USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 999 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 23 ASN : amide:sc= -0.732 K(o=-1.5,f=-3.8!) USER MOD Set 1.2: A 101 HIS : no HD1:sc= -0.763 K(o=-1.5,f=-5.2!) USER MOD Set 2.1: A 16 GLN : amide:sc= -2.18! K(o=-1.9!,f=-5.1) USER MOD Set 2.2: A 20 THR OG1 : rot -24:sc= 0.461 USER MOD Set 2.3: A 98 HIS : no HD1:sc= -0.13 K(o=-1.9,f=-3) USER MOD Set 3.1: A 82 SER OG : rot -74:sc= 0.397 USER MOD Set 3.2: A 83 HIS : no HD1:sc= 0.339 K(o=0.74,f=-0.013) USER MOD Set 4.1: A 53 THR OG1 : rot -5:sc= 0.647 USER MOD Set 4.2: A 69 LYS NZ :NH3+ -161:sc= 1.72 (180deg=0.447) USER MOD Set 5.1: A 42 TYR OH : rot 180:sc= 0.348 USER MOD Set 5.2: A 54 SER OG : rot -55:sc= -0.257 USER MOD Set 5.3: A 57 LYS NZ :NH3+ -179:sc= 1.67 (180deg=0.511) USER MOD Set 6.1: A 17 TYR OH : rot -75:sc= 0.118 USER MOD Set 6.2: A 21 GLN : amide:sc= 0.144 X(o=0.26,f=0.2) USER MOD Single : A 8 LYS NZ :NH3+ -167:sc= -0.0333 (180deg=-0.223) USER MOD Single : A 10 LYS NZ :NH3+ -178:sc= 0.429 (180deg=0.421) USER MOD Single : A 11 SER OG : rot -81:sc= 0.569 USER MOD Single : A 13 ASN : amide:sc= -0.451 X(o=-0.45,f=-0.23) USER MOD Single : A 15 MET CE :methyl -123:sc= -0.101 (180deg=-0.413) USER MOD Single : A 22 ASN : amide:sc= -0.0135 X(o=-0.014,f=-0.0065) USER MOD Single : A 25 THR OG1 : rot -84:sc= 0.33 USER MOD Single : A 37 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0496) USER MOD Single : A 47 SER OG : rot 160:sc= -1.2 USER MOD Single : A 49 LYS NZ :NH3+ -123:sc= 0.326 (180deg=0.157) USER MOD Single : A 55 LYS NZ :NH3+ -126:sc= 1.3 (180deg=-0.682) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0.00573 X(o=0.0057,f=-0.16) USER MOD Single : A 62 CYS SG : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 20:sc= 0.0813 USER MOD Single : A 68 THR OG1 : rot 68:sc= -1.44! USER MOD Single : A 78 LYS NZ :NH3+ 152:sc= -0.518 (180deg=-2.09!) USER MOD Single : A 81 THR OG1 : rot 45:sc= 0.41 USER MOD Single : A 85 MET CE :methyl -173:sc=-0.00595 (180deg=-0.0974) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 72:sc= 0.101 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0.0143 USER MOD Single : A 104 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.084) USER MOD Single : A 110 ASN : amide:sc= -1.38! K(o=-1.4!,f=0) USER MOD Single : A 114 TYR OH : rot 56:sc= 1.23 USER MOD Single : A 115 CYS SG : rot 180:sc= -0.155 USER MOD Single : A 117 ASN : amide:sc= -2.85! C(o=-2.9!,f=-4.3!) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ -167:sc= 0.135 (180deg=0.0921) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 128 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.023) USER MOD Single : A 130 LYS NZ :NH3+ 160:sc= 1.05 (180deg=0.791) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot -179:sc= 1.22 USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 142 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 87 N GLU A 6 -15.334 10.654 12.072 1.00 0.00 N ATOM 88 CA GLU A 6 -15.043 11.937 11.406 1.00 0.00 C ATOM 89 C GLU A 6 -13.646 12.457 11.817 1.00 0.00 C ATOM 90 O GLU A 6 -12.854 12.875 10.972 1.00 0.00 O ATOM 91 CB GLU A 6 -16.152 12.975 11.752 1.00 0.00 C ATOM 92 CG GLU A 6 -17.606 12.486 11.514 1.00 0.00 C ATOM 93 CD GLU A 6 -17.870 11.963 10.084 1.00 0.00 C ATOM 94 OE1 GLU A 6 -18.044 12.784 9.154 1.00 0.00 O ATOM 95 OE2 GLU A 6 -17.903 10.726 9.882 1.00 0.00 O ATOM 0 HA GLU A 6 -15.036 11.785 10.327 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -16.047 13.260 12.799 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -15.985 13.874 11.158 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.832 11.693 12.227 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.292 13.307 11.722 1.00 0.00 H new ATOM 102 N GLU A 7 -13.376 12.412 13.131 1.00 0.00 N ATOM 103 CA GLU A 7 -12.072 12.791 13.721 1.00 0.00 C ATOM 104 C GLU A 7 -10.937 11.855 13.261 1.00 0.00 C ATOM 105 O GLU A 7 -9.803 12.305 13.045 1.00 0.00 O ATOM 106 CB GLU A 7 -12.186 12.782 15.264 1.00 0.00 C ATOM 107 CG GLU A 7 -13.233 13.766 15.835 1.00 0.00 C ATOM 108 CD GLU A 7 -12.848 15.238 15.625 1.00 0.00 C ATOM 109 OE1 GLU A 7 -12.031 15.758 16.413 1.00 0.00 O ATOM 110 OE2 GLU A 7 -13.335 15.877 14.666 1.00 0.00 O ATOM 0 H GLU A 7 -14.060 12.109 13.825 1.00 0.00 H new ATOM 0 HA GLU A 7 -11.820 13.793 13.375 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -12.438 11.773 15.591 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -11.211 13.021 15.689 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -14.197 13.577 15.363 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -13.358 13.577 16.901 1.00 0.00 H new ATOM 117 N LYS A 8 -11.269 10.556 13.106 1.00 0.00 N ATOM 118 CA LYS A 8 -10.329 9.522 12.638 1.00 0.00 C ATOM 119 C LYS A 8 -9.861 9.849 11.216 1.00 0.00 C ATOM 120 O LYS A 8 -8.678 10.007 10.979 1.00 0.00 O ATOM 121 CB LYS A 8 -11.005 8.116 12.673 1.00 0.00 C ATOM 122 CG LYS A 8 -10.231 6.995 11.925 1.00 0.00 C ATOM 123 CD LYS A 8 -10.985 5.644 11.912 1.00 0.00 C ATOM 124 CE LYS A 8 -11.110 5.012 13.310 1.00 0.00 C ATOM 125 NZ LYS A 8 -9.774 4.774 13.926 1.00 0.00 N ATOM 0 H LYS A 8 -12.203 10.196 13.304 1.00 0.00 H new ATOM 0 HA LYS A 8 -9.465 9.506 13.302 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.132 7.817 13.713 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -12.002 8.198 12.241 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -10.046 7.312 10.898 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -9.258 6.857 12.396 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -11.982 5.794 11.497 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -10.465 4.950 11.251 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -11.697 5.666 13.954 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -11.651 4.068 13.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -9.879 4.156 14.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.148 4.318 13.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.361 5.682 14.221 1.00 0.00 H new ATOM 139 N ILE A 9 -10.837 9.965 10.302 1.00 0.00 N ATOM 140 CA ILE A 9 -10.600 10.220 8.870 1.00 0.00 C ATOM 141 C ILE A 9 -9.861 11.556 8.647 1.00 0.00 C ATOM 142 O ILE A 9 -8.986 11.647 7.797 1.00 0.00 O ATOM 143 CB ILE A 9 -11.965 10.168 8.067 1.00 0.00 C ATOM 144 CG1 ILE A 9 -12.616 8.742 8.179 1.00 0.00 C ATOM 145 CG2 ILE A 9 -11.793 10.585 6.585 1.00 0.00 C ATOM 146 CD1 ILE A 9 -11.747 7.595 7.683 1.00 0.00 C ATOM 0 H ILE A 9 -11.826 9.884 10.538 1.00 0.00 H new ATOM 0 HA ILE A 9 -9.951 9.432 8.487 1.00 0.00 H new ATOM 0 HB ILE A 9 -12.636 10.896 8.522 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -12.873 8.558 9.222 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -13.549 8.740 7.616 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -12.757 10.533 6.078 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -11.412 11.605 6.536 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -11.089 9.911 6.097 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -12.284 6.654 7.802 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -11.510 7.747 6.630 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -10.824 7.562 8.261 1.00 0.00 H new ATOM 158 N LYS A 10 -10.197 12.566 9.450 1.00 0.00 N ATOM 159 CA LYS A 10 -9.555 13.893 9.405 1.00 0.00 C ATOM 160 C LYS A 10 -8.044 13.809 9.726 1.00 0.00 C ATOM 161 O LYS A 10 -7.211 14.230 8.913 1.00 0.00 O ATOM 162 CB LYS A 10 -10.306 14.849 10.382 1.00 0.00 C ATOM 163 CG LYS A 10 -9.617 16.219 10.686 1.00 0.00 C ATOM 164 CD LYS A 10 -9.049 16.305 12.133 1.00 0.00 C ATOM 165 CE LYS A 10 -10.146 16.168 13.204 1.00 0.00 C ATOM 166 NZ LYS A 10 -9.622 16.300 14.582 1.00 0.00 N ATOM 0 H LYS A 10 -10.928 12.492 10.158 1.00 0.00 H new ATOM 0 HA LYS A 10 -9.625 14.292 8.393 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -11.295 15.049 9.970 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -10.454 14.325 11.326 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -8.808 16.379 9.974 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -10.337 17.023 10.536 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -8.306 15.520 12.276 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -8.536 17.258 12.263 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -10.909 16.928 13.036 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -10.633 15.199 13.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -10.397 16.166 15.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -8.889 15.580 14.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -9.211 17.247 14.708 1.00 0.00 H new ATOM 180 N SER A 11 -7.712 13.230 10.894 1.00 0.00 N ATOM 181 CA SER A 11 -6.312 13.105 11.361 1.00 0.00 C ATOM 182 C SER A 11 -5.506 12.205 10.405 1.00 0.00 C ATOM 183 O SER A 11 -4.372 12.536 10.029 1.00 0.00 O ATOM 184 CB SER A 11 -6.279 12.545 12.801 1.00 0.00 C ATOM 185 OG SER A 11 -7.014 11.340 12.903 1.00 0.00 O ATOM 0 H SER A 11 -8.398 12.837 11.539 1.00 0.00 H new ATOM 0 HA SER A 11 -5.853 14.093 11.366 1.00 0.00 H new ATOM 0 HB2 SER A 11 -5.246 12.369 13.101 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.690 13.283 13.490 1.00 0.00 H new ATOM 0 HG SER A 11 -7.968 11.545 12.991 1.00 0.00 H new ATOM 191 N LEU A 12 -6.122 11.059 10.051 1.00 0.00 N ATOM 192 CA LEU A 12 -5.625 10.100 9.045 1.00 0.00 C ATOM 193 C LEU A 12 -5.219 10.783 7.728 1.00 0.00 C ATOM 194 O LEU A 12 -4.079 10.671 7.310 1.00 0.00 O ATOM 195 CB LEU A 12 -6.724 9.028 8.776 1.00 0.00 C ATOM 196 CG LEU A 12 -6.556 8.116 7.522 1.00 0.00 C ATOM 197 CD1 LEU A 12 -5.233 7.316 7.566 1.00 0.00 C ATOM 198 CD2 LEU A 12 -7.807 7.216 7.352 1.00 0.00 C ATOM 0 H LEU A 12 -7.005 10.767 10.470 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.727 9.631 9.446 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.786 8.384 9.653 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.681 9.543 8.690 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.483 8.745 6.635 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.154 6.693 6.675 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -4.391 8.007 7.601 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.220 6.683 8.453 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -7.682 6.582 6.474 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.929 6.591 8.237 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.691 7.841 7.225 1.00 0.00 