933 O GLN A 69 -6.821 0.853 7.043 1.00 0.00 O ATOM 934 CB GLN A 69 -4.726 0.138 8.908 1.00 0.00 C ATOM 935 CG GLN A 69 -4.904 1.647 8.899 1.00 0.00 C ATOM 936 CD GLN A 69 -4.197 2.325 10.056 1.00 0.00 C ATOM 937 OE1 GLN A 69 -3.007 2.631 9.978 1.00 0.00 O ATOM 938 NE2 GLN A 69 -4.927 2.563 11.139 1.00 0.00 N ATOM 0 H GLN A 69 -4.048 1.010 6.366 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.742 -1.582 7.618 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.443 -0.300 9.602 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.731 -0.100 9.285 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -4.523 2.048 7.960 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -5.967 1.884 8.939 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -5.910 2.293 11.161 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -4.505 3.016 11.949 1.00 0.00 H new ATOM 947 N GLY A 70 -6.976 -1.344 6.584 1.00 0.00 N ATOM 948 CA GLY A 70 -8.332 -1.233 6.081 1.00 0.00 C ATOM 949 C GLY A 70 -9.368 -1.620 7.118 1.00 0.00 C ATOM 950 O GLY A 70 -9.079 -1.648 8.314 1.00 0.00 O ATOM 0 H GLY A 70 -6.587 -2.287 6.563 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -8.513 -0.209 5.756 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.444 -1.870 5.204 1.00 0.00 H new ATOM 954 N SER A 71 -10.580 -1.918 6.659 1.00 0.00 N ATOM 955 CA SER A 71 -11.664 -2.300 7.556 1.00 0.00 C ATOM 956 C SER A 71 -12.204 -3.681 7.198 1.00 0.00 C ATOM 957 O SER A 71 -12.362 -4.542 8.063 1.00 0.00 O ATOM 958 CB SER A 71 -12.791 -1.268 7.496 1.00 0.00 C ATOM 959 OG SER A 71 -12.412 -0.060 8.133 1.00 0.00 O ATOM 0 H SER A 71 -10.835 -1.902 5.672 1.00 0.00 H new ATOM 0 HA SER A 71 -11.268 -2.336 8.571 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.050 -1.068 6.456 1.00 0.00 H new ATOM 0 HB3 SER A 71 -13.683 -1.671 7.975 1.00 0.00 H new ATOM 0 HG SER A 71 -13.149 0.583 8.079 1.00 0.00 H new ATOM 965 N GLY A 72 -12.486 -3.885 5.915 1.00 0.00 N ATOM 966 CA GLY A 72 -13.006 -5.163 5.463 1.00 0.00 C ATOM 967 C GLY A 72 -13.117 -5.243 3.954 1.00 0.00 C ATOM 968 O GLY A 72 -13.262 -4.223 3.281 1.00 0.00 O ATOM 0 H GLY A 72 -12.364 -3.188 5.180 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -12.356 -5.962 5.819 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -13.988 -5.329 5.906 1.00 0.00 H new ATOM 972 N ALA A 73 -13.046 -6.458 3.420 1.00 0.00 N ATOM 973 CA ALA A 73 -13.139 -6.667 1.981 1.00 0.00 C ATOM 974 C ALA A 73 -14.164 -5.727 1.355 1.00 0.00 C ATOM 975 O ALA A 73 -15.098 -5.264 2.009 1.00 0.00 O ATOM 976 CB ALA A 73 -13.497 -8.115 1.680 1.00 0.00 C ATOM 0 H ALA A 73 -12.924 -7.313 3.963 1.00 0.00 H new ATOM 0 HA ALA A 73 -12.166 -6.446 1.543 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.563 -8.257 0.601 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.728 -8.772 2.086 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.457 -8.355 2.137 1.00 0.00 H new ATOM 982 N PRO A 74 -13.986 -5.435 0.058 1.00 0.00 N ATOM 983 CA PRO A 74 -12.877 -5.980 -0.731 1.00 0.00 C ATOM 984 C PRO A 74 -11.530 -5.399 -0.315 1.00 0.00 C ATOM 985 O PRO A 74 -10.488 -5.780 -0.848 1.00 0.00 O ATOM 986 CB PRO A 74 -13.221 -5.561 -2.162 1.00 0.00 C ATOM 987 CG PRO A 74 -14.074 -4.350 -2.008 1.00 0.00 C ATOM 988 CD PRO A 74 -14.854 -4.552 -0.738 1.00 0.00 C ATOM 0 HA PRO A 74 -12.774 -7.057 -0.601 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -12.322 -5.341 -2.737 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -13.751 -6.354 -2.690 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -13.465 -3.448 -1.953 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -14.742 -4.232 -2.861 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.043 -3.607 -0.228 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.824 -5.010 -0.931 1.00 0.00 H new ATOM 996 N GLN A 75 -11.558 -4.475 0.641 1.00 0.00 N ATOM 997 CA GLN A 75 -10.338 -3.842 1.127 1.00 0.00 C ATOM 998 C GLN A 75 -9.500 -4.826 1.937 1.00 0.00 C ATOM 999 O GLN A 75 -9.967 -5.384 2.931 1.00 0.00 O ATOM 1000 CB GLN A 75 -10.679 -2.620 1.982 1.00 0.00 C ATOM 1001 CG GLN A 75 -10.832 -1.339 1.177 1.00 0.00 C ATOM 1002 CD GLN A 75 -11.445 -0.213 1.986 1.00 0.00 C ATOM 1003 OE1 GLN A 75 -11.045 0.040 3.122 1.00 0.00 O ATOM 1004 NE2 GLN A 75 -12.422 0.472 1.402 1.00 0.00 N ATOM 0 H GLN A 75 -12.412 -4.149 1.094 1.00 0.00 H new ATOM 0 HA GLN A 75 -9.755 -3.522 0.263 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -11.605 -2.812 2.523 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -9.897 -2.479 2.728 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -9.855 -1.027 0.808 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -11.454 -1.535 0.304 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -12.722 0.228 0.458 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -12.872 1.242 1.897 1.00 0.00 H new ATOM 1013 N LEU A 76 -8.261 -5.036 1.505 1.00 0.00 N ATOM 1014 CA LEU A 76 -7.357 -5.953 2.190 1.00 0.00 C ATOM 1015 C LEU A 76 -6.242 -5.191 2.899 1.00 0.00 C ATOM 1016 O LEU A 76 -5.741 -4.189 2.390 1.00 0.00 O ATOM 1017 CB LEU A 76 -6.758 -6.948 1.194 1.00 0.00 C ATOM 1018 CG LEU A 76 -5.591 -7.791 1.709 1.00 0.00 C ATOM 1019 CD1 LEU A 76 -6.103 -9.016 2.450 1.00 0.00 C ATOM 1020 CD2 LEU A 76 -4.682 -8.202 0.559 1.00 0.00 C ATOM 0 H LEU A 76 -7.860 -4.584 0.684 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.931 -6.499 2.939 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -7.549 -7.621 0.863 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -6.422 -6.396 0.316 1.00 0.00 H new ATOM 0 HG LEU A 76 -5.011 -7.186 2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -5.258 -9.604 2.809 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -6.712 -8.701 3.297 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -6.707 -9.623 1.776 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -3.857 -8.801 0.944 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.251 -8.788 -0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -4.287 -7.311 0.071 1.00 0.00 H new ATOM 1032 N SER A 77 -5.858 -5.674 4.076 1.00 0.00 N ATOM 1033 CA SER A 77 -4.802 -5.038 4.856 1.00 0.00 C ATOM 1034 C SER A 