H new ATOM 210 N ASN A 13 -6.160 11.491 7.101 1.00 0.00 N ATOM 211 CA ASN A 13 -5.963 12.072 5.756 1.00 0.00 C ATOM 212 C ASN A 13 -4.893 13.166 5.764 1.00 0.00 C ATOM 213 O ASN A 13 -4.240 13.369 4.755 1.00 0.00 O ATOM 214 CB ASN A 13 -7.316 12.584 5.169 1.00 0.00 C ATOM 215 CG ASN A 13 -8.081 11.475 4.435 1.00 0.00 C ATOM 216 OD1 ASN A 13 -8.051 11.395 3.203 1.00 0.00 O ATOM 217 ND2 ASN A 13 -8.698 10.570 5.178 1.00 0.00 N ATOM 0 H ASN A 13 -7.078 11.682 7.502 1.00 0.00 H new ATOM 0 HA ASN A 13 -5.597 11.282 5.100 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -7.935 12.979 5.975 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -7.124 13.408 4.482 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -9.166 9.779 4.735 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -8.706 10.663 6.194 1.00 0.00 H new ATOM 224 N ARG A 14 -4.728 13.858 6.905 1.00 0.00 N ATOM 225 CA ARG A 14 -3.622 14.817 7.097 1.00 0.00 C ATOM 226 C ARG A 14 -2.250 14.107 7.052 1.00 0.00 C ATOM 227 O ARG A 14 -1.414 14.430 6.205 1.00 0.00 O ATOM 228 CB ARG A 14 -3.788 15.575 8.439 1.00 0.00 C ATOM 229 CG ARG A 14 -2.743 16.690 8.672 1.00 0.00 C ATOM 230 CD ARG A 14 -2.948 17.423 10.001 1.00 0.00 C ATOM 231 NE ARG A 14 -2.015 18.550 10.153 1.00 0.00 N ATOM 232 CZ ARG A 14 -1.806 19.228 11.288 1.00 0.00 C ATOM 233 NH1 ARG A 14 -2.368 18.839 12.431 1.00 0.00 N ATOM 234 NH2 ARG A 14 -1.022 20.289 11.276 1.00 0.00 N ATOM 0 H ARG A 14 -5.347 13.772 7.711 1.00 0.00 H new ATOM 0 HA ARG A 14 -3.659 15.536 6.278 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -4.785 16.014 8.474 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -3.726 14.858 9.258 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -1.743 16.256 8.652 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -2.795 17.408 7.854 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -3.973 17.789 10.060 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -2.811 16.724 10.826 1.00 0.00 H new ATOM 0 HE ARG A 14 -1.486 18.837 9.329 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -2.967 18.014 12.450 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -2.199 19.366 13.288 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -0.580 20.587 10.406 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -0.857 20.811 12.137 1.00 0.00 H new ATOM 248 N MET A 15 -2.070 13.105 7.944 1.00 0.00 N ATOM 249 CA MET A 15 -0.767 12.434 8.169 1.00 0.00 C ATOM 250 C MET A 15 -0.377 11.583 6.955 1.00 0.00 C ATOM 251 O MET A 15 0.774 11.568 6.551 1.00 0.00 O ATOM 252 CB MET A 15 -0.752 11.563 9.468 1.00 0.00 C ATOM 253 CG MET A 15 -1.715 10.361 9.493 1.00 0.00 C ATOM 254 SD MET A 15 -1.505 9.300 10.946 1.00 0.00 S ATOM 255 CE MET A 15 0.117 8.577 10.663 1.00 0.00 C ATOM 0 H MET A 15 -2.822 12.739 8.527 1.00 0.00 H new ATOM 0 HA MET A 15 -0.030 13.225 8.305 1.00 0.00 H new ATOM 0 HB2 MET A 15 0.262 11.193 9.620 1.00 0.00 H new ATOM 0 HB3 MET A 15 -0.987 12.207 10.315 1.00 0.00 H new ATOM 0 HG2 MET A 15 -2.741 10.727 9.465 1.00 0.00 H new ATOM 0 HG3 MET A 15 -1.564 9.765 8.593 1.00 0.00 H new ATOM 0 HE1 MET A 15 0.035 7.490 10.660 1.00 0.00 H new ATOM 0 HE2 MET A 15 0.503 8.915 9.701 1.00 0.00 H new ATOM 0 HE3 MET A 15 0.797 8.887 11.456 1.00 0.00 H new ATOM 265 N GLN A 16 -1.366 10.886 6.387 1.00 0.00 N ATOM 266 CA GLN A 16 -1.187 10.037 5.209 1.00 0.00 C ATOM 267 C GLN A 16 -0.819 10.883 3.983 1.00 0.00 C ATOM 268 O GLN A 16 0.176 10.611 3.337 1.00 0.00 O ATOM 269 CB GLN A 16 -2.476 9.234 4.930 1.00 0.00 C ATOM 270 CG GLN A 16 -2.367 8.243 3.767 1.00 0.00 C ATOM 271 CD GLN A 16 -3.689 7.568 3.453 1.00 0.00 C ATOM 272 OE1 GLN A 16 -4.446 8.049 2.622 1.00 0.00 O ATOM 273 NE2 GLN A 16 -4.000 6.489 4.153 1.00 0.00 N ATOM 0 H GLN A 16 -2.324 10.897 6.738 1.00 0.00 H new ATOM 0 HA GLN A 16 -0.371 9.342 5.407 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.751 8.687 5.832 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.286 9.933 4.721 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -2.010 8.767 2.880 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -1.624 7.484 4.009 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -3.341 6.118 4.838 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -4.899 6.028 4.008 1.00 0.00 H new ATOM 282 N TYR A 17 -1.638 11.916 3.695 1.00 0.00 N ATOM 283 CA TYR A 17 -1.433 12.783 2.504 1.00 0.00 C ATOM 284 C TYR A 17 -0.043 13.446 2.525 1.00 0.00 C ATOM 285 O TYR A 17 0.676 13.393 1.520 1.00 0.00 O ATOM 286 CB TYR A 17 -2.527 13.867 2.354 1.00 0.00 C ATOM 287 CG TYR A 17 -2.360 14.750 1.102 1.00 0.00 C ATOM 288 CD1 TYR A 17 -2.723 14.279 -0.161 1.00 0.00 C ATOM 289 CD2 TYR A 17 -1.812 16.039 1.177 1.00 0.00 C ATOM 290 CE1 TYR A 17 -2.552 15.054 -1.294 1.00 0.00 C ATOM 291 CE2 TYR A 17 -1.644 16.816 0.045 1.00 0.00 C ATOM 292 CZ TYR A 17 -2.015 16.320 -1.189 1.00 0.00 C ATOM 293 OH TYR A 17 -1.851 17.089 -2.322 1.00 0.00 O ATOM 0 H TYR A 17 -2.444 12.173 4.264 1.00 0.00 H new ATOM 0 HA TYR A 17 -1.502 12.123 1.640 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -3.503 13.383 2.318 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -2.519 14.503 3.239 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -3.146 13.290 -0.255 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -1.515 16.433 2.138 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -2.839 14.668 -2.261 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.224 17.808 0.126 1.00 0.00 H new ATOM 0 HH TYR A 17 -1.082 16.760 -2.832 1.00 0.00 H new ATOM 303 N GLU A 18 0.336 14.045 3.675 1.00 0.00 N ATOM 304 CA GLU A 18 1.643 14.739 3.807 1.00 0.00 C ATOM 305 C GLU A 18 2.832 13.751 3.665 1.00 0.00 C ATOM 306 O GLU A 18 3.935 14.149 3.285 1.00 0.00 O ATOM 307 CB GLU A 18 1.732 15.501 5.154 1.00 0.00 C ATOM 308 CG GLU A 18 1.773 14.599 6.392 1.00 0.00 C ATOM 309 CD GLU A 18 1.844 15.375 7.710 1.00 0.00 C ATOM 310 OE1 GLU A 18 2.956 15.766 8.113 1.00 0.00 O ATOM 311 OE2 GLU A 18 0.791 15.607 8.336 1.00 0.00 O ATOM 0 H GLU A 18 -0.236 14.064 4.519 1.00 0.00 H new ATOM 0 HA GLU A 18 1.710 15.462 2.994 1.00 0.00 H new ATOM 0 HB2 GLU A 18 2.625 16.126 5.145 1.00 0.00 H new ATOM 0 HB3 GLU A 18 0.876 16.170 5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.886 13.965 6.400 1.00 0.00 H new ATOM 0 HG3 GLU A 18 2.637 13.938 6.322 1.00 0.00 H new ATOM 318 N VAL A 19 2.575 12.461 3.956 1.00 0.00 N ATOM 319 CA VAL A 19 3.570 11.390 3.797 1.00 0.00 C ATOM 320 C VAL A 19 3.705 11.046 2.303 1.00 0.00 C ATOM 321 O VAL A 19 4.772 11.190 1.737 1.00 0.00 O ATOM 322 CB VAL A 19 3.194 10.114 4.658 1.00 0.00 C ATOM 323 CG1 VAL A 19 3.867 8.827 4.142 1.00 0.00 C ATOM 324 CG2 VAL A 19 3.546 10.331 6.147 1.00 0.00 C ATOM 0 H VAL A 19 1.674 12.136 4.307 1.00 0.00 H new ATOM 0 HA VAL A 19 4.533 11.740 4.169 1.00 0.00 H new ATOM 0 HB VAL A 19 2.117 9.982 4.556 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.573 7.986 4.770 1.00 0.00 H new ATOM 0 HG12 VAL A 19 3.554 8.640 3.115 1.00 0.00 H new ATOM 0 HG13 VAL A 19 4.950 8.944 4.176 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.279 9.442 6.717 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.616 10.517 6.245 1.00 0.00 H new ATOM 0 HG23 VAL A 19 2.992 11.188 6.531 1.00 0.00 H new ATOM 334 N THR A 20 2.592 10.637 1.686 1.00 0.00 N ATOM 335 CA THR A 20 2.532 10.193 0.273 1.00 0.00 C ATOM 336 C THR A 20 3.048 11.263 -0.711 1.00 0.00 C ATOM 337 O THR A 20 3.696 10.938 -1.714 1.00 0.00 O ATOM 338 CB THR A 20 1.064 9.805 -0.112 1.00 0.00 C ATOM 339 OG1 THR A 20 0.214 10.965 -0.082 1.00 0.00 O ATOM 340 CG2 THR A 20 0.493 8.757 0.849 1.00 0.00 C ATOM 0 H THR A 20 1.687 10.601 2.155 1.00 0.00 H new ATOM 0 HA THR A 20 3.186 9.325 0.192 1.00 0.00 H new ATOM 0 HB THR A 20 1.094 9.388 -1.119 1.00 0.00 H new ATOM 0 HG1 THR A 20 0.599 11.637 0.519 1.00 0.00 H new ATOM 0 HG21 THR A 20 -0.527 8.510 0.554 1.00 0.00 H new ATOM 0 HG22 THR A 20 1.109 7.858 0.815 1.00 0.00 H new ATOM 0 HG23 THR A 20 0.490 9.156 1.863 1.00 0.00 H new ATOM 348 N GLN A 21 2.776 12.536 -0.385 1.00 0.00 N ATOM 349 CA GLN A 21 3.057 13.676 -1.278 1.00 0.00 C ATOM 350 C GLN A 21 4.541 14.094 -1.188 1.00 0.00 C ATOM 351 O GLN A 21 5.151 14.476 -2.190 1.00 0.00 O ATOM 352 CB GLN A 21 2.111 14.861 -0.932 1.00 0.00 C ATOM 353 CG GLN A 21 2.185 16.077 -1.880 1.00 0.00 C ATOM 354 CD GLN A 21 1.845 15.734 -3.335 1.00 0.00 C ATOM 355 OE1 GLN A 21 0.684 15.787 -3.743 1.00 0.00 O ATOM 356 NE2 GLN A 21 2.848 15.372 -4.121 1.00 0.00 N ATOM 0 H GLN A 21 2.355 12.806 0.504 1.00 0.00 H new ATOM 0 HA GLN A 21 2.868 13.374 -2.308 1.00 0.00 H new ATOM 0 HB2 GLN A 21 1.085 14.492 -0.924 1.00 0.00 H new ATOM 0 HB3 GLN A 21 2.337 15.198 0.080 1.00 0.00 H new ATOM 0 HG2 GLN A 21 1.500 16.847 -1.526 1.00 0.00 H new ATOM 0 HG3 GLN A 21 3.189 16.500 -1.839 1.00 0.00 H new ATOM 0 HE21 GLN A 21 3.798 15.338 -3.752 1.00 0.00 H new ATOM 0 HE22 GLN A 21 2.670 15.127 -5.095 1.00 0.00 H new ATOM 365 N ASN A 22 5.114 13.998 0.025 1.00 0.00 N ATOM 366 CA ASN A 22 6.524 14.381 0.292 1.00 0.00 C ATOM 367 C ASN A 22 7.461 13.166 0.160 1.00 0.00 C ATOM 368 O ASN A 22 8.677 13.330 0.006 1.00 0.00 O ATOM 369 CB ASN A 22 6.633 14.988 1.721 1.00 0.00 C ATOM 370 CG ASN A 22 8.042 15.465 2.106 1.00 0.00 C ATOM 371 OD1 ASN A 22 8.404 16.612 1.865 1.00 0.00 O ATOM 372 ND2 ASN A 22 8.847 14.588 2.696 1.00 0.00 N ATOM 0 H ASN A 22 4.620 13.655 0.849 1.00 0.00 H new ATOM 0 HA ASN A 22 6.830 15.123 -0.445 1.00 0.00 H new ATOM 0 HB2 ASN A 22 5.945 15.830 1.798 1.00 0.00 H new ATOM 0 HB3 ASN A 22 6.306 14.242 2.445 1.00 0.00 H new ATOM 0 HD21 ASN A 22 9.793 14.862 2.961 1.00 0.00 H new ATOM 0 HD22 ASN A 22 8.519 13.641 2.884 1.00 0.00 H new ATOM 379 N ASN A 23 6.860 11.958 0.211 1.00 0.00 N ATOM 380 CA ASN A 23 7.560 10.662 0.387 1.00 0.00 C ATOM 381 C ASN A 23 8.145 10.568 1.807 1.00 0.00 C ATOM 382 O ASN A 23 9.083 9.805 2.070 1.00 0.00 O ATOM 383 CB ASN A 23 8.612 10.387 -0.726 1.00 0.00 C ATOM 384 CG ASN A 23 8.030 10.501 -2.132 1.00 0.00 C ATOM 385 OD1 ASN A 23 6.829 10.373 -2.333 1.00 0.00 O ATOM 386 ND2 ASN A 23 8.884 10.735 -3.107 1.00 0.00 N ATOM 0 H ASN A 23 5.849 11.852 0.129 1.00 0.00 H new ATOM 0 HA ASN A 23 6.826 9.864 0.275 1.00 0.00 H new ATOM 0 HB2 ASN A 23 9.437 11.091 -0.621 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.026 9.388 -0.589 1.00 0.00 H new ATOM 0 HD21 ASN A 23 8.551 10.815 -4.068 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.878 10.836 -2.901 1.00 0.00 H new ATOM 393 N GLY A 24 7.490 11.309 2.727 1.00 0.00 N ATOM 394 CA GLY A 24 7.820 11.334 4.145 1.00 0.00 C ATOM 395 C GLY A 24 7.419 10.051 4.858 1.00 0.00 C ATOM 396 O GLY A 24 6.952 9.102 4.217 1.00 0.00 O ATOM 0 H GLY A 24 6.704 11.914 2.487 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.892 11.492 4.263 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.320 12.180 4.617 1.00 0.00 H new ATOM 400 N THR A 25 7.656 10.001 6.176 1.00 0.00 N ATOM 401 CA THR A 25 7.282 8.839 6.998 1.00 0.00 C ATOM 402 C THR A 25 7.361 9.144 8.498 1.00 0.00 C ATOM 403 O THR A 25 7.897 10.183 8.912 1.00 0.00 O ATOM 404 CB THR A 25 8.187 7.595 6.662 1.00 0.00 C ATOM 405 OG1 THR A 25 7.666 6.409 7.296 1.00 0.00 O ATOM 406 CG2 THR A 25 9.665 7.812 7.063 1.00 0.00 C ATOM 0 H THR A 25 8.106 10.753 6.698 1.00 0.00 H new ATOM 0 HA THR A 25 6.246 8.605 6.755 1.00 0.00 H new ATOM 0 HB THR A 25 8.164 7.467 5.580 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.987 6.364 8.221 1.00 0.00 H new ATOM 0 HG21 THR A 25 10.245 6.925 6.810 1.00 0.00 H new ATOM 0 HG22 THR A 25 10.065 8.672 6.526 1.00 0.00 H new ATOM 0 HG23 THR A 25 9.728 7.992 8.136 1.00 0.00 H new ATOM 414 N GLU A 26 6.799 8.227 9.299 1.00 0.00 N ATOM 415 CA GLU A 26 7.022 8.175 10.745 1.00 0.00 C ATOM 416 C GLU A 26 8.004 7.018 11.028 1.00 0.00 C ATOM 417 O GLU A 26 8.026 6.018 10.285 1.00 0.00 O ATOM 418 CB GLU A 26 5.687 7.926 11.531 1.00 0.00 C ATOM 419 CG GLU A 26 5.060 6.521 11.330 1.00 0.00 C ATOM 420 CD GLU A 26 3.928 6.176 12.322 1.00 0.00 C ATOM 421 OE1 GLU A 26 4.222 5.689 13.449 1.00 0.00 O ATOM 422 OE2 GLU A 26 2.739 6.367 11.975 1.00 0.00 O ATOM 0 H GLU A 26 6.174 7.498 8.956 1.00 0.00 H new ATOM 0 HA GLU A 26 7.424 9.132 11.078 1.00 0.00 H new ATOM 0 HB2 GLU A 26 5.876 8.074 12.594 1.00 0.00 H new ATOM 0 HB3 GLU A 26 4.959 8.679 11.229 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.669 6.454 10.315 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.845 5.771 11.420 1.00 0.00 H new ATOM 429 N PRO A 27 8.872 7.147 12.058 1.00 0.00 N ATOM 430 CA PRO A 27 9.400 5.973 12.766 1.00 0.00 C ATOM 431 C PRO A 27 8.260 5.398 13.647 1.00 0.00 C ATOM 432 O PRO A 27 7.567 6.197 14.282 1.00 0.00 O ATOM 433 CB PRO A 27 10.585 6.550 13.603 1.00 0.00 C ATOM 434 CG PRO A 27 10.806 7.945 13.076 1.00 0.00 C ATOM 435 CD PRO A 27 9.457 8.404 12.578 1.00 0.00 C ATOM 0 HA PRO A 27 9.743 5.157 12.130 1.00 0.00 H new ATOM 0 HB2 PRO A 27 10.344 6.565 14.666 1.00 0.00 H new ATOM 0 HB3 PRO A 27 11.481 5.940 13.488 1.00 0.00 H new ATOM 0 HG2 PRO A 27 11.182 8.605 13.858 1.00 0.00 H new ATOM 0 HG3 PRO A 27 11.543 7.949 12.273 1.00 0.00 H new ATOM 0 HD2 PRO A 27 8.853 8.834 13.377 1.00 0.00 H new ATOM 0 HD3 PRO A 27 9.546 9.163 11.801 1.00 0.00 H new ATOM 598 N LYS A 37 3.254 -8.930 12.632 1.00 0.00 N ATOM 599 CA LYS A 37 3.670 -9.843 11.552 1.00 0.00 C ATOM 600 C LYS A 37 2.603 -10.944 11.353 1.00 0.00 C ATOM 601 O LYS A 37 2.904 -12.068 10.928 1.00 0.00 O ATOM 602 CB LYS A 37 5.073 -10.462 11.864 1.00 0.00 C ATOM 603 CG LYS A 37 5.218 -11.212 13.225 1.00 0.00 C ATOM 604 CD LYS A 37 5.512 -10.265 14.415 1.00 0.00 C ATOM 605 CE LYS A 37 5.501 -10.985 15.777 1.00 0.00 C ATOM 606 NZ LYS A 37 4.144 -11.474 16.144 1.00 0.00 N ATOM 0 HA LYS A 37 3.758 -9.279 10.624 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.324 -11.157 11.063 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.813 -9.662 11.835 1.00 0.00 H new ATOM 0 HG2 LYS A 37 4.301 -11.765 13.427 1.00 0.00 H new ATOM 0 HG3 LYS A 37 6.021 -11.945 13.145 1.00 0.00 H new ATOM 0 HD2 LYS A 37 6.485 -9.796 14.267 1.00 0.00 H new ATOM 0 HD3 LYS A 37 4.771 -9.466 14.427 1.00 0.00 H new ATOM 0 HE2 LYS A 37 6.193 -11.827 15.746 1.00 0.00 H new ATOM 0 HE3 LYS A 37 5.861 -10.304 16.549 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 4.156 -11.829 17.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 3.461 -10.693 16.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 3.866 -12.242 15.500 1.00 0.00 H new ATOM 620 N GLU A 38 1.338 -10.557 11.613 1.00 0.00 N ATOM 621 CA GLU A 38 0.141 -11.424 11.498 1.00 0.00 C ATOM 622 C GLU A 38 -0.122 -11.877 10.048 1.00 0.00 C ATOM 623 O GLU A 38 0.669 -11.605 9.144 1.00 0.00 O ATOM 624 CB GLU A 38 -1.122 -10.680 12.074 1.00 0.00 C ATOM 625 CG GLU A 38 -1.243 -9.149 11.762 1.00 0.00 C ATOM 626 CD GLU A 38 -0.954 -8.722 10.301 1.00 0.00 C ATOM 627 OE1 GLU A 38 -1.804 -8.963 9.410 1.00 0.00 O ATOM 628 OE2 GLU A 38 0.137 -8.148 10.049 1.00 0.00 O ATOM 0 H GLU A 38 1.112 -9.610 11.917 1.00 0.00 H new ATOM 0 HA GLU A 38 0.335 -12.323 12.083 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.013 -11.176 11.690 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.127 -10.808 13.156 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.252 -8.826 12.020 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.558 -8.611 12.418 1.00 0.00 H new ATOM 635 N GLU A 39 -1.232 -12.601 9.855 1.00 0.00 N ATOM 636 CA GLU A 39 -1.798 -12.865 8.524 1.00 0.00 C ATOM 637 C GLU A 39 -3.093 -12.038 8.323 1.00 0.00 C ATOM 638 O GLU A 39 -3.840 -11.772 9.279 1.00 0.00 O ATOM 639 CB GLU A 39 -2.080 -14.372 8.341 1.00 0.00 C ATOM 640 CG GLU A 39 -3.056 -14.980 9.365 1.00 0.00 C ATOM 641 CD GLU A 39 -3.546 -16.380 8.980 1.00 0.00 C ATOM 642 OE1 GLU A 39 -2.884 -17.380 9.330 1.00 0.00 O ATOM 643 OE2 GLU A 39 -4.597 -16.482 8.324 1.00 0.00 O ATOM 0 H GLU A 39 -1.764 -13.021 10.617 1.00 0.00 H new ATOM 0 HA GLU A 39 -1.071 -12.563 7.770 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -2.481 -14.532 7.340 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -1.135 -14.913 8.397 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.567 -15.029 10.338 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -3.916 -14.319 9.473 1.00 0.00 H new ATOM 650 N GLY A 40 -3.358 -11.676 7.057 1.00 0.00 N ATOM 651 CA GLY A 40 -4.465 -10.787 6.685 1.00 0.00 C ATOM 652 C GLY A 40 -4.126 -10.022 5.414 1.00 0.00 C ATOM 653 O GLY A 40 -3.615 -10.620 4.454 1.00 0.00 O ATOM 0 H GLY A 40 -2.806 -11.995 6.261 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -5.374 -11.370 6.535 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.666 -10.087 7.496 1.00 0.00 H new ATOM 657 N LEU A 41 -4.383 -8.703 5.394 1.00 0.00 N ATOM 658 CA LEU A 41 -4.028 -7.822 4.256 1.00 0.00 C ATOM 659 C LEU A 41 -3.584 -6.450 4.733 1.00 0.00 C ATOM 660 O LEU A 41 -4.068 -5.961 5.733 1.00 0.00 O ATOM 661 CB LEU A 41 -5.239 -7.637 3.316 1.00 0.00 C ATOM 662 CG LEU A 41 -5.611 -8.862 2.442 1.00 0.00 C ATOM 663 CD1 LEU A 41 -6.939 -8.639 1.764 1.00 0.00 C ATOM 664 CD2 LEU A 41 -4.532 -9.162 1.396 1.00 0.00 C ATOM 0 H LEU A 41 -4.842 -8.213 6.162 1.00 0.00 H new ATOM 0 HA LEU A 41 -3.207 -8.303 3.725 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.106 -7.370 3.920 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.037 -6.793 2.657 1.00 0.00 H new ATOM 0 HG LEU A 41 -5.685 -9.725 3.103 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.186 -9.508 1.154 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -7.712 -8.493 2.518 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.880 -7.755 1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.830 -10.027 0.804 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -4.410 -8.299 0.742 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -3.588 -9.374 1.898 1.00 0.00 H new ATOM 676 N TYR A 42 -2.725 -5.815 3.935 1.00 0.00 N ATOM 677 CA TYR A 42 -2.269 -4.430 4.159 1.00 0.00 C ATOM 678 C TYR A 42 -2.965 -3.539 3.147 1.00 0.00 C ATOM 679 O TYR A 42 -2.796 -3.710 1.933 1.00 0.00 O ATOM 680 CB TYR A 42 -0.735 -4.300 4.054 1.00 0.00 C ATOM 681 CG TYR A 42 0.006 -4.870 5.267 1.00 0.00 C ATOM 682 CD1 TYR A 42 0.266 -6.237 5.378 1.00 0.00 C ATOM 683 CD2 TYR A 42 0.425 -4.036 6.306 1.00 0.00 C ATOM 684 CE1 TYR A 42 0.917 -6.748 6.478 1.00 0.00 C ATOM 685 CE2 TYR A 42 1.075 -4.542 7.405 1.00 0.00 C ATOM 686 CZ TYR A 42 1.317 -5.896 7.492 1.00 0.00 C ATOM 687 OH TYR A 42 1.978 -6.398 8.591 1.00 0.00 O ATOM 0 H TYR A 42 -2.318 -6.246 3.105 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.528 -4.124 5.173 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.395 -4.814 3.155 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -0.474 -3.248 3.939 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.048 -6.904 4.589 1.00 0.00 H new ATOM 0 HD2 TYR A 42 0.235 -2.975 6.244 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.114 -7.807 6.549 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.395 -3.882 8.198 1.00 0.00 H new ATOM 0 HH TYR A 42 2.189 -5.667 9.208 1.00 0.00 H new ATOM 697 N VAL A 43 -3.766 -2.607 3.672 1.00 0.00 N ATOM 698 CA VAL A 43 -4.711 -1.795 2.905 1.00 0.00 C ATOM 699 C VAL A 43 -4.440 -0.305 3.153 1.00 0.00 C ATOM 700 O VAL A 43 -3.806 0.060 4.156 1.00 0.00 O ATOM 701 CB VAL A 43 -6.209 -2.160 3.283 1.00 0.00 C ATOM 702 CG1 VAL A 43 -6.431 -3.693 3.235 1.00 0.00 C ATOM 703 CG2 VAL A 43 -6.641 -1.580 4.657 1.00 0.00 C ATOM 0 H VAL A 43 -3.774 -2.392 4.669 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.572 -2.008 1.845 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.845 -1.690 2.533 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.464 -3.919 3.498 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.223 -4.059 2.230 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.761 -4.180 3.944 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.674 -1.862 4.862 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.994 -1.977 5.439 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.559 -0.493 4.635 1.00 0.00 H new ATOM 713 N ASP A 44 -4.938 0.542 2.243 1.00 0.00 N ATOM 714 CA ASP A 44 -4.860 1.997 2.365 1.00 0.00 C ATOM 715 C ASP A 44 -5.996 2.431 3.297 1.00 0.00 C ATOM 716 O ASP A 44 -7.150 2.328 2.909 1.00 0.00 O ATOM 717 CB ASP A 44 -4.977 2.649 0.953 1.00 0.00 C ATOM 718 CG ASP A 44 -4.593 4.138 0.868 1.00 0.00 C ATOM 719 OD1 ASP A 44 -4.049 4.695 1.841 1.00 0.00 O ATOM 720 OD2 ASP A 44 -4.842 4.758 -0.199 1.00 0.00 O ATOM 0 H ASP A 44 -5.410 0.230 1.394 1.00 0.00 H new ATOM 0 HA ASP A 44 -3.906 2.319 2.782 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -4.345 2.090 0.262 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -6.004 2.538 0.606 1.00 0.00 H new ATOM 725 N ILE A 45 -5.643 2.829 4.541 1.00 0.00 N ATOM 726 CA ILE A 45 -6.602 3.083 5.666 1.00 0.00 C ATOM 727 C ILE A 45 -7.840 3.915 5.231 