77 -3.426 -5.428 4.327 1.00 0.00 C ATOM 1035 O SER A 77 -3.276 -6.436 3.635 1.00 0.00 O ATOM 1036 CB SER A 77 -4.924 -5.427 6.330 1.00 0.00 C ATOM 1037 OG SER A 77 -4.582 -6.788 6.529 1.00 0.00 O ATOM 0 H SER A 77 -6.262 -6.504 4.511 1.00 0.00 H new ATOM 0 HA SER A 77 -4.915 -3.958 4.762 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.272 -4.793 6.932 1.00 0.00 H new ATOM 0 HB3 SER A 77 -5.944 -5.251 6.672 1.00 0.00 H new ATOM 0 HG SER A 77 -4.666 -7.011 7.480 1.00 0.00 H new ATOM 1043 N LEU A 78 -2.422 -4.622 4.657 1.00 0.00 N ATOM 1044 CA LEU A 78 -1.056 -4.882 4.217 1.00 0.00 C ATOM 1045 C LEU A 78 -0.048 -4.385 5.248 1.00 0.00 C ATOM 1046 O LEU A 78 -0.348 -3.497 6.045 1.00 0.00 O ATOM 1047 CB LEU A 78 -0.798 -4.208 2.868 1.00 0.00 C ATOM 1048 CG LEU A 78 -1.261 -4.980 1.632 1.00 0.00 C ATOM 1049 CD1 LEU A 78 -0.989 -4.178 0.369 1.00 0.00 C ATOM 1050 CD2 LEU A 78 -0.577 -6.337 1.563 1.00 0.00 C ATOM 0 H LEU A 78 -2.529 -3.783 5.228 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.934 -5.960 4.108 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.291 -3.236 2.870 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.272 -4.023 2.776 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.336 -5.142 1.710 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.325 -4.743 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.527 -3.231 0.416 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.080 -3.984 0.284 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.919 -6.872 0.677 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.503 -6.198 1.509 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.824 -6.915 2.454 1.00 0.00 H new ATOM 1062 N GLN A 79 1.149 -4.962 5.224 1.00 0.00 N ATOM 1063 CA GLN A 79 2.202 -4.577 6.156 1.00 0.00 C ATOM 1064 C GLN A 79 3.506 -4.295 5.417 1.00 0.00 C ATOM 1065 O GLN A 79 3.884 -5.029 4.503 1.00 0.00 O ATOM 1066 CB GLN A 79 2.418 -5.676 7.197 1.00 0.00 C ATOM 1067 CG GLN A 79 1.471 -5.586 8.382 1.00 0.00 C ATOM 1068 CD GLN A 79 1.797 -6.594 9.467 1.00 0.00 C ATOM 1069 OE1 GLN A 79 2.712 -6.390 10.265 1.00 0.00 O ATOM 1070 NE2 GLN A 79 1.046 -7.689 9.503 1.00 0.00 N ATOM 0 H GLN A 79 1.414 -5.698 4.569 1.00 0.00 H new ATOM 0 HA GLN A 79 1.889 -3.664 6.663 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.296 -6.648 6.718 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.445 -5.626 7.559 1.00 0.00 H new ATOM 0 HG2 GLN A 79 1.513 -4.581 8.801 1.00 0.00 H new ATOM 0 HG3 GLN A 79 0.449 -5.745 8.038 1.00 0.00 H new ATOM 0 HE21 GLN A 79 0.298 -7.817 8.822 1.00 0.00 H new ATOM 0 HE22 GLN A 79 1.217 -8.402 10.212 1.00 0.00 H new ATOM 1079 N ILE A 80 4.190 -3.229 5.820 1.00 0.00 N ATOM 1080 CA ILE A 80 5.453 -2.852 5.196 1.00 0.00 C ATOM 1081 C ILE A 80 6.394 -4.047 5.095 1.00 0.00 C ATOM 1082 O ILE A 80 6.622 -4.757 6.074 1.00 0.00 O ATOM 1083 CB ILE A 80 6.153 -1.726 5.979 1.00 0.00 C ATOM 1084 CG1 ILE A 80 5.292 -0.461 5.975 1.00 0.00 C ATOM 1085 CG2 ILE A 80 7.525 -1.442 5.386 1.00 0.00 C ATOM 1086 CD1 ILE A 80 5.818 0.630 6.881 1.00 0.00 C ATOM 0 H ILE A 80 3.891 -2.612 6.575 1.00 0.00 H new ATOM 0 HA ILE A 80 5.216 -2.494 4.194 1.00 0.00 H new ATOM 0 HB ILE A 80 6.285 -2.049 7.012 1.00 0.00 H new ATOM 0 HG12 ILE A 80 5.229 -0.077 4.957 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.279 -0.720 6.282 1.00 0.00 H new ATOM 0 HG21 ILE A 80 8.007 -0.644 5.950 1.00 0.00 H new ATOM 0 HG22 ILE A 80 8.137 -2.343 5.436 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.415 -1.136 4.346 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.159 1.496 6.828 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.855 0.264 7.907 1.00 0.00 H new ATOM 0 HD13 ILE A 80 6.820 0.917 6.561 1.00 0.00 H new ATOM 1098 N GLY A 81 6.942 -4.264 3.903 1.00 0.00 N ATOM 1099 CA GLY A 81 7.854 -5.373 3.695 1.00 0.00 C ATOM 1100 C GLY A 81 7.137 -6.646 3.293 1.00 0.00 C ATOM 1101 O GLY A 81 7.696 -7.739 3.392 1.00 0.00 O ATOM 0 H GLY A 81 6.770 -3.691 3.077 1.00 0.00 H new ATOM 0 HA2 GLY A 81 8.575 -5.106 2.922 1.00 0.00 H new ATOM 0 HA3 GLY A 81 8.419 -5.551 4.610 1.00 0.00 H new ATOM 1105 N ASP A 82 5.896 -6.507 2.840 1.00 0.00 N ATOM 1106 CA ASP A 82 5.101 -7.656 2.422 1.00 0.00 C ATOM 1107 C ASP A 82 4.862 -7.632 0.916 1.00 0.00 C ATOM 1108 O ASP A 82 4.624 -6.575 0.331 1.00 0.00 O ATOM 1109 CB ASP A 82 3.763 -7.674 3.163 1.00 0.00 C ATOM 1110 CG ASP A 82 3.909 -8.099 4.611 1.00 0.00 C ATOM 1111 OD1 ASP A 82 4.978 -7.838 5.201 1.00 0.00 O ATOM 1112 OD2 ASP A 82 2.954 -8.694 5.154 1.00 0.00 O ATOM 0 H ASP A 82 5.419 -5.610 2.753 1.00 0.00 H new ATOM 0 HA ASP A 82 5.657 -8.561 2.669 1.00 0.00 H new ATOM 0 HB2 ASP A 82 3.315 -6.681 3.122 1.00 0.00 H new ATOM 0 HB3 ASP A 82 3.079 -8.354 2.655 1.00 0.00 H new ATOM 1117 N VAL A 83 4.929 -8.804 0.293 1.00 0.00 N ATOM 1118 CA VAL A 83 4.720 -8.919 -1.146 1.00 0.00 C ATOM 1119 C VAL A 83 3.374 -9.563 -1.456 1.00 0.00 C ATOM 1120 O VAL A 83 2.951 -10.500 -0.779 1.00 0.00 O ATOM 1121 CB VAL A 83 5.838 -9.744 -1.812 1.00 0.00 C ATOM 1122 CG1 VAL A 83 5.649 -9.779 -3.321 1.00 0.00 C ATOM 1123 CG2 VAL A 83 7.203 -9.181 -1.449 1.00 0.00 C ATOM 0 H VAL A 83 5.126 -9.688 0.762 1.00 0.00 H new ATOM 0 HA VAL A 83 4.737 -7.907 -1.550 1.00 0.00 H new ATOM 0 HB VAL A 83 5.782 -10.767 -1.440 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.448 -10.366 -3.774 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.686 -10.233 -3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.677 -8.763 -3.715 1.00 0.00 H new ATOM 0 HG21 VAL A 83 7.981 -9.776 -1.928 1.00 0.00 H new ATOM 0 HG22 VAL A 83 7.273 -8.148 -1.791 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.335 -9.215 -0.367 1.00 0.00 H new ATOM 1133 N VAL A 84 2.704 -9.054 -2.486 1.00 0.00 N ATOM 1134 CA VAL A 84 1.405 -9.581 -2.888 1.00 0.00 C ATOM 1135 C VAL A 84 1.388 -9.927 -4.372 1.00 0.00 C ATOM 1136 O VAL A 84 1.792 -9.123 -5.212 1.00 0.00 O ATOM 1137 CB VAL A 84 0.276 -8.576 -2.593 1.00 0.00 C ATOM 1138 CG1 VAL A 84 0.138 -8.351 -1.095 1.00 0.00 C ATOM 1139 CG2 VAL A 84 0.532 -7.262 -3.316 1.00 0.00 C ATOM 0 H VAL A 84 3.039 -8.278 -3.057 1.00 0.00 H new ATOM 0 HA VAL A 84 1.236 -10.486 -2.305 1.00 0.00 H new ATOM 0 HB VAL A 84 -0.662 -8.991 -2.961 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.665 -7.638 -0.907 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.094 -9.297 -0.605 1.00 0.00 H new ATOM 0 HG13 VAL A 84 1.074 -7.957 -0.699 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -0.275 -6.563 -3.097 1.00 0.00 H new ATOM 0 HG22 VAL A 84 1.479 -6.840 -2.979 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.576 -7.440 -4.390 1.00 0.00 H new ATOM 1149 N ARG A 85 0.918 -11.129 -4.689 1.00 0.00 N ATOM 1150 CA ARG A 85 0.848 -11.583 -6.073 1.00 0.00 C ATOM 1151 C ARG A 85 -0.190 -10.784 -6.855 1.00 0.00 C ATOM 1152 O ARG A 85 -1.388 -11.057 -6.773 1.00 0.00 O ATOM 1153 CB ARG A 85 0.508 -13.073 -6.127 1.00 0.00 C ATOM 1154 CG ARG A 85 1.730 -13.978 -6.113 1.00 0.00 C ATOM 1155 CD ARG A 85 2.775 -13.517 -7.116 1.00 0.00 C ATOM 1156 NE ARG A 85 3.547 -14.634 -7.654 1.00 0.00 N ATOM 1157 CZ ARG A 85 3.093 -15.458 -8.592 1.00 0.00 C ATOM 1158 NH1 ARG A 85 1.877 -15.290 -9.093 1.00 0.00 N ATOM 1159 NH2 ARG A 85 3.855 -16.451 -9.030 1.00 0.00 N ATOM 0 H ARG A 85 0.580 -11.807 -4.006 1.00 0.00 H new ATOM 0 HA ARG A 85 1.824 -11.424 -6.531 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -0.128 -13.323 -5.278 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -0.071 -13.272 -7.029 1.00 0.00 H new ATOM 0 HG2 ARG A 85 2.164 -13.990 -5.113 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.430 -15.000 -6.342 1.00 0.00 H new ATOM 0 HD2 ARG A 85 2.285 -12.988 -7.933 1.00 0.00 H new ATOM 0 HD3 ARG A 85 3.450 -12.808 -6.637 1.00 0.00 H new ATOM 0 HE ARG A 85 4.487 -14.790 -7.289 1.00 0.00 H new ATOM 0 HH11 ARG A 85 1.288 -14.527 -8.758 1.00 0.00 H new ATOM 0 HH12 ARG A 85 1.530 -15.924 -9.813 1.00 0.00 H new ATOM 0 HH21 ARG A 85 4.791 -16.583 -8.647 1.00 0.00 H new ATOM 0 HH22 ARG A 85 3.505 -17.083 -9.750 1.00 0.00 H new ATOM 1173 N ILE A 86 0.278 -9.797 -7.612 1.00 0.00 N ATOM 1174 CA ILE A 86 -0.610 -8.960 -8.409 1.00 0.00 C ATOM 1175 C ILE A 86 -1.226 -9.751 -9.558 1.00 0.00 C ATOM 1176 O ILE A 86 -0.527 -10.173 -10.479 1.00 0.00 O ATOM 1177 CB ILE A 86 0.132 -7.738 -8.982 1.00 0.00 C ATOM 1178 CG1 ILE A 86 0.619 -6.833 -7.848 1.00 0.00 C ATOM 1179 CG2 ILE A 86 -0.772 -6.967 -9.932 1.00 0.00 C ATOM 1180 CD1 ILE A 86 1.502 -5.698 -8.318 1.00 0.00 C ATOM 0 H ILE A 86 1.266 -9.558 -7.690 1.00 0.00 H new ATOM 0 HA ILE A 86 -1.401 -8.615 -7.743 1.00 0.00 H new ATOM 0 HB ILE A 86 1.000 -8.087 -9.541 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -0.245 -6.419 -7.328 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.169 -7.435 -7.124 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -0.233 -6.106 -10.329 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -1.074 -7.616 -10.754 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.657 -6.625 -9.395 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.810 -5.098 -7.462 1.00 0.00 H new ATOM 0 HD12 ILE A 86 2.384 -6.104 -8.812 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.949 -5.073 -9.019 1.00 0.00 H new ATOM 1192 N GLN A 87 -2.540 -9.945 -9.498 1.00 0.00 N ATOM 1193 CA GLN A 87 -3.250 -10.684 -10.535 1.00 0.00 C ATOM 1194 C GLN A 87 -3.877 -9.733 -11.549 1.00 0.00 C ATOM 1195 O GLN A 87 -3.828 -9.977 -12.754 1.00 0.00 O ATOM 1196 CB GLN A 87 -4.332 -11.568 -9.911 1.00 0.00 C ATOM 1197 CG GLN A 87 -3.805 -12.512 -8.843 1.00 0.00 C ATOM 1198 CD GLN A 87 -3.351 -13.842 -9.413 1.00 0.00 C ATOM 1199 OE1 GLN A 87 -2.487 -13.893 -10.289 1.00 0.00 O ATOM 1200 NE2 GLN A 87 -3.932 -14.928 -8.916 1.00 0.00 N ATOM 0 H GLN A 87 -3.133 -9.601 -8.743 1.00 0.00 H new ATOM 0 HA GLN A 87 -2.529 -11.316 -11.054 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -5.102 -10.932 -9.474 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.810 -12.153 -10.697 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -2.971 -12.039 -8.325 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -4.584 -12.686 -8.101 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -4.644 -14.839 -8.191 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -3.667 -15.851 -9.260 1.00 0.00 H new ATOM 1209 N GLU A 88 -4.465 -8.649 -11.052 1.00 0.00 N ATOM 1210 CA GLU A 88 -5.102 -7.662 -11.916 1.00 0.00 C ATOM 1211 C GLU A 88 -4.843 -6.247 -11.409 1.00 0.00 C ATOM 1212 O GLU A 88 -4.291 -6.054 -10.324 1.00 0.00 O ATOM 1213 CB GLU A 88 -6.608 -7.919 -11.997 1.00 0.00 C ATOM 1214 CG GLU A 88 -7.007 -8.855 -13.126 1.00 0.00 C ATOM 1215 CD GLU A 88 -7.221 -8.127 -14.439 1.00 0.00 C ATOM 1216 OE1 GLU A 88 -6.238 -7.575 -14.978 1.00 0.00 O ATOM 1217 OE2 GLU A 88 -8.370 -8.108 -14.927 1.00 0.00 O ATOM 0 H GLU A 88 -4.513 -8.432 -10.056 1.00 0.00 H new ATOM 0 HA GLU A 88 -4.670 -7.757 -12.912 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -6.947 -8.340 -11.051 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -7.124 -6.967 -12.126 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.233 -9.612 -13.256 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.923 -9.379 -12.852 1.00 0.00 H new ATOM 1224 N THR A 89 -5.244 -5.258 -12.201 1.00 0.00 N ATOM 1225 CA THR A 89 -5.054 -3.860 -11.835 1.00 0.00 C ATOM 1226 C THR A 89 -6.262 -3.019 -12.230 1.00 0.00 C ATOM 1227 O THR A 89 -6.776 -3.137 -13.343 1.00 0.00 O ATOM 1228 CB THR A 89 -3.794 -3.271 -12.497 1.00 0.00 C ATOM 1229 OG1 THR A 89 -2.683 -4.154 -12.307 1.00 0.00 O ATOM 1230 CG2 THR A 89 -3.467 -1.903 -11.918 1.00 0.00 C ATOM 0 H THR A 89 -5.703 -5.399 -13.101 1.00 0.00 H new ATOM 0 HA THR A 89 -4.933 -3.831 -10.752 1.00 0.00 H new ATOM 0 HB THR A 89 -3.990 -3.158 -13.563 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.886 -3.773 -12.732 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.574 -1.508 -12.401 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.303 -1.225 -12.091 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.290 -1.994 -10.846 1.00 0.00 H new ATOM 1238 N CYS A 90 -6.712 -2.170 -11.313 1.00 0.00 N ATOM 1239 CA CYS A 90 -7.861 -1.308 -11.566 1.00 0.00 C ATOM 1240 C CYS A 90 -7.598 0.110 -11.069 1.00 0.00 C ATOM 1241 O CYS A 90 -7.063 0.308 -9.979 1.00 0.00 O ATOM 1242 CB CYS A 90 -9.109 -1.875 -10.888 1.00 0.00 C ATOM 1243 SG CYS A 90 -9.961 -3.145 -11.854 1.00 0.00 S ATOM 0 H CYS A 90 -6.298 -2.060 -10.387 1.00 0.00 H new ATOM 0 HA CYS A 90 -8.026 -1.271 -12.643 1.00 0.00 H new ATOM 0 HB2 CYS A 90 -8.826 -2.296 -9.923 1.00 0.00 H new ATOM 0 HB3 CYS A 90 -9.803 -1.059 -10.688 1.00 0.00 H new ATOM 0 HG CYS A 90 -11.002 -3.565 -11.197 1.00 0.00 H new ATOM 1249 N GLY A 91 -7.975 1.095 -11.879 1.00 0.00 N ATOM 1250 CA GLY A 91 -7.770 2.482 -11.505 1.00 0.00 C ATOM 1251 C GLY A 91 -6.456 2.699 -10.782 1.00 0.00 C ATOM 1252 O GLY A 91 -5.386 2.429 -11.329 1.00 0.00 O ATOM 0 H GLY A 91 -8.419 0.957 -12.787 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.796 3.104 -12.400 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -8.591 2.808 -10.866 1.00 0.00 H new ATOM 1256 N ASP A 92 -6.534 3.190 -9.550 1.00 0.00 N ATOM 1257 CA ASP A 92 -5.341 3.444 -8.751 1.00 0.00 C ATOM 1258 C ASP A 92 -5.238 2.451 -7.597 1.00 0.00 C ATOM 1259 O ASP A 92 -4.846 2.813 -6.488 1.00 0.00 O ATOM 1260 CB ASP A 92 -5.360 4.874 -8.209 1.00 0.00 C ATOM 1261 CG ASP A 92 -3.979 5.364 -7.820 1.00 0.00 C ATOM 1262 OD1 ASP A 92 -2.986 4.807 -8.333 1.00 0.00 O ATOM 1263 OD2 ASP A 92 -3.890 6.303 -7.002 1.00 0.00 O ATOM 0 H ASP A 92 -7.411 3.420 -9.083 1.00 0.00 H new ATOM 0 HA ASP A 92 -4.470 3.318 -9.394 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -5.779 5.540 -8.963 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -6.017 4.922 -7.341 1.00 0.00 H new ATOM 1268 N TRP A 93 -5.594 1.200 -7.867 1.00 0.00 N ATOM 1269 CA TRP A 93 -5.543 0.156 -6.850 1.00 0.00 C ATOM 1270 C TRP A 93 -5.222 -1.197 -7.476 1.00 0.00 C ATOM 1271 O TRP A 93 -5.658 -1.496 -8.588 1.00 0.00 O ATOM 1272 CB TRP A 93 -6.873 0.081 -6.099 1.00 0.00 C ATOM 1273 CG TRP A 93 -7.197 1.332 -5.340 1.00 0.00 C ATOM 1274 CD1 TRP A 93 -7.461 2.564 -5.866 1.00 0.00 C ATOM 1275 CD2 TRP A 93 -7.290 1.472 -3.918 1.00 0.00 C ATOM 1276 NE1 TRP A 93 -7.712 3.462 -4.857 1.00 0.00 N ATOM 1277 CE2 TRP A 93 -7.614 2.817 -3.652 1.00 0.00 C ATOM 1278 CE3 TRP A 93 -7.133 0.593 -2.844 1.00 0.00 C ATOM 1279 CZ2 TRP A 93 -7.782 3.300 -2.358 1.00 0.00 C ATOM 1280 CZ3 TRP A 93 -7.299 1.074 -1.559 1.00 0.00 C ATOM 1281 CH2 TRP A 93 -7.622 2.417 -1.325 1.00 0.00 C ATOM 0 H TRP A 93 -5.921 0.884 -8.780 1.00 0.00 H new ATOM 0 HA TRP A 93 -4.750 0.408 -6.146 1.00 0.00 H new ATOM 0 HB2 TRP A 93 -7.673 -0.121 -6.811 1.00 0.00 H new ATOM 0 HB3 TRP A 93 -6.844 -0.759 -5.405 1.00 0.00 H new ATOM 0 HD1 TRP A 93 -7.471 2.798 -6.920 1.00 0.00 H new ATOM 0 HE1 TRP A 93 -7.935 4.449 -4.984 1.00 0.00 H new ATOM 0 HE3 TRP A 93 -6.886 -0.444 -3.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 93 -8.030 4.335 -2.175 1.00 0.00 H new ATOM 0 HZ3 TRP A 93 -7.178 0.403 -0.721 1.00 0.00 H new ATOM 0 HH2 TRP A 93 -7.747 2.762 -0.309 1.00 0.00 H new ATOM 1292 N TYR A 94 -4.458 -2.011 -6.756 1.00 0.00 N ATOM 1293 CA TYR A 94 -4.077 -3.332 -7.243 1.00 0.00 C ATOM 1294 C TYR A 94 -5.045 -4.398 -6.739 1.00 0.00 C ATOM 1295 O TYR A 94 -5.761 -4.189 -5.760 1.00 0.00 O ATOM 1296 CB TYR A 94 -2.652 -3.670 -6.799 1.00 0.00 C ATOM 1297 CG TYR A 94 -1.584 -2.967 -7.606 1.00 0.00 C ATOM 1298 CD1 TYR A 94 -1.556 -3.064 -8.992 1.00 0.00 C ATOM 1299 CD2 TYR A 94 -0.604 -2.205 -6.983 1.00 0.00 C ATOM 1300 CE1 TYR A 94 -0.581 -2.425 -9.733 1.00 0.00 C ATOM 1301 CE2 TYR A 94 0.374 -1.561 -7.716 1.00 0.00 C ATOM 1302 CZ TYR A 94 0.381 -1.674 -9.090 1.00 0.00 C ATOM 1303 OH TYR A 94 1.353 -1.034 -9.825 1.00 0.00 O ATOM 0 H TYR A 94 -4.090 -1.780 -5.833 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.117 -3.316 -8.332 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -2.535 -3.405 -5.748 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -2.503 -4.747 -6.874 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -2.309 -3.649 -9.498 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -0.607 -2.114 -5.907 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -0.572 -2.513 -10.809 1.00 0.00 H new ATOM 0 HE2 TYR A 94 1.129 -0.972 -7.216 1.00 0.00 H new ATOM 0 HH TYR A 94 1.800 -0.366 -9.265 1.00 0.00 H new ATOM 1313 N ARG A 95 -5.060 -5.541 -7.416 1.00 0.00 N ATOM 1314 CA ARG A 95 -5.940 -6.641 -7.039 1.00 0.00 C ATOM 1315 C ARG A 95 -5.148 -7.932 -6.856 1.00 0.00 C ATOM 1316 O ARG A 95 -4.629 -8.497 -7.818 1.00 0.00 O ATOM 1317 CB ARG A 95 -7.024 -6.841 -8.099 1.00 0.00 C ATOM 1318 CG ARG A 95 -8.327 -7.391 -7.542 1.00 0.00 C ATOM 1319 CD ARG A 95 -8.351 -8.911 -7.579 1.00 0.00 C ATOM 1320 NE ARG A 95 -7.818 -9.497 -6.352 1.00 0.00 N ATOM 1321 CZ ARG A 95 -8.110 -10.725 -5.936 1.00 0.00 C ATOM 1322 NH1 ARG A 95 -8.926 -11.492 -6.646 1.00 0.00 N ATOM 1323 NH2 ARG A 95 -7.586 -11.187 -4.808 1.00 0.00 N ATOM 0 H ARG A 95 -4.473 -5.730 -8.228 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.412 -6.387 -6.090 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -7.222 -5.887 -8.588 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -6.650 -7.521 -8.865 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -8.458 -7.049 -6.515 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -9.165 -6.999 -8.118 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -9.375 -9.254 -7.729 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -7.769 -9.262 -8.431 1.00 0.00 H new ATOM 0 HE ARG A 95 -7.187 -8.933 -5.783 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.331 -11.140 -7.513 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -9.149 -12.434 -6.325 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -6.958 -10.600 -4.259 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -7.811 -12.130 -4.490 1.00 0.00 H new ATOM 1337 N GLY A 96 -5.059 -8.395 -5.612 1.00 0.00 N ATOM 1338 CA GLY A 96 -4.328 -9.615 -5.325 1.00 0.00 C ATOM 1339 C GLY A 96 -4.527 -10.088 -3.899 1.00 0.00 C ATOM 1340 O GLY A 96 -5.606 -9.924 -3.327 1.00 0.00 O ATOM 0 H GLY A 96 -5.480 -7.947 -4.798 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.649 -10.398 -6.012 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.266 -9.449 -5.505 1.00 0.00 H new ATOM 1344 N TYR A 97 -3.486 -10.679 -3.322 1.00 0.00 N ATOM 1345 CA TYR A 