1.00 0.00 C ATOM 728 O ILE A 45 -8.953 3.684 5.706 1.00 0.00 O ATOM 729 CB ILE A 45 -5.907 3.819 6.888 1.00 0.00 C ATOM 730 CG1 ILE A 45 -4.522 3.199 7.223 1.00 0.00 C ATOM 731 CG2 ILE A 45 -6.818 3.826 8.154 1.00 0.00 C ATOM 732 CD1 ILE A 45 -3.730 3.916 8.310 1.00 0.00 C ATOM 0 H ILE A 45 -4.671 2.988 4.806 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.937 2.093 5.976 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.750 4.852 6.578 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.671 2.163 7.529 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.922 3.179 6.313 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -6.306 4.339 8.968 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.750 4.344 7.928 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.035 2.800 8.452 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.781 3.404 8.467 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -3.541 4.945 8.004 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.301 3.913 9.238 1.00 0.00 H new ATOM 744 N VAL A 46 -7.616 4.878 4.324 1.00 0.00 N ATOM 745 CA VAL A 46 -8.681 5.746 3.769 1.00 0.00 C ATOM 746 C VAL A 46 -9.712 4.923 2.954 1.00 0.00 C ATOM 747 O VAL A 46 -10.916 4.985 3.203 1.00 0.00 O ATOM 748 CB VAL A 46 -8.045 6.888 2.874 1.00 0.00 C ATOM 749 CG1 VAL A 46 -7.286 7.925 3.750 1.00 0.00 C ATOM 750 CG2 VAL A 46 -7.098 6.295 1.781 1.00 0.00 C ATOM 0 H VAL A 46 -6.689 5.082 3.950 1.00 0.00 H new ATOM 0 HA VAL A 46 -9.211 6.207 4.603 1.00 0.00 H new ATOM 0 HB VAL A 46 -8.863 7.400 2.367 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -6.859 8.698 3.111 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.979 8.381 4.457 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -6.487 7.424 4.297 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.678 7.105 1.185 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -6.291 5.742 2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.664 5.624 1.135 1.00 0.00 H new ATOM 760 N SER A 47 -9.191 4.123 2.025 1.00 0.00 N ATOM 761 CA SER A 47 -9.965 3.422 0.991 1.00 0.00 C ATOM 762 C SER A 47 -10.470 2.059 1.510 1.00 0.00 C ATOM 763 O SER A 47 -11.468 1.521 1.020 1.00 0.00 O ATOM 764 CB SER A 47 -9.046 3.247 -0.249 1.00 0.00 C ATOM 765 OG SER A 47 -9.742 2.756 -1.369 1.00 0.00 O ATOM 0 H SER A 47 -8.190 3.937 1.966 1.00 0.00 H new ATOM 0 HA SER A 47 -10.848 4.001 0.721 1.00 0.00 H new ATOM 0 HB2 SER A 47 -8.592 4.206 -0.499 1.00 0.00 H new ATOM 0 HB3 SER A 47 -8.233 2.564 -0.002 1.00 0.00 H new ATOM 0 HG SER A 47 -9.236 2.959 -2.183 1.00 0.00 H new ATOM 771 N GLY A 48 -9.771 1.539 2.537 1.00 0.00 N ATOM 772 CA GLY A 48 -10.009 0.200 3.086 1.00 0.00 C ATOM 773 C GLY A 48 -9.834 -0.917 2.060 1.00 0.00 C ATOM 774 O GLY A 48 -10.418 -1.991 2.206 1.00 0.00 O ATOM 0 H GLY A 48 -9.021 2.044 3.009 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.325 0.030 3.917 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -11.020 0.156 3.491 1.00 0.00 H new ATOM 778 N LYS A 49 -9.001 -0.668 1.033 1.00 0.00 N ATOM 779 CA LYS A 49 -8.866 -1.563 -0.143 1.00 0.00 C ATOM 780 C LYS A 49 -7.454 -2.199 -0.180 1.00 0.00 C ATOM 781 O LYS A 49 -6.460 -1.485 -0.001 1.00 0.00 O ATOM 782 CB LYS A 49 -9.180 -0.785 -1.451 1.00 0.00 C ATOM 783 CG LYS A 49 -10.682 -0.492 -1.679 1.00 0.00 C ATOM 784 CD LYS A 49 -10.961 0.344 -2.954 1.00 0.00 C ATOM 785 CE LYS A 49 -10.475 -0.330 -4.244 1.00 0.00 C ATOM 786 NZ LYS A 49 -11.114 -1.651 -4.472 1.00 0.00 N ATOM 0 H LYS A 49 -8.401 0.156 0.990 1.00 0.00 H new ATOM 0 HA LYS A 49 -9.589 -2.374 -0.057 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.637 0.160 -1.436 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -8.802 -1.357 -2.298 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.222 -1.436 -1.748 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -11.076 0.039 -0.812 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -12.032 0.529 -3.031 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -10.476 1.315 -2.856 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -10.684 0.322 -5.092 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -9.393 -0.456 -4.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -10.379 -2.382 -4.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -11.736 -1.879 -3.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -11.675 -1.619 -5.347 1.00 0.00 H new ATOM 800 N PRO A 50 -7.354 -3.556 -0.404 1.00 0.00 N ATOM 801 CA PRO A 50 -6.080 -4.325 -0.271 1.00 0.00 C ATOM 802 C PRO A 50 -5.013 -3.985 -1.333 1.00 0.00 C ATOM 803 O PRO A 50 -5.229 -4.165 -2.522 1.00 0.00 O ATOM 804 CB PRO A 50 -6.555 -5.795 -0.378 1.00 0.00 C ATOM 805 CG PRO A 50 -7.810 -5.737 -1.194 1.00 0.00 C ATOM 806 CD PRO A 50 -8.485 -4.448 -0.794 1.00 0.00 C ATOM 0 HA PRO A 50 -5.565 -4.089 0.660 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -5.801 -6.420 -0.857 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -6.744 -6.222 0.607 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -7.587 -5.750 -2.261 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.450 -6.596 -0.992 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -9.061 -4.026 -1.618 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.178 -4.600 0.034 1.00 0.00 H new ATOM 814 N LEU A 51 -3.830 -3.551 -0.866 1.00 0.00 N ATOM 815 CA LEU A 51 -2.729 -3.086 -1.740 1.00 0.00 C ATOM 816 C LEU A 51 -1.700 -4.194 -1.960 1.00 0.00 C ATOM 817 O LEU A 51 -1.057 -4.264 -3.016 1.00 0.00 O ATOM 818 CB LEU A 51 -2.059 -1.831 -1.125 1.00 0.00 C ATOM 819 CG LEU A 51 -3.026 -0.657 -0.796 1.00 0.00 C ATOM 820 CD1 LEU A 51 -2.246 0.602 -0.363 1.00 0.00 C ATOM 821 CD2 LEU A 51 -4.000 -0.388 -1.976 1.00 0.00 C ATOM 0 H LEU A 51 -3.606 -3.511 0.128 1.00 0.00 H new ATOM 0 HA LEU A 51 -3.146 -2.822 -2.712 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -1.545 -2.125 -0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -1.297 -1.470 -1.816 1.00 0.00 H new ATOM 0 HG LEU A 51 -3.642 -0.946 0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.948 1.406 -0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -1.657 0.377 0.526 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.582 0.914 -1.169 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -4.664 0.437 -1.719 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -3.429 -0.130 -2.868 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.592 -1.283 -2.171 1.00 0.00 H new ATOM 833 N PHE A 52 -1.550 -5.042 -0.934 1.00 0.00 N ATOM 834 CA PHE A 52 -0.674 -6.229 -0.984 1.00 0.00 C ATOM 835 C PHE A 52 -1.040 -7.191 0.137 1.00 0.00 C ATOM 836 O PHE A 52 -1.677 -6.799 1.130 1.00 0.00 O ATOM 837 CB PHE A 52 0.837 -5.862 -0.973 1.00 0.00 C ATOM 838 CG PHE A 52 1.314 -5.026 0.219 1.00 0.00 C ATOM 839 CD1 PHE A 52 1.214 -3.633 0.200 1.00 0.00 C ATOM 840 CD2 PHE A 52 1.905 -5.629 1.331 1.00 0.00 C ATOM 841 CE1 PHE A 52 1.683 -2.877 1.252 1.00 0.00 C ATOM 842 CE2 PHE A 52 2.383 -4.869 2.376 1.00 0.00 C ATOM 843 CZ PHE A 52 2.270 -3.493 2.336 1.00 0.00 C ATOM 0 H PHE A 52 -2.032 -4.928 -0.042 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.843 -6.729 -1.938 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.416 -6.785 -0.999 1.00 0.00 H new ATOM 0 HB3 PHE A 52 1.065 -5.317 -1.889 1.00 0.00 H new ATOM 0 HD1 PHE A 52 0.763 -3.142 -0.650 1.00 0.00 H new ATOM 0 HD2 PHE A 52 1.989 -6.705 1.373 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.591 -1.801 1.227 1.00 0.00 H new ATOM 0 HE2 PHE A 52 2.846 -5.349 3.226 1.00 0.00 H new ATOM 0 HZ PHE A 52 2.643 -2.898 3.157 1.00 0.00 H new ATOM 853 N THR A 53 -0.639 -8.455 -0.028 1.00 0.00 N ATOM 854 CA THR A 53 -1.105 -9.541 0.823 1.00 0.00 C ATOM 855 C THR A 53 -0.107 -9.826 1.945 1.00 0.00 C ATOM 856 O THR A 53 1.109 -9.695 1.767 1.00 0.00 O ATOM 857 CB THR A 53 -1.373 -10.838 -0.024 1.00 0.00 C ATOM 858 OG1 THR A 53 -0.151 -11.353 -0.562 1.00 0.00 O ATOM 859 CG2 THR A 53 -2.342 -10.570 -1.193 1.00 0.00 C ATOM 0 H THR A 53 0.015 -8.748 -0.754 1.00 0.00 H new ATOM 0 HA THR A 53 -2.045 -9.230 1.279 1.00 0.00 H new ATOM 0 HB THR A 53 -1.823 -11.564 0.653 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.584 -10.740 -0.351 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.500 -11.492 -1.753 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.295 -10.215 -0.801 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.916 -9.814 -1.852 1.00 0.00 H new ATOM 867 N SER A 54 -0.646 -10.239 3.099 1.00 0.00 N ATOM 868 CA SER A 54 0.150 -10.720 4.229 1.00 0.00 C ATOM 869 C SER A 54 0.571 -12.191 3.990 1.00 0.00 C ATOM 870 O SER A 54 1.383 -12.739 4.735 1.00 0.00 O ATOM 871 CB SER A 54 -0.620 -10.545 5.549 1.00 0.00 C ATOM 872 OG SER A 54 0.207 -10.776 6.662 1.00 0.00 O ATOM 0 H SER A 54 -1.651 -10.248 3.273 1.00 0.00 H new ATOM 0 HA SER A 54 1.059 -10.123 4.309 1.00 0.00 H new ATOM 0 HB2 SER A 54 -1.029 -9.536 5.602 1.00 0.00 H new ATOM 0 HB3 SER A 54 -1.465 -11.233 5.573 1.00 0.00 H new ATOM 0 HG SER A 54 0.618 -11.662 6.586 1.00 0.00 H new ATOM 878 N LYS A 55 -0.056 -12.822 2.983 1.00 0.00 N ATOM 879 CA LYS A 55 0.366 -14.118 2.424 1.00 0.00 C ATOM 880 C LYS A 55 1.891 -14.165 2.148 1.00 0.00 C ATOM 881 O LYS A 55 2.561 -15.132 2.518 1.00 0.00 O ATOM 882 CB LYS A 55 -0.445 -14.376 1.122 1.00 0.00 C ATOM 883 CG LYS A 55 0.119 -15.469 0.183 1.00 0.00 C ATOM 884 CD LYS A 55 -0.764 -15.713 -1.063 1.00 0.00 C ATOM 885 CE LYS A 55 -1.035 -14.436 -1.878 1.00 0.00 C ATOM 886 NZ LYS A 55 -1.908 -14.703 -3.049 1.00 0.00 N ATOM 0 H LYS A 55 -0.884 -12.440 2.527 1.00 0.00 H new ATOM 0 HA LYS A 55 0.164 -14.902 3.153 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -1.463 -14.651 1.399 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.508 -13.442 0.564 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.120 -15.182 -0.139 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.218 -16.401 0.739 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -0.279 -16.449 -1.705 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -1.715 -16.143 -0.747 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.504 -13.689 -1.238 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.089 -14.015 -2.219 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -1.445 -14.356 -3.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -2.074 -15.726 -3.