97 -3.553 -11.181 -1.955 1.00 0.00 C ATOM 1346 C TYR A 97 -2.158 -11.306 -1.352 1.00 0.00 C ATOM 1347 O TYR A 97 -1.152 -11.140 -2.043 1.00 0.00 O ATOM 1348 CB TYR A 97 -4.259 -12.538 -1.922 1.00 0.00 C ATOM 1349 CG TYR A 97 -3.582 -13.593 -2.767 1.00 0.00 C ATOM 1350 CD1 TYR A 97 -2.294 -14.025 -2.474 1.00 0.00 C ATOM 1351 CD2 TYR A 97 -4.230 -14.157 -3.859 1.00 0.00 C ATOM 1352 CE1 TYR A 97 -1.671 -14.989 -3.244 1.00 0.00 C ATOM 1353 CE2 TYR A 97 -3.615 -15.122 -4.634 1.00 0.00 C ATOM 1354 CZ TYR A 97 -2.336 -15.534 -4.323 1.00 0.00 C ATOM 1355 OH TYR A 97 -1.720 -16.494 -5.093 1.00 0.00 O ATOM 0 H TYR A 97 -2.586 -10.822 -3.780 1.00 0.00 H new ATOM 0 HA TYR A 97 -4.123 -10.468 -1.360 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -4.309 -12.887 -0.891 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -5.286 -12.413 -2.266 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -1.771 -13.600 -1.630 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -5.231 -13.836 -4.106 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -0.670 -15.314 -3.002 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -4.133 -15.551 -5.479 1.00 0.00 H new ATOM 0 HH TYR A 97 -2.324 -16.774 -5.812 1.00 0.00 H new ATOM 1365 N LEU A 98 -2.104 -11.601 -0.058 1.00 0.00 N ATOM 1366 CA LEU A 98 -0.832 -11.750 0.641 1.00 0.00 C ATOM 1367 C LEU A 98 -0.201 -13.105 0.340 1.00 0.00 C ATOM 1368 O LEU A 98 -0.781 -14.151 0.636 1.00 0.00 O ATOM 1369 CB LEU A 98 -1.035 -11.592 2.149 1.00 0.00 C ATOM 1370 CG LEU A 98 0.174 -11.093 2.940 1.00 0.00 C ATOM 1371 CD1 LEU A 98 0.588 -9.709 2.465 1.00 0.00 C ATOM 1372 CD2 LEU A 98 -0.133 -11.077 4.431 1.00 0.00 C ATOM 0 H LEU A 98 -2.926 -11.742 0.529 1.00 0.00 H new ATOM 0 HA LEU A 98 -0.158 -10.970 0.288 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.862 -10.901 2.314 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.339 -12.556 2.557 1.00 0.00 H new ATOM 0 HG LEU A 98 1.004 -11.778 2.768 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.450 -9.370 3.039 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.850 -9.750 1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.239 -9.013 2.607 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.739 -10.719 4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.978 -10.415 4.621 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -0.380 -12.085 4.762 1.00 0.00 H new ATOM 1384 N ILE A 99 0.991 -13.080 -0.248 1.00 0.00 N ATOM 1385 CA ILE A 99 1.702 -14.307 -0.585 1.00 0.00 C ATOM 1386 C ILE A 99 2.019 -15.120 0.665 1.00 0.00 C ATOM 1387 O ILE A 99 1.690 -16.303 0.750 1.00 0.00 O ATOM 1388 CB ILE A 99 3.013 -14.009 -1.337 1.00 0.00 C ATOM 1389 CG1 ILE A 99 2.757 -13.031 -2.485 1.00 0.00 C ATOM 1390 CG2 ILE A 99 3.629 -15.298 -1.858 1.00 0.00 C ATOM 1391 CD1 ILE A 99 4.014 -12.620 -3.220 1.00 0.00 C ATOM 0 H ILE A 99 1.484 -12.224 -0.501 1.00 0.00 H new ATOM 0 HA ILE A 99 1.044 -14.885 -1.234 1.00 0.00 H new ATOM 0 HB ILE A 99 3.716 -13.548 -0.643 1.00 0.00 H new ATOM 0 HG12 ILE A 99 2.065 -13.487 -3.193 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.269 -12.140 -2.090 1.00 0.00 H new ATOM 0 HG21 ILE A 99 4.555 -15.071 -2.387 1.00 0.00 H new ATOM 0 HG22 ILE A 99 3.843 -15.963 -1.021 1.00 0.00 H new ATOM 0 HG23 ILE A 99 2.932 -15.785 -2.540 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.757 -11.926 -4.020 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.699 -12.135 -2.525 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.492 -13.503 -3.645 1.00 0.00 H new ATOM 1403 N LYS A 100 2.659 -14.477 1.636 1.00 0.00 N ATOM 1404 CA LYS A 100 3.019 -15.138 2.884 1.00 0.00 C ATOM 1405 C LYS A 100 1.786 -15.726 3.564 1.00 0.00 C ATOM 1406 O LYS A 100 1.866 -16.757 4.232 1.00 0.00 O ATOM 1407 CB LYS A 100 3.712 -14.151 3.827 1.00 0.00 C ATOM 1408 CG LYS A 100 2.976 -12.830 3.972 1.00 0.00 C ATOM 1409 CD LYS A 100 3.708 -11.885 4.910 1.00 0.00 C ATOM 1410 CE LYS A 100 3.940 -12.519 6.272 1.00 0.00 C ATOM 1411 NZ LYS A 100 5.253 -13.219 6.343 1.00 0.00 N ATOM 0 H LYS A 100 2.939 -13.498 1.582 1.00 0.00 H new ATOM 0 HA LYS A 100 3.706 -15.951 2.650 1.00 0.00 H new ATOM 0 HB2 LYS A 100 3.813 -14.611 4.810 1.00 0.00 H new ATOM 0 HB3 LYS A 100 4.720 -13.957 3.460 1.00 0.00 H new ATOM 0 HG2 LYS A 100 2.869 -12.362 2.993 1.00 0.00 H new ATOM 0 HG3 LYS A 100 1.970 -13.012 4.350 1.00 0.00 H new ATOM 0 HD2 LYS A 100 4.665 -11.604 4.471 1.00 0.00 H new ATOM 0 HD3 LYS A 100 3.130 -10.968 5.028 1.00 0.00 H new ATOM 0 HE2 LYS A 100 3.897 -11.749 7.043 1.00 0.00 H new ATOM 0 HE3 LYS A 100 3.139 -13.227 6.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 5.108 -14.196 6.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 5.692 -13.229 5.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 5.876 -12.721 7.010 1.00 0.00 H new ATOM 1425 N HIS A 101 0.647 -15.065 3.387 1.00 0.00 N ATOM 1426 CA HIS A 101 -0.603 -15.523 3.981 1.00 0.00 C ATOM 1427 C HIS A 101 -1.743 -15.459 2.969 1.00 0.00 C ATOM 1428 O HIS A 101 -2.413 -14.435 2.837 1.00 0.00 O ATOM 1429 CB HIS A 101 -0.949 -14.680 5.209 1.00 0.00 C ATOM 1430 CG HIS A 101 0.006 -14.862 6.349 1.00 0.00 C ATOM 1431 ND1 HIS A 101 0.887 -14.003 6.912 1.00 0.00 N flip ATOM 1432 CD2 HIS A 101 0.128 -16.046 7.045 1.00 0.00 C flip ATOM 1433 CE1 HIS A 101 1.519 -14.676 7.928 1.00 0.00 C flip ATOM 1434 NE2 HIS A 101 1.043 -15.907 7.989 1.00 0.00 N flip ATOM 0 H HIS A 101 0.564 -14.210 2.837 1.00 0.00 H new ATOM 0 HA HIS A 101 -0.470 -16.561 4.287 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -0.966 -13.628 4.924 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -1.954 -14.936 5.544 1.00 0.00 H new ATOM 0 HD1 HIS A 101 1.051 -13.036 6.633 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -0.436 -16.946 6.850 1.00 0.00 H new ATOM 0 HE1 HIS A 101 2.282 -14.266 8.573 1.00 0.00 H new ATOM 1443 N LYS A 102 -1.955 -16.559 2.254 1.00 0.00 N ATOM 1444 CA LYS A 102 -3.013 -16.629 1.253 1.00 0.00 C ATOM 1445 C LYS A 102 -4.358 -16.938 1.903 1.00 0.00 C ATOM 1446 O LYS A 102 -5.174 -17.671 1.344 1.00 0.00 O ATOM 1447 CB LYS A 102 -2.683 -17.695 0.206 1.00 0.00 C ATOM 1448 CG LYS A 102 -1.682 -17.232 -0.839 1.00 0.00 C ATOM 1449 CD LYS A 102 -1.634 -18.182 -2.024 1.00 0.00 C ATOM 1450 CE LYS A 102 -0.254 -18.207 -2.663 1.00 0.00 C ATOM 1451 NZ LYS A 102 0.747 -18.883 -1.793 1.00 0.00 N ATOM 0 H LYS A 102 -1.408 -17.414 2.349 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.081 -15.657 0.764 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.288 -18.577 0.710 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -3.603 -17.999 -0.294 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.950 -16.233 -1.183 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.692 -17.160 -0.389 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -1.903 -19.187 -1.697 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -2.374 -17.879 -2.765 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -0.307 -18.721 -3.623 1.00 0.00 H new ATOM 0 HE3 LYS A 102 0.071 -17.187 -2.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 1.553 -19.198 -2.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 1.081 -18.218 -1.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.308 -19.706 -1.333 1.00 0.00 H new ATOM 1465 N MET A 103 -4.582 -16.375 3.085 1.00 0.00 N ATOM 1466 CA MET A 103 -5.830 -16.589 3.809 1.00 0.00 C ATOM 1467 C MET A 103 -6.729 -15.360 3.720 1.00 0.00 C ATOM 1468 O MET A 103 -7.877 -15.384 4.164 1.00 0.00 O ATOM 1469 CB MET A 103 -5.543 -16.921 5.275 1.00 0.00 C ATOM 1470 CG MET A 103 -5.369 -18.408 5.539 1.00 0.00 C ATOM 1471 SD MET A 103 -6.922 -19.227 5.950 1.00 0.00 S ATOM 1472 CE MET A 103 -7.959 -18.687 4.593 1.00 0.00 C ATOM 0 H MET A 103 -3.916 -15.767 3.562 1.00 0.00 H new ATOM 0 HA MET A 103 -6.349 -17.430 3.348 1.00 0.00 H new ATOM 0 HB2 MET A 103 -4.640 -16.397 5.588 1.00 0.00 H new ATOM 0 HB3 MET A 103 -6.360 -16.544 5.891 1.00 0.00 H new ATOM 0 HG2 MET A 103 -4.935 -18.881 4.658 1.00 0.00 H new ATOM 0 HG3 MET A 103 -4.662 -18.548 6.357 1.00 0.00 H new ATOM 0 HE1 MET A 103 -8.909 -19.221 4.626 1.00 0.00 H new ATOM 0 HE2 MET A 103 -8.142 -17.616 4.679 1.00 0.00 H new ATOM 0 HE3 MET A 103 -7.458 -18.895 3.647 1.00 0.00 H new ATOM 1482 N LEU A 104 -6.199 -14.286 3.145 1.00 0.00 N ATOM 1483 CA LEU A 104 -6.953 -13.046 2.998 1.00 0.00 C ATOM 1484 C LEU A 104 -6.686 -12.403 1.641 1.00 0.00 C ATOM 1485 O LEU A 104 -5.544 -12.089 1.307 1.00 0.00 O ATOM 1486 CB LEU A 104 -6.590 -12.069 4.118 1.00 0.00 C ATOM 1487 CG LEU A 104 -5.109 -11.996 4.491 1.00 0.00 C ATOM 1488 CD1 LEU A 104 -4.754 -10.608 5.001 1.00 0.00 C ATOM 1489 CD2 LEU A 104 -4.768 -13.052 5.532 1.00 0.00 C ATOM 0 H LEU A 104 -5.250 -14.249 2.773 1.00 0.00 H new ATOM 0 HA LEU A 104 -8.014 -13.286 3.063 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -6.920 -11.072 3.825 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -7.155 -12.342 5.009 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.519 -12.193 3.596 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.696 -10.576 5.261 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.959 -9.871 4.224 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.352 -10.381 5.884 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -3.710 -12.985 5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.367 -12.887 6.428 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.983 -14.042 5.130 1.00 0.00 H new ATOM 1501 N GLN A 105 -7.747 -12.210 0.864 1.00 0.00 N ATOM 1502 CA GLN A 105 -7.627 -11.604 -0.456 1.00 0.00 C ATOM 1503 C GLN A 105 -8.466 -10.334 -0.550 1.00 0.00 C ATOM 1504 O GLN A 105 -9.479 -10.195 0.134 1.00 0.00 O ATOM 1505 CB GLN A 105 -8.057 -12.596 -1.538 1.00 0.00 C ATOM 1506 CG GLN A 105 -7.451 -13.980 -1.370 1.00 0.00 C ATOM 1507 CD GLN A 105 -8.154 -15.030 -2.208 1.00 0.00 C ATOM 1508 OE1 GLN A 105 -9.382 -15.050 -2.296 1.00 0.00 O ATOM 1509 NE2 GLN A 105 -7.376 -15.910 -2.828 1.00 0.00 N ATOM 0 H GLN A 105 -8.699 -12.465 1.126 1.00 0.00 H new ATOM 0 HA GLN A 105 -6.581 -11.339 -0.612 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -9.144 -12.681 -1.530 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.775 -12.201 -2.514 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -6.397 -13.947 -1.645 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -7.497 -14.268 -0.320 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -6.363 -15.855 -2.726 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -7.792 -16.640 -3.406 1.00 0.00 H new ATOM 1518 N GLY A 106 -8.037 -9.409 -1.404 1.00 0.00 N ATOM 1519 CA GLY A 106 -8.761 -8.162 -1.572 1.00 0.00 C ATOM 1520 C GLY A 106 -8.052 -7.202 -2.506 1.00 0.00 C ATOM 1521 O GLY A 106 -7.482 -7.615 -3.516 1.00 0.00 O ATOM 0 H GLY A 106 -7.202 -9.501 -1.982 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -9.757 -8.373 -1.961 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -8.892 -7.688 -0.599 1.00 0.00 H new ATOM 1525 N ILE A 107 -8.089 -5.917 -2.170 1.00 0.00 N ATOM 1526 CA ILE A 107 -7.445 -4.895 -2.987 1.00 0.00 C ATOM 1527 C ILE A 107 -6.681 -3.900 -2.121 1.00 0.00 C ATOM 1528 O ILE A 107 -6.853 -3.860 -0.903 1.00 0.00 O ATOM 1529 CB ILE A 107 -8.472 -4.131 -3.844 1.00 0.00 C ATOM 1530 CG1 ILE A 107 -9.559 -3.524 -2.955 1.00 0.00 C ATOM 1531 CG2 ILE A 107 -9.085 -5.055 -4.885 1.00 0.00 C ATOM 1532 CD1 ILE A 107 -10.408 -2.489 -3.660 1.00 0.00 C ATOM 0 H ILE A 107 -8.558 -5.559 -1.338 1.00 0.00 H new ATOM 0 HA ILE A 107 -6.746 -5.411 -3.646 1.00 0.00 H new ATOM 0 HB ILE A 107 -7.960 -3.321 -4.363 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.204 -4.322 -2.587 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -9.091 -3.066 -2.084 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -9.809 -4.501 -5.483 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.300 -5.444 -5.534 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -9.586 -5.884 -4.386 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -11.157 -2.102 -2.970 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.774 -1.672 -4.004 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -10.905 -2.947 -4.515 1.00 0.00 H new ATOM 1544 N PHE A 108 -5.836 -3.096 -2.759 1.00 0.00 N ATOM 1545 CA PHE A 108 -5.045 -2.099 -2.047 1.00 0.00 C ATOM 1546 C PHE A 108 -4.574 -1.000 -2.996 1.00 0.00 C ATOM 1547 O PHE A 108 -4.555 -1.164 -4.216 1.00 0.00 O ATOM 1548 CB PHE A 108 -3.840 -2.759 -1.374 1.00 0.00 C ATOM 1549 CG PHE A 108 -3.339 -3.974 -2.101 1.00 0.00 C ATOM 1550 CD1 PHE A 108 -3.882 -5.223 -1.844 1.00 0.00 C ATOM 1551 CD2 PHE A 108 -2.327 -3.869 -3.040 1.00 0.00 C ATOM 1552 CE1 PHE A 108 -3.423 -6.344 -2.510 1.00 0.00 C ATOM 1553 CE2 PHE A 108 -1.863 -4.985 -3.710 1.00 0.00 C ATOM 1554 CZ PHE A 108 -2.413 -6.224 -3.445 1.00 0.00 C ATOM 0 H PHE A 108 -5.682 -3.116 -3.767 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.677 -1.648 -1.282 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -3.032 -2.031 -1.299 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -4.111 -3.040 -0.356 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -4.673 -5.322 -1.115 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -1.895 -2.902 -3.252 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -3.853 -7.312 -2.300 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -1.072 -4.889 -4.439 1.00 0.00 H new ATOM 0 HZ PHE A 108 -2.054 -7.098 -3.968 1.00 0.00 H new ATOM 1564 N PRO A 109 -4.186 0.149 -2.423 1.00 0.00 N ATOM 1565 CA PRO A 109 -3.707 1.298 -3.198 1.00 0.00 C ATOM 1566 C PRO A 109 -2.346 1.041 -3.835 1.00 0.00 C ATOM 1567 O PRO A 109 -1.397 0.645 -3.159 1.00 0.00 O ATOM 1568 CB PRO A 109 -3.607 2.413 -2.154 1.00 0.00 C ATOM 1569 CG PRO A 109 -3.415 1.703 -0.858 1.00 0.00 C ATOM 1570 CD PRO A 109 -4.182 0.414 -0.974 1.00 0.00 C ATOM 0 HA PRO A 109 -4.370 1.533 -4.031 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -2.772 3.081 -2.367 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -4.509 3.025 -2.140 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -2.358 1.513 -0.670 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -3.784 2.303 -0.026 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -3.701 -0.391 -0.419 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -5.194 0.512 -0.580 1.00 0.00 H new ATOM 1578 N LYS A 110 -2.257 1.269 -5.141 1.00 0.00 N ATOM 1579 CA LYS A 110 -1.012 1.065 -5.871 1.00 0.00 C ATOM 1580 C LYS A 110 0.102 1.938 -5.302 1.00 0.00 C ATOM 1581 O LYS A 110 1.274 1.563 -5.333 1.00 0.00 O ATOM 1582 CB LYS A 110 -1.210 1.376 -7.357 1.00 0.00 C ATOM 1583 CG LYS A 110 -2.189 0.442 -8.048 1.00 0.00 C ATOM 1584 CD LYS A 110 -2.649 1.006 -9.382 1.00 0.00 C ATOM 1585 CE LYS A 110 -1.535 0.969 -10.417 1.00 0.00 C ATOM 1586 NZ LYS A 110 -2.036 1.286 -11.783 1.00 0.00 N ATOM 0 H LYS A 110 -3.034 1.596 -5.716 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.723 0.020 -5.761 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -1.564 2.402 -7.461 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.246 1.318 -7.863 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.719 -0.529 -8.205 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -3.053 0.277 -7.404 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -3.503 0.434 -9.745 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.987 2.033 -9.247 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -0.759 1.682 -10.140 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -1.074 -0.019 -10.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -1.310 1.039 -12.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -2.900 0.739 -11.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -2.249 2.302 -11.848 1.00 0.00 H new ATOM 1600 N SER A 111 -0.272 3.102 -4.782 1.00 0.00 N ATOM 1601 CA SER A 111 0.695 4.030 -4.209 1.00 0.00 C ATOM 1602 C SER A 111 1.386 3.412 -2.996 1.00 0.00 C ATOM 1603 O SER A 111 2.369 3.951 -2.486 1.00 0.00 O ATOM 1604 CB SER A 111 0.007 5.335 -3.807 1.00 0.00 C ATOM 1605 OG SER A 111 -0.406 6.066 -4.949 1.00 0.00 O ATOM 0 H SER A 111 -1.239 3.425 -4.746 1.00 0.00 H new ATOM 0 HA SER A 111 1.449 4.244 -4.967 1.00 0.00 H new ATOM 0 HB2 SER A 111 -0.857 5.116 -3.179 1.00 0.00 H new ATOM 0 HB3 SER A 111 0.689 5.941 -3.211 1.00 0.00 H new ATOM 0 HG SER A 111 -0.845 6.895 -4.666 1.00 0.00 H new ATOM 1611 N PHE A 112 0.865 2.278 -2.540 1.00 0.00 N ATOM 1612 CA PHE A 112 1.430 1.587 -1.387 1.00 0.00 C ATOM 1613 C PHE A 112 2.247 0.376 -1.826 1.00 0.00 C ATOM 1614 O PHE A 112 3.068 -0.141 -1.067 1.00 0.00 O ATOM 1615 CB PHE A 112 0.317 1.147 -0.434 1.00 0.00 C ATOM 1616 CG PHE A 112 -0.205 2.258 0.432 1.00 0.00 C ATOM 1617 CD1 PHE A 112 -0.796 3.376 -0.135 1.00 0.00 C ATOM 1618 CD2 PHE A 112 -0.106 2.184 1.812 1.00 0.00 C ATOM 1619 CE1 PHE A 112 -1.277 4.400 0.659 1.00 0.00 C ATOM 1620 CE2 PHE A 112 -0.585 3.205 2.611 1.00 0.00 C ATOM 1621 CZ PHE A 112 -1.172 4.314 2.034 1.00 0.00 C ATOM 0 H PHE A 112 0.053 1.818 -2.951 1.00 0.00 H new ATOM 0 HA PHE A 112 2.091 2.280 -0.867 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -0.506 0.733 -1.016 1.00 0.00 H new ATOM 0 HB3 PHE A 112 0.691 0.346 0.203 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -0.882 3.448 -1.209 1.00 0.00 H new ATOM 0 HD2 PHE A 112 0.351 1.318 2.269 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -1.735 5.267 0.205 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -0.500 3.136 3.685 1.00 0.00 H new ATOM 0 HZ PHE A 112 -1.548 5.112 2.656 1.00 0.00 H new ATOM 1631 N ILE A 113 2.016 -0.072 -3.055 1.00 0.00 N ATOM 1632 CA ILE A 113 2.731 -1.222 -3.596 1.00 0.00 C ATOM 1633 C ILE A 113 3.903 -0.782 -4.466 1.00 0.00 C ATOM 1634 O ILE A 113 3.744 0.037 -5.373 1.00 0.00 O ATOM 1635 CB ILE A 113 1.799 -2.124 -4.427 1.00 0.00 C ATOM 1636 CG1 ILE A 113 0.615 -2.592 -3.578 1.00 0.00 C ATOM 1637 CG2 ILE A 113 2.568 -3.317 -4.975 1.00 0.00 C ATOM 1638 CD1 ILE A 113 1.022 -3.405 -2.369 1.00 0.00 C ATOM 0 H ILE A 113 1.339 0.344 -3.695 1.00 0.00 H new ATOM 0 HA ILE A 113 3.107 -1.789 -2.744 1.00 0.00 H new ATOM 0 HB ILE A 113 1.414 -1.547 -5.267 1.00 0.00 H new ATOM 0 HG12 ILE A 113 0.049 -1.721 -3.246 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -0.053 -3.189 -4.199 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.896 -3.945 -5.560 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.381 -2.965 -5.610 1.00 0.00 H new ATOM 0 HG23 ILE A 113 2.978 -3.896 -4.148 1.00 0.00 H new ATOM 0 HD11 ILE A 113 0.132 -3.703 -1.814 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.562 -4.295 -2.694 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.666 -2.804 -1.727 1.00 0.00 H new ATOM 1650 N HIS A 114 5.080 -1.331 -4.186 1.00 0.00 N ATOM 1651 CA HIS A 114 6.280 -0.996 -4.945 1.00 0.00 C ATOM 1652 C HIS A 114 6.557 -2.048 -6.015 1.00 0.00 C ATOM 1653 O HIS A 114 7.085 -3.121 -5.721 1.00 0.00 O ATOM 1654 CB HIS A 114 7.483 -0.874 -4.010 1.00 0.00 C ATOM 1655 CG HIS A 114 8.754 -0.508 -4.713 1.00 0.00 C ATOM 1656 ND1 HIS A 114 8.914 0.667 -5.417 1.00 0.00 N ATOM 1657 CD2 HIS A 114 9.930 -1.170 -4.818 1.00 0.00 C ATOM 1658 CE1 HIS A 114 10.132 0.711 -5.925 1.00 0.00 C ATOM 1659 NE2 HIS A 114 10.770 -0.391 -5.576 1.00 0.00 N ATOM 0 H HIS A 114 5.229 -2.010 -3.439 1.00 0.00 H new ATOM 0 HA HIS A 114 6.113 -0.038 -5.437 1.00 0.00 H new ATOM 0 HB2 HIS A 114 7.268 -0.122 -3.251 1.00 0.00 H new ATOM 0 HB3 HIS A 114 7.625 -1.821 -3.489 1.00 0.00 H new ATOM 0 HD2 HIS A 114 10.164 -2.132 -4.386 1.00 0.00 H new ATOM 0 HE1 HIS A 114 10.538 1.513 -6.524 1.00 0.00 H new ATOM 0 HE2 HIS A 114 11.730 -0.626 -5.828 1.00 0.00 H new ATOM 1668 N ILE A 115 6.197 -1.734 -7.254 1.00 0.00 N ATOM 1669 CA ILE A 115 6.407 -2.652 -8.366 1.00 0.00 C ATOM 1670 C ILE A 115 7.891 -2.798 -8.686 1.00 0.00 C ATOM 1671 O ILE A 115 8.484 -1.939 -9.338 1.00 0.00 O ATOM 1672 CB ILE A 115 5.664 -2.184 -9.632 1.00 0.00 C ATOM 1673 CG1 ILE A 115 4.177 -1.989 -9.333 1.00 0.00 C ATOM 1674 CG2 ILE A 115 5.857 -3.185 -10.760 1.00 0.00 C ATOM 1675 CD1 ILE A 115 3.431 -3.285 -9.103 1.00 0.00 C ATOM 0 H ILE A 115 5.758 -0.850 -7.513 1.00 0.00 H new ATOM 0 HA ILE A 115 6.007 -3.618 -8.057 1.00 0.00 H new ATOM 0 HB ILE A 115 6.080 -1.227 -9.948 1.00 0.00 H new ATOM 0 HG12 ILE A 115 4.072 -1.357 -8.451 1.00 0.00 H new ATOM 0 HG13 ILE A 115 3.715 -1.456 -10.164 1.00 0.00 H new ATOM 0 HG21 ILE A 115 5.326 -2.840 -11.647 1.00 0.00 H new ATOM 0 HG22 ILE A 115 6.919 -3.278 -10.986 1.00 0.00 H new ATOM 0 HG23 ILE A 115 5.464 -4.155 -10.456 1.00 0.00 H new ATOM 0 HD11 ILE A 115 2.383 -3.070 -8.897 1.00 0.00 H new ATOM 0 HD12 ILE A 115 3.505 -3.910 -9.993 1.00 0.00 H new ATOM 0 HD13 ILE A 115 3.868 -3.810 -8.253 1.00 0.00 H new ATOM 1687 N LYS A 116 8.486 -3.892 -8.224 1.00 0.00 N ATOM 1688 CA LYS A 116 9.900 -4.154 -8.462 1.00 0.00 C ATOM 1689 C LYS A 116 10.167 -4.394 -9.945 1.00 0.00 C ATOM 1690 O LYS A 116 10.261 -5.537 -10.390 1.00 0.00 O ATOM 1691 CB LYS A 116 10.360 -5.366 -7.648 1.00 0.00 C ATOM 1692 CG LYS A 116 10.227 -5.175 -6.147 1.00 0.00 C ATOM 1693 CD LYS A 116 10.461 -6.476 -5.398 1.00 0.00 C ATOM 1694 CE LYS A 116 11.928 -6.658 -5.040 1.00 0.00 C ATOM 1695 NZ LYS A 116 12.281 -8.093 -4.857 1.00 0.00 N ATOM 0 H LYS A 116 8.010 -4.613 -7.682 1.00 0.00 H new ATOM 0 HA LYS A 116 10.464 -3.276 -8.146 1.00 0.00 H new ATOM 0 HB2 LYS A 116 9.778 -6.237 -7.948 1.00 0.00 H new ATOM 0 HB3 LYS A 116 11.401 -5.581 -7.888 1.00 0.00 H new ATOM 0 HG2 LYS A 116 10.943 -4.426 -5.810 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.233 -4.794 -5.914 1.00 0.00 H new ATOM 0 HD2 LYS A 116 9.860 -6.487 -4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 116 10.128 -7.314 -6.010 1.00 0.00 H new ATOM 0 HE2 LYS A 116 12.549 -6.229 -5.826 1.00 0.00 H new ATOM 0 HE3 LYS A 116 12.149 -6.110 -4.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.289 -8.174 -4.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 11.706 -8.497 -4.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 12.095 -8.612 -5.739 1.00 0.00 H new ATOM 1709 N GLU A 117 10.288 -3.309 -10.703 1.00 0.00 N ATOM 1710 CA GLU A 117 10.544 -3.403 -12.136 1.00 0.00 C ATOM 1711 C GLU A 117 11.931 -2.864 -12.477 1.00 0.00 C ATOM 1712 O GLU A 117 12.084 -2.038 -13.376 1.00 0.00 O ATOM 1713 CB GLU A 117 9.479 -2.632 -12.919 1.00 0.00 C ATOM 1714 CG GLU A 117 9.224 -3.190 -14.309 1.00 0.00 C ATOM 1715 CD GLU A 117 8.193 -4.303 -14.311 1.00 0.00 C ATOM 1716 OE1 GLU A 117 8.061 -4.990 -13.277 1.00 0.00 O ATOM 1717 OE2 GLU A 117 7.520 -4.486 -15.346 1.00 0.00 O ATOM 0 H GLU A 117 10.213 -2.355 -10.349 1.00 0.00 H new ATOM 0 HA GLU A 117 10.502 -4.455 -12.418 1.00 0.00 H new ATOM 0 HB2 GLU A 117 8.546 -2.643 -12.355 1.00 0.00 H new ATOM 0 HB3 GLU A 117 9.787 -1.590 -13.006 1.00 0.00 H new ATOM 0 HG2 GLU A 117 8.886 -2.386 -14.963 1.00 0.00 H new ATOM 0 HG3 GLU A 117 10.160 -3.566 -14.723 1.00 0.00 H new ATOM 1724 N VAL A 118 12.938 -3.338 -11.751 1.00 0.00 N ATOM 1725 CA VAL A 118 14.312 -2.906 -11.975 1.00 0.00 C ATOM 1726 C VAL A 118 14.833 -3.407 -13.318 1.00 0.00 C ATOM 1727 O VAL A 118 15.598 -2.719 -13.996 1.00 0.00 O ATOM 1728 CB VAL A 118 15.247 -3.403 -10.857 1.00 0.00 C ATOM 1729 CG1 VAL A 118 14.925 -2.707 -9.543 1.00 0.00 C ATOM 1730 CG2 VAL A 118 15.145 -4.913 -10.709 1.00 0.00 C ATOM 0 H VAL A 118 12.828 -4.022 -11.002 1.00 0.00 H new ATOM 0 HA VAL A 118 14.305 -1.816 -11.974 1.00 0.00 H new ATOM 0 HB VAL A 118 16.273 -3.157 -11.129 1.00 0.00 H new ATOM 0 HG11 VAL A 118 15.596 -3.071 -8.765 1.00 0.00 H new ATOM 0 HG12 VAL A 118 15.055 -1.631 -9.660 1.00 0.00 H new ATOM 0 HG13 VAL A 118 13.894 -2.920 -9.262 1.00 0.00 H new ATOM 0 HG21 VAL A 118 15.813 -5.247 -9.915 1.00 0.00 H new ATOM 0 HG22 VAL A 118 14.120 -5.186 -10.460 1.00 0.00 H new ATOM 0 HG23 VAL A 118 15.430 -5.391 -11.647 1.00 0.00 H new ATOM 1740 N THR A 119 14.414 -4.610 -13.698 1.00 0.00 N ATOM 1741 CA THR A 119 14.838 -5.204 -14.959 1.00 0.00 C ATOM 1742 C THR A 119 16.294 -4.869 -15.262 1.00 0.00 C ATOM 1743 O THR A 119 16.661 -4.631 -16.413 1.00 0.00 O ATOM 1744 CB THR A 119 13.959 -4.725 -16.130 1.00 0.00 C ATOM 1745 OG1 THR A 119 14.326 -5.412 -17.331 1.00 0.00 O ATOM 1746 CG2 THR A 119 14.100 -3.225 -16.334 1.00 0.00 C ATOM 0 H THR A 119 13.781 -5.192 -13.150 1.00 0.00 H new ATOM 0 HA THR A 119 14.730 -6.283 -14.852 1.00 0.00 H new ATOM 0 HB THR A 119 12.919 -4.946 -15.889 1.00 0.00 H new ATOM 0 HG1 THR A 119 15.301 -5.395 -17.433 1.00 0.00 H new ATOM 0 HG21 THR A 119 13.470 -2.910 -17.166 1.00 0.00 H new ATOM 0 HG22 THR A 119 13.791 -2.704 -15.428 1.00 0.00 H new ATOM 0 HG23 THR A 119 15.140 -2.984 -16.555 1.00 0.00 H new TER 1754 THR A 119