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -2.817 -14.214 -2.923 1.00 0.00 H new ATOM 900 N ASP A 56 2.425 -13.094 1.527 1.00 0.00 N ATOM 901 CA ASP A 56 3.847 -13.017 1.127 1.00 0.00 C ATOM 902 C ASP A 56 4.515 -11.750 1.693 1.00 0.00 C ATOM 903 O ASP A 56 5.427 -11.181 1.077 1.00 0.00 O ATOM 904 CB ASP A 56 3.969 -13.102 -0.427 1.00 0.00 C ATOM 905 CG ASP A 56 3.291 -11.969 -1.236 1.00 0.00 C ATOM 906 OD1 ASP A 56 2.594 -11.102 -0.671 1.00 0.00 O ATOM 907 OD2 ASP A 56 3.437 -11.967 -2.470 1.00 0.00 O ATOM 0 H ASP A 56 1.887 -12.261 1.289 1.00 0.00 H new ATOM 0 HA ASP A 56 4.381 -13.867 1.552 1.00 0.00 H new ATOM 0 HB2 ASP A 56 5.028 -13.119 -0.686 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.546 -14.053 -0.751 1.00 0.00 H new ATOM 912 N LYS A 57 4.086 -11.354 2.907 1.00 0.00 N ATOM 913 CA LYS A 57 4.659 -10.194 3.615 1.00 0.00 C ATOM 914 C LYS A 57 6.042 -10.550 4.187 1.00 0.00 C ATOM 915 O LYS A 57 6.279 -11.680 4.638 1.00 0.00 O ATOM 916 CB LYS A 57 3.712 -9.704 4.754 1.00 0.00 C ATOM 917 CG LYS A 57 3.495 -10.719 5.925 1.00 0.00 C ATOM 918 CD LYS A 57 4.137 -10.300 7.266 1.00 0.00 C ATOM 919 CE LYS A 57 3.465 -9.069 7.879 1.00 0.00 C ATOM 920 NZ LYS A 57 2.028 -9.302 8.220 1.00 0.00 N ATOM 0 H LYS A 57 3.340 -11.824 3.420 1.00 0.00 H new ATOM 0 HA LYS A 57 4.770 -9.381 2.897 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.115 -8.779 5.167 1.00 0.00 H new ATOM 0 HB3 LYS A 57 2.742 -9.463 4.319 1.00 0.00 H new ATOM 0 HG2 LYS A 57 2.424 -10.855 6.077 1.00 0.00 H new ATOM 0 HG3 LYS A 57 3.901 -11.687 5.630 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.077 -11.131 7.969 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.195 -10.092 7.109 1.00 0.00 H new ATOM 0 HE2 LYS A 57 4.005 -8.777 8.780 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.537 -8.236 7.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 1.619 -8.431 8.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.506 -9.570 7.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 1.957 -10.067 8.921 1.00 0.00 H new ATOM 934 N PHE A 58 6.952 -9.581 4.135 1.00 0.00 N ATOM 935 CA PHE A 58 8.282 -9.666 4.757 1.00 0.00 C ATOM 936 C PHE A 58 8.476 -8.437 5.653 1.00 0.00 C ATOM 937 O PHE A 58 7.651 -7.503 5.629 1.00 0.00 O ATOM 938 CB PHE A 58 9.395 -9.767 3.670 1.00 0.00 C ATOM 939 CG PHE A 58 9.364 -11.078 2.870 1.00 0.00 C ATOM 940 CD1 PHE A 58 10.042 -12.209 3.324 1.00 0.00 C ATOM 941 CD2 PHE A 58 8.640 -11.188 1.681 1.00 0.00 C ATOM 942 CE1 PHE A 58 9.997 -13.397 2.623 1.00 0.00 C ATOM 943 CE2 PHE A 58 8.601 -12.379 0.979 1.00 0.00 C ATOM 944 CZ PHE A 58 9.278 -13.482 1.450 1.00 0.00 C ATOM 0 H PHE A 58 6.789 -8.697 3.653 1.00 0.00 H new ATOM 0 HA PHE A 58 8.354 -10.568 5.365 1.00 0.00 H new ATOM 0 HB2 PHE A 58 9.293 -8.929 2.980 1.00 0.00 H new ATOM 0 HB3 PHE A 58 10.369 -9.668 4.150 1.00 0.00 H new ATOM 0 HD1 PHE A 58 10.612 -12.154 4.240 1.00 0.00 H new ATOM 0 HD2 PHE A 58 8.103 -10.330 1.304 1.00 0.00 H new ATOM 0 HE1 PHE A 58 10.526 -14.262 2.994 1.00 0.00 H new ATOM 0 HE2 PHE A 58 8.038 -12.444 0.059 1.00 0.00 H new ATOM 0 HZ PHE A 58 9.246 -14.412 0.901 1.00 0.00 H new ATOM 954 N ASP A 59 9.545 -8.453 6.463 1.00 0.00 N ATOM 955 CA ASP A 59 9.874 -7.326 7.348 1.00 0.00 C ATOM 956 C ASP A 59 10.408 -6.150 6.512 1.00 0.00 C ATOM 957 O ASP A 59 10.898 -6.340 5.382 1.00 0.00 O ATOM 958 CB ASP A 59 10.893 -7.738 8.448 1.00 0.00 C ATOM 959 CG ASP A 59 12.309 -8.008 7.917 1.00 0.00 C ATOM 960 OD1 ASP A 59 12.519 -9.058 7.284 1.00 0.00 O ATOM 961 OD2 ASP A 59 13.222 -7.181 8.148 1.00 0.00 O ATOM 0 H ASP A 59 10.197 -9.235 6.523 1.00 0.00 H new ATOM 0 HA ASP A 59 8.964 -7.014 7.860 1.00 0.00 H new ATOM 0 HB2 ASP A 59 10.942 -6.949 9.198 1.00 0.00 H new ATOM 0 HB3 ASP A 59 10.527 -8.633 8.951 1.00 0.00 H new ATOM 966 N SER A 60 10.278 -4.942 7.069 1.00 0.00 N ATOM 967 CA SER A 60 10.719 -3.704 6.420 1.00 0.00 C ATOM 968 C SER A 60 12.253 -3.676 6.279 1.00 0.00 C ATOM 969 O SER A 60 12.980 -3.493 7.263 1.00 0.00 O ATOM 970 CB SER A 60 10.196 -2.496 7.222 1.00 0.00 C ATOM 971 OG SER A 60 8.777 -2.505 7.299 1.00 0.00 O ATOM 0 H SER A 60 9.861 -4.795 7.988 1.00 0.00 H new ATOM 0 HA SER A 60 10.308 -3.655 5.412 1.00 0.00 H new ATOM 0 HB2 SER A 60 10.617 -2.514 8.227 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.531 -1.571 6.752 1.00 0.00 H new ATOM 0 HG SER A 60 8.472 -1.729 7.814 1.00 0.00 H new ATOM 977 N GLN A 61 12.726 -3.890 5.039 1.00 0.00 N ATOM 978 CA GLN A 61 14.162 -3.989 4.730 1.00 0.00 C ATOM 979 C GLN A 61 14.846 -2.610 4.785 1.00 0.00 C ATOM 980 O GLN A 61 16.033 -2.511 5.107 1.00 0.00 O ATOM 981 CB GLN A 61 14.360 -4.653 3.337 1.00 0.00 C ATOM 982 CG GLN A 61 13.728 -6.058 3.210 1.00 0.00 C ATOM 983 CD GLN A 61 14.284 -7.096 4.204 1.00 0.00 C ATOM 984 OE1 GLN A 61 15.462 -7.062 4.575 1.00 0.00 O ATOM 985 NE2 GLN A 61 13.430 -8.005 4.667 1.00 0.00 N ATOM 0 H GLN A 61 12.123 -3.999 4.223 1.00 0.00 H new ATOM 0 HA GLN A 61 14.634 -4.614 5.488 1.00 0.00 H new ATOM 0 HB2 GLN A 61 13.932 -4.004 2.573 1.00 0.00 H new ATOM 0 HB3 GLN A 61 15.428 -4.727 3.131 1.00 0.00 H new ATOM 0 HG2 GLN A 61 12.651 -5.974 3.355 1.00 0.00 H new ATOM 0 HG3 GLN A 61 13.885 -6.424 2.195 1.00 0.00 H new ATOM 0 HE21 GLN A 61 12.463 -8.008 4.342 1.00 0.00 H new ATOM 0 HE22 GLN A 61 13.742 -8.698 5.347 1.00 0.00 H new ATOM 994 N CYS A 62 14.074 -1.555 4.479 1.00 0.00 N ATOM 995 CA CYS A 62 14.557 -0.162 4.438 1.00 0.00 C ATOM 996 C CYS A 62 13.772 0.724 5.424 1.00 0.00 C ATOM 997 O CYS A 62 14.280 1.754 5.866 1.00 0.00 O ATOM 998 CB CYS A 62 14.412 0.382 2.996 1.00 0.00 C ATOM 999 SG CYS A 62 15.221 -0.646 1.746 1.00 0.00 S ATOM 0 H CYS A 62 13.084 -1.645 4.250 1.00 0.00 H new ATOM 0 HA CYS A 62 15.606 -0.142 4.735 1.00 0.00 H new ATOM 0 HB2 CYS A 62 13.353 0.467 2.754 1.00 0.00 H new ATOM 0 HB3 CYS A 62 14.830 1.388 2.953 1.00 0.00 H new ATOM 0 HG CYS A 62 15.047 -0.118 0.571 1.00 0.00 H new ATOM 1005 N GLY A 63 12.515 0.334 5.730 1.00 0.00 N ATOM 1006 CA GLY A 63 11.647 1.112 6.632 1.00 0.00 C ATOM 1007 C GLY A 63 10.171 0.940 6.299 1.00 0.00 C ATOM 1008 O GLY A 63 9.319 0.890 7.192 1.00 0.00 O ATOM 0 H GLY A 63 12.082 -0.514 5.365 1.00 0.00 H new ATOM 0 HA2 GLY A 63 11.824 0.801 7.662 1.00 0.00 H new ATOM 0 HA3 GLY A 63 11.912 2.167 6.568 1.00 0.00 H new ATOM 1012 N TRP A 64 9.871 0.862 4.998 1.00 0.00 N ATOM 1013 CA TRP A 64 8.512 0.568 4.489 1.00 0.00 C ATOM 1014 C TRP A 64 8.395 -0.929 4.136 1.00 0.00 C ATOM 1015 O TRP A 64 9.406 -1.552 3.806 1.00 0.00 O ATOM 1016 CB TRP A 64 8.205 1.448 3.241 1.00 0.00 C ATOM 1017 CG TRP A 64 8.109 2.934 3.523 1.00 0.00 C ATOM 1018 CD1 TRP A 64 8.019 3.546 4.747 1.00 0.00 C ATOM 1019 CD2 TRP A 64 8.067 3.996 2.548 1.00 0.00 C ATOM 1020 NE1 TRP A 64 7.945 4.898 4.590 1.00 0.00 N ATOM 1021 CE2 TRP A 64 7.978 5.206 3.259 1.00 0.00 C ATOM 1022 CE3 TRP A 64 8.116 4.040 1.151 1.00 0.00 C ATOM 1023 CZ2 TRP A 64 7.917 6.445 2.621 1.00 0.00 C ATOM 1024 CZ3 TRP A 64 8.053 5.270 0.515 1.00 0.00 C ATOM 1025 CH2 TRP A 64 7.969 6.460 1.252 1.00 0.00 C ATOM 0 H TRP A 64 10.561 1.000 4.260 1.00 0.00 H new ATOM 0 HA TRP A 64 7.783 0.802 5.265 1.00 0.00 H new ATOM 0 HB2 TRP A 64 8.984 1.283 2.496 1.00 0.00 H new ATOM 0 HB3 TRP A 64 7.266 1.114 2.800 1.00 0.00 H new ATOM 0 HD1 TRP A 64 8.008 3.032 5.697 1.00 0.00 H new ATOM 0 HE1 TRP A 64 7.876 5.576 5.349 1.00 0.00 H new ATOM 0 HE3 TRP A 64 8.202 3.130 0.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 7.832 7.361 3.187 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 8.069 5.312 -0.564 1.00 0.00 H new ATOM 0 HH2 TRP A 64 7.945 7.406 0.731 1.00 0.00 H new ATOM 1036 N PRO A 65 7.172 -1.551 4.235 1.00 0.00 N ATOM 1037 CA PRO A 65 6.944 -2.926 3.726 1.00 0.00 C ATOM 1038 C PRO A 65 7.182 -2.998 2.199 1.00 0.00 C ATOM 1039 O PRO A 65 6.515 -2.290 1.430 1.00 0.00 O ATOM 1040 CB PRO A 65 5.465 -3.229 4.107 1.00 0.00 C ATOM 1041 CG PRO A 65 5.132 -2.241 5.189 1.00 0.00 C ATOM 1042 CD PRO A 65 5.940 -0.999 4.868 1.00 0.00 C ATOM 0 HA PRO A 65 7.630 -3.658 4.152 1.00 0.00 H new ATOM 0 HB2 PRO A 65 4.804 -3.111 3.248 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.350 -4.254 4.460 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.064 -2.021 5.204 1.00 0.00 H new ATOM 0 HG3 PRO A 65 5.391 -2.634 6.172 1.00 0.00 H new ATOM 0 HD2 PRO A 65 5.404 -0.333 4.192 1.00 0.00 H new ATOM 0 HD3 PRO A 65 6.170 -0.425 5.765 1.00 0.00 H new ATOM 1050 N SER A 66 8.160 -3.821 1.774 1.00 0.00 N ATOM 1051 CA SER A 66 8.594 -3.886 0.370 1.00 0.00 C ATOM 1052 C SER A 66 8.677 -5.339 -0.118 1.00 0.00 C ATOM 1053 O SER A 66 9.255 -6.201 0.555 1.00 0.00 O ATOM 1054 CB SER A 66 9.961 -3.182 0.204 1.00 0.00 C ATOM 1055 OG SER A 66 10.987 -3.824 0.959 1.00 0.00 O ATOM 0 H SER A 66 8.667 -4.455 2.392 1.00 0.00 H new ATOM 0 HA SER A 66 7.853 -3.370 -0.240 1.00 0.00 H new ATOM 0 HB2 SER A 66 10.238 -3.172 -0.850 1.00 0.00 H new ATOM 0 HB3 SER A 66 9.874 -2.142 0.520 1.00 0.00 H new ATOM 0 HG SER A 66 10.714 -4.742 1.167 1.00 0.00 H new ATOM 1061 N PHE A 67 8.090 -5.588 -1.295 1.00 0.00 N ATOM 1062 CA PHE A 67 8.180 -6.873 -2.015 1.00 0.00 C ATOM 1063 C PHE A 67 7.863 -6.599 -3.509 1.00 0.00 C ATOM 1064 O PHE A 67 7.655 -5.446 -3.882 1.00 0.00 O ATOM 1065 CB PHE A 67 7.230 -7.931 -1.363 1.00 0.00 C ATOM 1066 CG PHE A 67 7.405 -9.356 -1.880 1.00 0.00 C ATOM 1067 CD1 PHE A 67 8.653 -9.972 -1.825 1.00 0.00 C ATOM 1068 CD2 PHE A 67 6.345 -10.066 -2.436 1.00 0.00 C ATOM 1069 CE1 PHE A 67 8.830 -11.244 -2.313 1.00 0.00 C ATOM 1070 CE2 PHE A 67 6.530 -11.344 -2.920 1.00 0.00 C ATOM 1071 CZ PHE A 67 7.770 -11.935 -2.858 1.00 0.00 C ATOM 0 H PHE A 67 7.528 -4.892 -1.786 1.00 0.00 H new ATOM 0 HA PHE A 67 9.181 -7.299 -1.948 1.00 0.00 H new ATOM 0 HB2 PHE A 67 7.392 -7.928 -0.285 1.00 0.00 H new ATOM 0 HB3 PHE A 67 6.198 -7.623 -1.531 1.00 0.00 H new ATOM 0 HD1 PHE A 67 9.491 -9.444 -1.394 1.00 0.00 H new ATOM 0 HD2 PHE A 67 5.367 -9.611 -2.489 1.00 0.00 H new ATOM 0 HE1 PHE A 67 9.806 -11.705 -2.269 1.00 0.00 H new ATOM 0 HE2 PHE A 67 5.698 -11.883 -3.349 1.00 0.00 H new ATOM 0 HZ PHE A 67 7.912 -12.937 -3.235 1.00 0.00 H new ATOM 1081 N THR A 68 7.833 -7.631 -4.363 1.00 0.00 N ATOM 1082 CA THR A 68 7.674 -7.461 -5.816 1.00 0.00 C ATOM 1083 C THR A 68 6.204 -7.611 -6.255 1.00 0.00 C ATOM 1084 O THR A 68 5.868 -7.286 -7.401 1.00 0.00 O ATOM 1085 CB THR A 68 8.557 -8.486 -6.596 1.00 0.00 C ATOM 1086 OG1 THR A 68 8.416 -8.268 -8.005 1.00 0.00 O ATOM 1087 CG2 THR A 68 8.207 -9.948 -6.262 1.00 0.00 C ATOM 0 H THR A 68 7.918 -8.604 -4.069 1.00 0.00 H new ATOM 0 HA THR A 68 8.000 -6.448 -6.053 1.00 0.00 H new ATOM 0 HB THR A 68 9.589 -8.323 -6.287 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.815 -7.406 -8.244 1.00 0.00 H new ATOM 0 HG21 THR A 68 8.852 -10.616 -6.833 1.00 0.00 H new ATOM 0 HG22 THR A 68 8.355 -10.123 -5.196 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.166 -10.141 -6.520 1.00 0.00 H new ATOM 1095 N LYS A 69 5.330 -8.093 -5.342 1.00 0.00 N ATOM 1096 CA LYS A 69 3.943 -8.490 -5.680 1.00 0.00 C ATOM 1097 C LYS A 69 2.943 -7.480 -5.074 1.00 0.00 C ATOM 1098 O LYS A 69 2.598 -7.597 -3.894 1.00 0.00 O ATOM 1099 CB LYS A 69 3.673 -9.961 -5.179 1.00 0.00 C ATOM 1100 CG LYS A 69 2.463 -10.730 -5.811 1.00 0.00 C ATOM 1101 CD LYS A 69 1.053 -10.205 -5.420 1.00 0.00 C ATOM 1102 CE LYS A 69 0.779 -10.239 -3.903 1.00 0.00 C ATOM 1103 NZ LYS A 69 0.803 -11.624 -3.360 1.00 0.00 N ATOM 0 H LYS A 69 5.564 -8.217 -4.357 1.00 0.00 H new ATOM 0 HA LYS A 69 3.807 -8.477 -6.761 1.00 0.00 H new ATOM 0 HB2 LYS A 69 4.574 -10.548 -5.357 1.00 0.00 H new ATOM 0 HB3 LYS A 69 3.523 -9.927 -4.100 1.00 0.00 H new ATOM 0 HG2 LYS A 69 2.557 -10.690 -6.896 1.00 0.00 H new ATOM 0 HG3 LYS A 69 2.533 -11.779 -5.523 1.00 0.00 H new ATOM 0 HD2 LYS A 69 0.944 -9.181 -5.777 1.00 0.00 H new ATOM 0 HD3 LYS A 69 0.298 -10.803 -5.930 1.00 0.00 H new ATOM 0 HE2 LYS A 69 1.525 -9.635 -3.387 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -0.192 -9.788 -3.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 0.312 -11.646 -2.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 0.325 -12.266 -4.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 1.789 -11.930 -3.232 1.00 0.00 H new ATOM 1117 N PRO A 70 2.478 -6.451 -5.849 1.00 0.00 N ATOM 1118 CA PRO A 70 1.314 -5.641 -5.458 1.00 0.00 C ATOM 1119 C PRO A 70 0.010 -6.295 -5.955 1.00 0.00 C ATOM 1120 O PRO A 70 0.044 -7.281 -6.703 1.00 0.00 O ATOM 1121 CB PRO A 70 1.600 -4.302 -6.170 1.00 0.00 C ATOM 1122 CG PRO A 70 2.259 -4.709 -7.464 1.00 0.00 C ATOM 1123 CD PRO A 70 3.036 -5.988 -7.156 1.00 0.00 C ATOM 0 HA PRO A 70 1.180 -5.531 -4.382 1.00 0.00 H new ATOM 0 HB2 PRO A 70 0.683 -3.741 -6.349 1.00 0.00 H new ATOM 0 HB3 PRO A 70 2.252 -3.664 -5.573 1.00 0.00 H new ATOM 0 HG2 PRO A 70 1.516 -4.882 -8.243 1.00 0.00 H new ATOM 0 HG3 PRO A 70 2.925 -3.926 -7.826 1.00 0.00 H new ATOM 0 HD2 PRO A 70 2.896 -6.736 -7.936 1.00 0.00 H new ATOM 0 HD3 PRO A 70 4.107 -5.796 -7.086 1.00 0.00 H new ATOM 1131 N ILE A 71 -1.130 -5.744 -5.543 1.00 0.00 N ATOM 1132 CA ILE A 71 -2.446 -6.199 -6.005 1.00 0.00 C ATOM 1133 C ILE A 71 -2.854 -5.320 -7.190 1.00 0.00 C ATOM 1134 O ILE A 71 -3.201 -4.162 -7.013 1.00 0.00 O ATOM 1135 CB ILE A 71 -3.505 -6.169 -4.837 1.00 0.00 C ATOM 1136 CG1 ILE A 71 -3.126 -7.254 -3.767 1.00 0.00 C ATOM 1137 CG2 ILE A 71 -4.950 -6.361 -5.367 1.00 0.00 C ATOM 1138 CD1 ILE A 71 -3.970 -7.264 -2.508 1.00 0.00 C ATOM 0 H ILE A 71 -1.171 -4.970 -4.880 1.00 0.00 H new ATOM 0 HA ILE A 71 -2.399 -7.239 -6.329 1.00 0.00 H new ATOM 0 HB ILE A 71 -3.483 -5.187 -4.365 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -3.193 -8.236 -4.234 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -2.084 -7.107 -3.482 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -5.650 -6.334 -4.532 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -5.190 -5.561 -6.068 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -5.027 -7.323 -5.874 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -3.620 -8.052 -1.841 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.886 -6.300 -2.006 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.012 -7.447 -2.770 1.00 0.00 H new ATOM 1150 N GLU A 72 -2.852 -5.922 -8.386 1.00 0.00 N ATOM 1151 CA GLU A 72 -2.923 -5.208 -9.681 1.00 0.00 C ATOM 1152 C GLU A 72 -4.270 -4.447 -9.851 1.00 0.00 C ATOM 1153 O GLU A 72 -4.367 -3.489 -10.628 1.00 0.00 O ATOM 1154 CB GLU A 72 -2.711 -6.245 -10.821 1.00 0.00 C ATOM 1155 CG GLU A 72 -2.647 -5.658 -12.241 1.00 0.00 C ATOM 1156 CD GLU A 72 -2.456 -6.728 -13.329 1.00 0.00 C ATOM 1157 OE1 GLU A 72 -3.463 -7.335 -13.757 1.00 0.00 O ATOM 1158 OE2 GLU A 72 -1.305 -6.983 -13.753 1.00 0.00 O ATOM 0 H GLU A 72 -2.800 -6.935 -8.490 1.00 0.00 H new ATOM 0 HA GLU A 72 -2.141 -4.450 -9.718 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -1.786 -6.788 -10.628 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.522 -6.973 -10.783 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -3.565 -5.105 -12.441 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -1.826 -4.943 -12.295 1.00 0.00 H new ATOM 1165 N GLU A 73 -5.284 -4.878 -9.086 1.00 0.00 N ATOM 1166 CA GLU A 73 -6.644 -4.322 -9.127 1.00 0.00 C ATOM 1167 C GLU A 73 -6.730 -3.004 -8.335 1.00 0.00 C ATOM 1168 O GLU A 73 -7.242 -2.007 -8.842 1.00 0.00 O ATOM 1169 CB GLU A 73 -7.629 -5.373 -8.559 1.00 0.00 C ATOM 1170 CG GLU A 73 -7.677 -6.675 -9.375 1.00 0.00 C ATOM 1171 CD GLU A 73 -8.506 -7.770 -8.697 1.00 0.00 C ATOM 1172 OE1 GLU A 73 -9.749 -7.672 -8.695 1.00 0.00 O ATOM 1173 OE2 GLU A 73 -7.924 -8.714 -8.133 1.00 0.00 O ATOM 0 H GLU A 73 -5.180 -5.635 -8.411 1.00 0.00 H new ATOM 0 HA GLU A 73 -6.909 -4.093 -10.159 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -7.346 -5.607 -7.533 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -8.629 -4.940 -8.523 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -8.095 -6.466 -10.360 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -6.661 -7.039 -9.531 1.00 0.00 H new ATOM 1180 N GLU A 74 -6.196 -2.999 -7.103 1.00 0.00 N ATOM 1181 CA GLU A 74 -6.272 -1.833 -6.193 1.00 0.00 C ATOM 1182 C GLU A 74 -5.100 -0.877 -6.435 1.00 0.00 C ATOM 1183 O GLU A 74 -5.174 0.324 -6.130 1.00 0.00 O ATOM 1184 CB GLU A 74 -6.268 -2.321 -4.721 1.00 0.00 C ATOM 1185 CG GLU A 74 -7.634 -2.772 -4.164 1.00 0.00 C ATOM 1186 CD GLU A 74 -8.318 -3.901 -4.944 1.00 0.00 C ATOM 1187 OE1 GLU A 74 -7.935 -5.069 -4.779 1.00 0.00 O ATOM 1188 OE2 GLU A 74 -9.273 -3.623 -5.704 1.00 0.00 O ATOM 0 H GLU A 74 -5.700 -3.797 -6.706 1.00 0.00 H new ATOM 0 HA GLU A 74 -7.198 -1.293 -6.393 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -5.568 -3.152 -4.635 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -5.887 -1.517 -4.092 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.498 -3.096 -3.132 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.302 -1.911 -4.143 1.00 0.00 H new ATOM 1195 N VAL A 75 -4.024 -1.434 -6.984 1.00 0.00 N ATOM 1196 CA VAL A 75 -2.771 -0.738 -7.222 1.00 0.00 C ATOM 1197 C VAL A 75 -2.632 -0.465 -8.720 1.00 0.00 C ATOM 1198 O VAL A 75 -2.766 -1.381 -9.534 1.00 0.00 O ATOM 1199 CB VAL A 75 -1.565 -1.585 -6.674 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -0.218 -0.967 -7.061 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -1.682 -1.771 -5.139 1.00 0.00 C ATOM 0 H VAL A 75 -4.003 -2.409 -7.282 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.766 0.214 -6.692 1.00 0.00 H new ATOM 0 HB VAL A 75 -1.609 -2.570 -7.139 1.00 0.00 H new ATOM 0 HG11 VAL A 75 0.591 -1.580 -6.664 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -0.138 -0.919 -8.147 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.147 0.039 -6.647 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -0.838 -2.360 -4.778 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.678 -0.795 -4.653 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -2.612 -2.289 -4.905 1.00 0.00 H new ATOM 1211 N GLU A 76 -2.380 0.795 -9.070 1.00 0.00 N ATOM 1212 CA GLU A 76 -2.294 1.239 -10.463 1.00 0.00 C ATOM 1213 C GLU A 76 -0.867 1.707 -10.747 1.00 0.00 C ATOM 1214 O GLU A 76 -0.377 2.619 -10.083 1.00 0.00 O ATOM 1215 CB GLU A 76 -3.311 2.376 -10.697 1.00 0.00 C ATOM 1216 CG GLU A 76 -3.427 2.838 -12.155 1.00 0.00 C ATOM 1217 CD GLU A 76 -4.421 3.991 -12.311 1.00 0.00 C ATOM 1218 OE1 GLU A 76 -5.646 3.742 -12.312 1.00 0.00 O ATOM 1219 OE2 GLU A 76 -3.986 5.152 -12.413 1.00 0.00 O ATOM 0 H GLU A 76 -2.229 1.542 -8.392 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.533 0.420 -11.142 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -4.292 2.045 -10.355 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.030 3.230 -10.080 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -2.447 3.152 -12.515 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.742 2.000 -12.777 1.00 0.00 H new ATOM 1226 N GLU A 77 -0.211 1.091 -11.738 1.00 0.00 N ATOM 1227 CA GLU A 77 1.201 1.370 -12.065 1.00 0.00 C ATOM 1228 C GLU A 77 1.287 2.527 -13.081 1.00 0.00 C ATOM 1229 O GLU A 77 0.627 2.496 -14.131 1.00 0.00 O ATOM 1230 CB GLU A 77 1.888 0.086 -12.610 1.00 0.00 C ATOM 1231 CG GLU A 77 1.162 -0.574 -13.795 1.00 0.00 C ATOM 1232 CD GLU A 77 1.910 -1.783 -14.355 1.00 0.00 C ATOM 1233 OE1 GLU A 77 2.773 -1.600 -15.237 1.00 0.00 O ATOM 1234 OE2 GLU A 77 1.639 -2.920 -13.916 1.00 0.00 O ATOM 0 H GLU A 77 -0.639 0.386 -12.337 1.00 0.00 H new ATOM 0 HA GLU A 77 1.728 1.674 -11.161 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.904 0.335 -12.916 1.00 0.00 H new ATOM 0 HB3 GLU A 77 1.968 -0.639 -11.800 1.00 0.00 H new ATOM 0 HG2 GLU A 77 0.167 -0.885 -13.477 1.00 0.00 H new ATOM 0 HG3 GLU A 77 1.028 0.162 -14.587 1.00 0.00 H new ATOM 1241 N LYS A 78 2.077 3.563 -12.744 1.00 0.00 N ATOM 1242 CA LYS A 78 2.232 4.779 -13.568 1.00 0.00 C ATOM 1243 C LYS A 78 3.723 5.019 -13.848 1.00 0.00 C ATOM 1244 O LYS A 78 4.463 5.425 -12.950 1.00 0.00 O ATOM 1245 CB LYS A 78 1.611 6.008 -12.838 1.00 0.00 C ATOM 1246 CG LYS A 78 0.127 5.853 -12.426 1.00 0.00 C ATOM 1247 CD LYS A 78 -0.849 5.668 -13.620 1.00 0.00 C ATOM 1248 CE LYS A 78 -1.192 6.974 -14.369 1.00 0.00 C ATOM 1249 NZ LYS A 78 -0.050 7.550 -15.116 1.00 0.00 N ATOM 0 H LYS A 78 2.630 3.581 -11.887 1.00 0.00 H new ATOM 0 HA LYS A 78 1.708 4.643 -14.514 1.00 0.00 H new ATOM 0 HB2 LYS A 78 2.199 6.214 -11.944 1.00 0.00 H new ATOM 0 HB3 LYS A 78 1.702 6.879 -13.487 1.00 0.00 H new ATOM 0 HG2 LYS A 78 0.034 4.996 -11.759 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -0.175 6.733 -11.858 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.411 4.962 -14.326 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.773 5.220 -13.253 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -2.009 6.780 -15.064 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -1.553 7.710 -13.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -0.405 8.092 -15.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 0.492 8.179 -14.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 0.566 6.783 -15.454 1.00 0.00 H new ATOM 1263 N LEU A 79 4.157 4.734 -15.083 1.00 0.00 N ATOM 1264 CA LEU A 79 5.547 4.932 -15.510 1.00 0.00 C ATOM 1265 C LEU A 79 5.867 6.437 -15.548 1.00 0.00 C ATOM 1266 O LEU A 79 5.062 7.244 -16.034 1.00 0.00 O ATOM 1267 CB LEU A 79 5.799 4.289 -16.901 1.00 0.00 C ATOM 1268 CG LEU A 79 7.283 4.300 -17.404 1.00 0.00 C ATOM 1269 CD1 LEU A 79 8.199 3.467 -16.487 1.00 0.00 C ATOM 1270 CD2 LEU A 79 7.384 3.824 -18.865 1.00 0.00 C ATOM 0 H LEU A 79 3.553 4.359 -15.814 1.00 0.00 H new ATOM 0 HA LEU A 79 6.205 4.443 -14.792 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.455 3.255 -16.869 1.00 0.00 H new ATOM 0 HB3 LEU A 79 5.183 4.808 -17.636 1.00 0.00 H new ATOM 0 HG LEU A 79 7.629 5.333 -17.365 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.220 3.498 -16.867 1.00 0.00 H new ATOM 0 HD12 LEU A 79 8.175 3.878 -15.478 1.00 0.00 H new ATOM 0 HD13 LEU A 79 7.851 2.434 -16.466 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.426 3.844 -19.183 1.00 0.00 H new ATOM 0 HD22 LEU A 79 7.000 2.807 -18.944 1.00 0.00 H new ATOM 0 HD23 LEU A 79 6.797 4.484 -19.504 1.00 0.00 H new ATOM 1282 N ASP A 80 7.045 6.786 -15.036 1.00 0.00 N ATOM 1283 CA ASP A 80 7.508 8.170 -14.900 1.00 0.00 C ATOM 1284 C ASP A 80 9.009 8.229 -15.215 1.00 0.00 C ATOM 1285 O ASP A 80 9.817 7.534 -14.586 1.00 0.00 O ATOM 1286 CB ASP A 80 7.234 8.704 -13.469 1.00 0.00 C ATOM 1287 CG ASP A 80 7.624 10.189 -13.299 1.00 0.00 C ATOM 1288 OD1 ASP A 80 8.814 10.486 -13.014 1.00 0.00 O ATOM 1289 OD2 ASP A 80 6.750 11.068 -13.444 1.00 0.00 O ATOM 0 H ASP A 80 7.721 6.102 -14.696 1.00 0.00 H new ATOM 0 HA ASP A 80 6.962 8.801 -15.601 1.00 0.00 H new ATOM 0 HB2 ASP A 80 6.176 8.582 -13.237 1.00 0.00 H new ATOM 0 HB3 ASP A 80 7.789 8.103 -12.749 1.00 0.00 H new ATOM 1294 N THR A 81 9.371 9.060 -16.193 1.00 0.00 N ATOM 1295 CA THR A 81 10.764 9.327 -16.555 1.00 0.00 C ATOM 1296 C THR A 81 11.052 10.811 -16.301 1.00 0.00 C ATOM 1297 O THR A 81 10.949 11.648 -17.212 1.00 0.00 O ATOM 1298 CB THR A 81 11.043 8.914 -18.038 1.00 0.00 C ATOM 1299 OG1 THR A 81 10.122 9.579 -18.917 1.00 0.00 O ATOM 1300 CG2 THR A 81 10.918 7.393 -18.224 1.00 0.00 C ATOM 0 H THR A 81 8.698 9.573 -16.763 1.00 0.00 H new ATOM 0 HA THR A 81 11.436 8.728 -15.941 1.00 0.00 H new ATOM 0 HB THR A 81 12.063 9.211 -18.281 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.057 10.525 -18.668 1.00 0.00 H new ATOM 0 HG21 THR A 81 11.117 7.136 -19.264 1.00 0.00 H new ATOM 0 HG22 THR A 81 11.638 6.887 -17.581 1.00 0.00 H new ATOM 0 HG23 THR A 81 9.910 7.076 -17.959 1.00 0.00 H new ATOM 1308 N SER A 82 11.330 11.134 -15.027 1.00 0.00 N ATOM 1309 CA SER A 82 11.552 12.513 -14.572 1.00 0.00 C ATOM 1310 C SER A 82 12.774 13.147 -15.274 1.00 0.00 C ATOM 1311 O SER A 82 12.648 14.178 -15.947 1.00 0.00 O ATOM 1312 CB SER A 82 11.704 12.557 -13.030 1.00 0.00 C ATOM 1313 OG SER A 82 11.860 13.887 -12.566 1.00 0.00 O ATOM 0 H SER A 82 11.407 10.442 -14.282 1.00 0.00 H new ATOM 0 HA SER A 82 10.679 13.105 -14.845 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.828 12.107 -12.563 1.00 0.00 H new ATOM 0 HB3 SER A 82 12.566 11.961 -12.730 1.00 0.00 H new ATOM 0 HG SER A 82 12.761 14.206 -12.783 1.00 0.00 H new ATOM 1319 N HIS A 83 13.955 12.508 -15.127 1.00 0.00 N ATOM 1320 CA HIS A 83 15.223 12.990 -15.721 1.00 0.00 C ATOM 1321 C HIS A 83 16.074 11.793 -16.180 1.00 0.00 C ATOM 1322 O HIS A 83 16.966 11.333 -15.459 1.00 0.00 O ATOM 1323 CB HIS A 83 16.020 13.887 -14.722 1.00 0.00 C ATOM 1324 CG HIS A 83 15.303 15.154 -14.332 1.00 0.00 C ATOM 1325 ND1 HIS A 83 14.652 15.310 -13.128 1.00 0.00 N ATOM 1326 CD2 HIS A 83 15.107 16.312 -15.012 1.00 0.00 C ATOM 1327 CE1 HIS A 83 14.089 16.499 -13.085 1.00 0.00 C ATOM 1328 NE2 HIS A 83 14.348 17.126 -14.212 1.00 0.00 N ATOM 0 H HIS A 83 14.057 11.644 -14.594 1.00 0.00 H new ATOM 0 HA HIS A 83 14.981 13.607 -16.587 1.00 0.00 H new ATOM 0 HB2 HIS A 83 16.233 13.310 -13.822 1.00 0.00 H new ATOM 0 HB3 HIS A 83 16.980 14.147 -15.169 1.00 0.00 H new ATOM 0 HD2 HIS A 83 15.479 16.548 -15.998 1.00 0.00 H new ATOM 0 HE1 HIS A 83 13.511 16.894 -12.262 1.00 0.00 H new ATOM 0 HE2 HIS A 83 14.034 18.067 -14.452 1.00 0.00 H new ATOM 1337 N GLY A 84 15.725 11.246 -17.357 1.00 0.00 N ATOM 1338 CA GLY A 84 16.532 10.218 -18.041 1.00 0.00 C ATOM 1339 C GLY A 84 16.358 8.795 -17.500 1.00 0.00 C ATOM 1340 O GLY A 84 16.619 7.823 -18.216 1.00 0.00 O ATOM 0 H GLY A 84 14.877 11.503 -17.861 1.00 0.00 H new ATOM 0 HA2 GLY A 84 16.276 10.222 -19.101 1.00 0.00 H new ATOM 0 HA3 GLY A 84 17.584 10.493 -17.966 1.00 0.00 H new ATOM 1344 N MET A 85 15.900 8.675 -16.248 1.00 0.00 N ATOM 1345 CA MET A 85 15.787 7.397 -15.524 1.00 0.00 C ATOM 1346 C MET A 85 14.378 6.803 -15.706 1.00 0.00 C ATOM 1347 O MET A 85 13.385 7.532 -15.669 1.00 0.00 O ATOM 1348 CB MET A 85 16.065 7.647 -14.008 1.00 0.00 C ATOM 1349 CG MET A 85 15.945 6.412 -13.095 1.00 0.00 C ATOM 1350 SD MET A 85 15.806 6.850 -11.346 1.00 0.00 S ATOM 1351 CE MET A 85 17.297 7.823 -11.079 1.00 0.00 C ATOM 0 H MET A 85 15.591 9.476 -15.697 1.00 0.00 H new ATOM 0 HA MET A 85 16.515 6.690 -15.922 1.00 0.00 H new ATOM 0 HB2 MET A 85 17.070 8.057 -13.904 1.00 0.00 H new ATOM 0 HB3 MET A 85 15.372 8.409 -13.651 1.00 0.00 H new ATOM 0 HG2 MET A 85 15.072 5.830 -13.390 1.00 0.00 H new ATOM 0 HG3 MET A 85 16.817 5.773 -13.238 1.00 0.00 H new ATOM 0 HE1 MET A 85 17.399 8.049 -10.018 1.00 0.00 H new ATOM 0 HE2 MET A 85 18.166 7.257 -11.414 1.00 0.00 H new ATOM 0 HE3 MET A 85 17.231 8.753 -11.644 1.00 0.00 H new ATOM 1361 N ILE A 86 14.319 5.478 -15.903 1.00 0.00 N ATOM 1362 CA ILE A 86 13.066 4.706 -15.848 1.00 0.00 C ATOM 1363 C ILE A 86 12.706 4.477 -14.366 1.00 0.00 C ATOM 1364 O ILE A 86 13.543 4.004 -13.588 1.00 0.00 O ATOM 1365 CB ILE A 86 13.198 3.307 -16.571 1.00 0.00 C ATOM 1366 CG1 ILE A 86 13.589 3.473 -18.074 1.00 0.00 C ATOM 1367 CG2 ILE A 86 11.905 2.451 -16.424 1.00 0.00 C ATOM 1368 CD1 ILE A 86 12.556 4.170 -18.944 1.00 0.00 C ATOM 0 H ILE A 86 15.141 4.909 -16.106 1.00 0.00 H new ATOM 0 HA ILE A 86 12.290 5.270 -16.364 1.00 0.00 H new ATOM 0 HB ILE A 86 14.004 2.770 -16.072 1.00 0.00 H new ATOM 0 HG12 ILE A 86 14.523 4.033 -18.129 1.00 0.00 H new ATOM 0 HG13 ILE A 86 13.784 2.486 -18.492 1.00 0.00 H new ATOM 0 HG21 ILE A 86 12.039 1.498 -16.936 1.00 0.00 H new ATOM 0 HG22 ILE A 86 11.706 2.271 -15.368 1.00 0.00 H new ATOM 0 HG23 ILE A 86 11.063 2.984 -16.866 1.00 0.00 H new ATOM 0 HD11 ILE A 86 12.926 4.234 -19.967 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.625 3.603 -18.929 1.00 0.00 H new ATOM 0 HD13 ILE A 86 12.375 5.174 -18.560 1.00 0.00 H new ATOM 1380 N ARG A 87 11.472 4.814 -13.988 1.00 0.00 N ATOM 1381 CA ARG A 87 10.942 4.599 -12.637 1.00 0.00 C ATOM 1382 C ARG A 87 9.418 4.513 -12.743 1.00 0.00 C ATOM 1383 O ARG A 87 8.841 5.033 -13.684 1.00 0.00 O ATOM 1384 CB ARG A 87 11.375 5.753 -11.683 1.00 0.00 C ATOM 1385 CG ARG A 87 11.031 5.512 -10.198 1.00 0.00 C ATOM 1386 CD ARG A 87 11.455 6.671 -9.290 1.00 0.00 C ATOM 1387 NE ARG A 87 12.916 6.908 -9.290 1.00 0.00 N ATOM 1388 CZ ARG A 87 13.560 7.726 -8.438 1.00 0.00 C ATOM 1389 NH1 ARG A 87 12.896 8.370 -7.479 1.00 0.00 N ATOM 1390 NH2 ARG A 87 14.870 7.875 -8.531 1.00 0.00 N ATOM 0 H ARG A 87 10.801 5.251 -14.620 1.00 0.00 H new ATOM 0 HA ARG A 87 11.339 3.675 -12.217 1.00 0.00 H new ATOM 0 HB2 ARG A 87 12.451 5.901 -11.775 1.00 0.00 H new ATOM 0 HB3 ARG A 87 10.897 6.677 -12.009 1.00 0.00 H new ATOM 0 HG2 ARG A 87 9.957 5.355 -10.100 1.00 0.00 H new ATOM 0 HG3 ARG A 87 11.518 4.597 -9.862 1.00 0.00 H new ATOM 0 HD2 ARG A 87 10.946 7.580 -9.611 1.00 0.00 H new ATOM 0 HD3 ARG A 87 11.127 6.465 -8.271 1.00 0.00 H new ATOM 0 HE ARG A 87 13.475 6.415 -9.987 1.00 0.00 H new ATOM 0 HH11 ARG A 87 11.888 8.245 -7.385 1.00 0.00 H new ATOM 0 HH12 ARG A 87 13.396 8.987 -6.839 1.00 0.00 H new ATOM 0 HH21 ARG A 87 15.391 7.370 -9.248 1.00 0.00 H new ATOM 0 HH22 ARG A 87 15.360 8.495 -7.886 1.00 0.00 H new ATOM 1404 N THR A 88 8.765 3.825 -11.807 1.00 0.00 N ATOM 1405 CA THR A 88 7.304 3.687 -11.797 1.00 0.00 C ATOM 1406 C THR A 88 6.786 4.015 -10.404 1.00 0.00 C ATOM 1407 O THR A 88 7.424 3.707 -9.411 1.00 0.00 O ATOM 1408 CB THR A 88 6.873 2.255 -12.255 1.00 0.00 C ATOM 1409 OG1 THR A 88 7.383 2.021 -13.568 1.00 0.00 O ATOM 1410 CG2 THR A 88 5.343 2.047 -12.266 1.00 0.00 C ATOM 0 H THR A 88 9.230 3.348 -11.035 1.00 0.00 H new ATOM 0 HA THR A 88 6.865 4.387 -12.508 1.00 0.00 H new ATOM 0 HB THR A 88 7.282 1.550 -11.531 1.00 0.00 H new ATOM 0 HG1 THR A 88 7.121 1.125 -13.866 1.00 0.00 H new ATOM 0 HG21 THR A 88 5.116 1.032 -12.593 1.00 0.00 H new ATOM 0 HG22 THR A 88 4.948 2.201 -11.262 1.00 0.00 H new ATOM 0 HG23 THR A 88 4.884 2.760 -12.950 1.00 0.00 H new ATOM 1418 N GLU A 89 5.674 4.727 -10.347 1.00 0.00 N ATOM 1419 CA GLU A 89 4.999 5.090 -9.098 1.00 0.00 C ATOM 1420 C GLU A 89 3.605 4.472 -9.108 1.00 0.00 C ATOM 1421 O GLU A 89 2.928 4.500 -10.141 1.00 0.00 O ATOM 1422 CB GLU A 89 4.926 6.628 -8.988 1.00 0.00 C ATOM 1423 CG GLU A 89 6.282 7.347 -9.139 1.00 0.00 C ATOM 1424 CD GLU A 89 6.154 8.879 -9.182 1.00 0.00 C ATOM 1425 OE1 GLU A 89 5.945 9.500 -8.116 1.00 0.00 O ATOM 1426 OE2 GLU A 89 6.255 9.469 -10.273 1.00 0.00 O ATOM 0 H GLU A 89 5.200 5.079 -11.179 1.00 0.00 H new ATOM 0 HA GLU A 89 5.548 4.714 -8.235 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.244 7.002 -9.752 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.496 6.890 -8.021 1.00 0.00 H new ATOM 0 HG2 GLU A 89 6.929 7.066 -8.308 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.768 7.004 -10.052 1.00 0.00 H new ATOM 1433 N VAL A 90 3.171 3.907 -7.974 1.00 0.00 N ATOM 1434 CA VAL A 90 1.869 3.226 -7.881 1.00 0.00 C ATOM 1435 C VAL A 90 0.850 4.126 -7.180 1.00 0.00 C ATOM 1436 O VAL A 90 0.977 4.441 -5.994 1.00 0.00 O ATOM 1437 CB VAL A 90 1.968 1.819 -7.188 1.00 0.00 C ATOM 1438 CG1 VAL A 90 2.620 0.798 -8.142 1.00 0.00 C ATOM 1439 CG2 VAL A 90 2.734 1.867 -5.845 1.00 0.00 C ATOM 0 H VAL A 90 3.703 3.907 -7.104 1.00 0.00 H new ATOM 0 HA VAL A 90 1.527 3.037 -8.898 1.00 0.00 H new ATOM 0 HB VAL A 90 0.950 1.504 -6.960 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.682 -0.172 -7.649 1.00 0.00 H new ATOM 0 HG12 VAL A 90 2.017 0.708 -9.046 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.622 1.136 -8.407 1.00 0.00 H new ATOM 0 HG21 VAL A 90 2.771 0.868 -5.411 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.749 2.226 -6.018 1.00 0.00 H new ATOM 0 HG23 VAL A 90 2.223 2.542 -5.158 1.00 0.00 H new ATOM 1449 N ARG A 91 -0.123 4.592 -7.966 1.00 0.00 N ATOM 1450 CA ARG A 91 -1.182 5.492 -7.510 1.00 0.00 C ATOM 1451 C ARG A 91 -2.270 5.565 -8.586 1.00 0.00 C ATOM 1452 O ARG A 91 -1.963 5.464 -9.783 1.00 0.00 O ATOM 1453 CB ARG A 91 -0.644 6.923 -7.175 1.00 0.00 C ATOM 1454 CG ARG A 91 -0.143 7.793 -8.359 1.00 0.00 C ATOM 1455 CD ARG A 91 1.203 7.337 -8.937 1.00 0.00 C ATOM 1456 NE ARG A 91 1.635 8.167 -10.077 1.00 0.00 N ATOM 1457 CZ ARG A 91 2.599 9.103 -10.036 1.00 0.00 C ATOM 1458 NH1 ARG A 91 3.112 9.512 -8.876 1.00 0.00 N ATOM 1459 NH2 ARG A 91 3.020 9.657 -11.157 1.00 0.00 N ATOM 0 H ARG A 91 -0.197 4.350 -8.954 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.596 5.091 -6.585 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -1.438 7.471 -6.667 1.00 0.00 H new ATOM 0 HB3 ARG A 91 0.176 6.817 -6.464 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.892 7.778 -9.151 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.053 8.827 -8.025 1.00 0.00 H new ATOM 0 HD2 ARG A 91 1.962 7.374 -8.156 1.00 0.00 H new ATOM 0 HD3 ARG A 91 1.125 6.298 -9.257 1.00 0.00 H new ATOM 0 HE ARG A 91 1.164 8.019 -10.969 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.774 9.114 -8.000 1.00 0.00 H new ATOM 0 HH12 ARG A 91 3.843 10.223 -8.864 1.00 0.00 H new ATOM 0 HH21 ARG A 91 2.614 9.375 -12.049 1.00 0.00 H new ATOM 0 HH22 ARG A 91 3.751 10.368 -11.131 1.00 0.00 H new ATOM 1473 N SER A 92 -3.534 5.717 -8.168 1.00 0.00 N ATOM 1474 CA SER A 92 -4.623 6.122 -9.077 1.00 0.00 C ATOM 1475 C SER A 92 -4.819 7.654 -8.955 1.00 0.00 C ATOM 1476 O SER A 92 -4.059 8.326 -8.248 1.00 0.00 O ATOM 1477 CB SER A 92 -5.909 5.323 -8.775 1.00 0.00 C ATOM 1478 OG SER A 92 -6.886 5.482 -9.792 1.00 0.00 O ATOM 0 H SER A 92 -3.831 5.566 -7.204 1.00 0.00 H new ATOM 0 HA SER A 92 -4.366 5.893 -10.111 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.663 4.266 -8.671 1.00 0.00 H new ATOM 0 HB3 SER A 92 -6.323 5.649 -7.821 1.00 0.00 H new ATOM 0 HG SER A 92 -6.604 4.996 -10.595 1.00 0.00 H new ATOM 1484 N ARG A 93 -5.821 8.211 -9.650 1.00 0.00 N ATOM 1485 CA ARG A 93 -5.923 9.677 -9.853 1.00 0.00 C ATOM 1486 C ARG A 93 -6.718 10.375 -8.718 1.00 0.00 C ATOM 1487 O ARG A 93 -6.266 11.403 -8.186 1.00 0.00 O ATOM 1488 CB ARG A 93 -6.530 9.999 -11.246 1.00 0.00 C ATOM 1489 CG ARG A 93 -6.457 11.496 -11.641 1.00 0.00 C ATOM 1490 CD ARG A 93 -6.920 11.771 -13.082 1.00 0.00 C ATOM 1491 NE ARG A 93 -8.339 11.423 -13.296 1.00 0.00 N ATOM 1492 CZ ARG A 93 -9.308 12.277 -13.675 1.00 0.00 C ATOM 1493 NH1 ARG A 93 -9.057 13.568 -13.850 1.00 0.00 N ATOM 1494 NH2 ARG A 93 -10.542 11.828 -13.860 1.00 0.00 N ATOM 0 H ARG A 93 -6.574 7.676 -10.083 1.00 0.00 H new ATOM 0 HA ARG A 93 -4.910 10.079 -9.818 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.010 9.410 -12.001 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -7.573 9.682 -11.257 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -7.072 12.076 -10.953 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -5.431 11.845 -11.524 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -6.769 12.825 -13.314 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -6.301 11.200 -13.774 1.00 0.00 H new ATOM 0 HE ARG A 93 -8.608 10.451 -13.143 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -8.116 13.930 -13.697 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -9.805 14.199 -14.138 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -10.752 10.841 -13.715 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.281 12.470 -14.147 1.00 0.00 H new ATOM 1508 N THR A 94 -7.889 9.814 -8.342 1.00 0.00 N ATOM 1509 CA THR A 94 -8.834 10.486 -7.418 1.00 0.00 C ATOM 1510 C THR A 94 -8.470 10.276 -5.920 1.00 0.00 C ATOM 1511 O THR A 94 -8.020 11.211 -5.253 1.00 0.00 O ATOM 1512 CB THR A 94 -10.302 9.986 -7.687 1.00 0.00 C ATOM 1513 OG1 THR A 94 -10.640 10.186 -9.065 1.00 0.00 O ATOM 1514 CG2 THR A 94 -11.347 10.693 -6.797 1.00 0.00 C ATOM 0 H THR A 94 -8.203 8.898 -8.663 1.00 0.00 H new ATOM 0 HA THR A 94 -8.762 11.555 -7.617 1.00 0.00 H new ATOM 0 HB THR A 94 -10.325 8.925 -7.438 1.00 0.00 H new ATOM 0 HG1 THR A 94 -11.554 9.871 -9.227 1.00 0.00 H new ATOM 0 HG21 THR A 94 -12.341 10.308 -7.027 1.00 0.00 H new ATOM 0 HG22 THR A 94 -11.118 10.505 -5.748 1.00 0.00 H new ATOM 0 HG23 THR A 94 -11.321 11.766 -6.987 1.00 0.00 H new ATOM 1522 N ALA A 95 -8.625 9.036 -5.423 1.00 0.00 N ATOM 1523 CA ALA A 95 -8.550 8.719 -3.973 1.00 0.00 C ATOM 1524 C ALA A 95 -7.419 7.722 -3.669 1.00 0.00 C ATOM 1525 O ALA A 95 -6.763 7.798 -2.621 1.00 0.00 O ATOM 1526 CB ALA A 95 -9.913 8.168 -3.502 1.00 0.00 C ATOM 0 H ALA A 95 -8.806 8.221 -6.009 1.00 0.00 H new ATOM 0 HA ALA A 95 -8.321 9.634 -3.427 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -9.863 7.934 -2.439 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -10.687 8.917 -3.673 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -10.153 7.264 -4.062 1.00 0.00 H new ATOM 1532 N ASP A 96 -7.191 6.796 -4.614 1.00 0.00 N ATOM 1533 CA ASP A 96 -6.193 5.701 -4.478 1.00 0.00 C ATOM 1534 C ASP A 96 -4.753 6.196 -4.782 1.00 0.00 C ATOM 1535 O ASP A 96 -3.842 5.397 -5.004 1.00 0.00 O ATOM 1536 CB ASP A 96 -6.569 4.498 -5.388 1.00 0.00 C ATOM 1537 CG ASP A 96 -8.031 4.030 -5.240 1.00 0.00 C ATOM 1538 OD1 ASP A 96 -8.925 4.635 -5.879 1.00 0.00 O ATOM 1539 OD2 ASP A 96 -8.300 3.068 -4.486 1.00 0.00 O ATOM 0 H ASP A 96 -7.692 6.778 -5.502 1.00 0.00 H new ATOM 0 HA ASP A 96 -6.211 5.367 -3.441 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -6.390 4.773 -6.428 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -5.907 3.663 -5.160 1.00 0.00 H new ATOM 1544 N SER A 97 -4.575 7.525 -4.858 1.00 0.00 N ATOM 1545 CA SER A 97 -3.270 8.184 -5.071 1.00 0.00 C ATOM 1546 C SER A 97 -2.253 7.939 -3.920 1.00 0.00 C ATOM 1547 O SER A 97 -1.043 8.135 -4.096 1.00 0.00 O ATOM 1548 CB SER A 97 -3.517 9.695 -5.255 1.00 0.00 C ATOM 1549 OG SER A 97 -4.333 10.203 -4.215 1.00 0.00 O ATOM 0 H SER A 97 -5.347 8.186 -4.772 1.00 0.00 H new ATOM 0 HA SER A 97 -2.817 7.746 -5.961 1.00 0.00 H new ATOM 0 HB2 SER A 97 -2.564 10.225 -5.267 1.00 0.00 H new ATOM 0 HB3 SER A 97 -3.994 9.875 -6.218 1.00 0.00 H new ATOM 0 HG SER A 97 -4.476 11.163 -4.350 1.00 0.00 H new ATOM 1555 N HIS A 98 -2.758 7.498 -2.764 1.00 0.00 N ATOM 1556 CA HIS A 98 -1.992 7.416 -1.503 1.00 0.00 C ATOM 1557 C HIS A 98 -1.091 6.165 -1.371 1.00 0.00 C ATOM 1558 O HIS A 98 -0.435 6.012 -0.336 1.00 0.00 O ATOM 1559 CB HIS A 98 -2.959 7.495 -0.296 1.00 0.00 C ATOM 1560 CG HIS A 98 -3.826 8.719 -0.282 1.00 0.00 C ATOM 1561 ND1 HIS A 98 -5.199 8.664 -0.321 1.00 0.00 N ATOM 1562 CD2 HIS A 98 -3.504 10.032 -0.208 1.00 0.00 C ATOM 1563 CE1 HIS A 98 -5.691 9.887 -0.276 1.00 0.00 C ATOM 1564 NE2 HIS A 98 -4.679 10.739 -0.208 1.00 0.00 N ATOM 0 H HIS A 98 -3.723 7.182 -2.670 1.00 0.00 H new ATOM 0 HA HIS A 98 -1.312 8.268 -1.517 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -3.597 6.611 -0.298 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -2.376 7.466 0.625 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -2.508 10.445 -0.158 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -6.739 10.149 -0.292 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -4.760 11.755 -0.163 1.00 0.00 H new ATOM 1573 N LEU A 99 -1.081 5.261 -2.376 1.00 0.00 N ATOM 1574 CA LEU A 99 -0.369 3.952 -2.274 1.00 0.00 C ATOM 1575 C LEU A 99 1.144 4.128 -1.965 1.00 0.00 C ATOM 1576 O LEU A 99 1.578 3.966 -0.819 1.00 0.00 O ATOM 1577 CB LEU A 99 -0.531 3.111 -3.579 1.00 0.00 C ATOM 1578 CG LEU A 99 -1.928 3.131 -4.252 1.00 0.00 C ATOM 1579 CD1 LEU A 99 -1.947 2.300 -5.543 1.00 0.00 C ATOM 1580 CD2 LEU A 99 -3.036 2.695 -3.284 1.00 0.00 C ATOM 0 H LEU A 99 -1.554 5.406 -3.268 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.832 3.421 -1.443 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.201 3.465 -4.305 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -0.278 2.076 -3.350 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.133 4.165 -4.528 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.942 2.338 -5.986 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -1.221 2.706 -6.247 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.691 1.266 -5.314 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.998 2.723 -3.796 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.839 1.680 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.060 3.371 -2.430 1.00 0.00 H new ATOM 1592 N GLY A 100 1.932 4.521 -2.980 1.00 0.00 N ATOM 1593 CA GLY A 100 3.384 4.573 -2.843 1.00 0.00 C ATOM 1594 C GLY A 100 4.087 4.700 -4.181 1.00 0.00 C ATOM 1595 O GLY A 100 3.498 5.144 -5.169 1.00 0.00 O ATOM 0 H GLY A 100 1.584 4.804 -3.896 1.00 0.00 H new ATOM 0 HA2 GLY A 100 3.656 5.418 -2.211 1.00 0.00 H new ATOM 0 HA3 GLY A 100 3.731 3.672 -2.337 1.00 0.00 H new ATOM 1599 N HIS A 101 5.381 4.355 -4.190 1.00 0.00 N ATOM 1600 CA HIS A 101 6.271 4.455 -5.370 1.00 0.00 C ATOM 1601 C HIS A 101 7.062 3.139 -5.472 1.00 0.00 C ATOM 1602 O HIS A 101 7.303 2.504 -4.447 1.00 0.00 O ATOM 1603 CB HIS A 101 7.222 5.684 -5.205 1.00 0.00 C ATOM 1604 CG HIS A 101 6.507 6.953 -4.782 1.00 0.00 C ATOM 1605 ND1 HIS A 101 5.933 7.830 -5.671 1.00 0.00 N ATOM 1606 CD2 HIS A 101 6.202 7.431 -3.549 1.00 0.00 C ATOM 1607 CE1 HIS A 101 5.299 8.781 -5.013 1.00 0.00 C ATOM 1608 NE2 HIS A 101 5.444 8.562 -3.726 1.00 0.00 N ATOM 0 H HIS A 101 5.855 3.990 -3.364 1.00 0.00 H new ATOM 0 HA HIS A 101 5.699 4.604 -6.286 1.00 0.00 H new ATOM 0 HB2 HIS A 101 7.987 5.444 -4.466 1.00 0.00 H new ATOM 0 HB3 HIS A 101 7.736 5.864 -6.149 1.00 0.00 H new ATOM 0 HD2 HIS A 101 6.500 7.001 -2.604 1.00 0.00 H new ATOM 0 HE1 HIS A 101 4.753 9.601 -5.457 1.00 0.00 H new ATOM 0 HE2 HIS A 101 5.056 9.139 -2.979 1.00 0.00 H new ATOM 1617 N VAL A 102 7.481 2.725 -6.683 1.00 0.00 N ATOM 1618 CA VAL A 102 8.181 1.430 -6.871 1.00 0.00 C ATOM 1619 C VAL A 102 9.523 1.676 -7.565 1.00 0.00 C ATOM 1620 O VAL A 102 9.661 2.571 -8.410 1.00 0.00 O ATOM 1621 CB VAL A 102 7.324 0.335 -7.648 1.00 0.00 C ATOM 1622 CG1 VAL A 102 5.898 0.228 -7.084 1.00 0.00 C ATOM 1623 CG2 VAL A 102 7.276 0.550 -9.169 1.00 0.00 C ATOM 0 H VAL A 102 7.351 3.260 -7.542 1.00 0.00 H new ATOM 0 HA VAL A 102 8.343 1.009 -5.879 1.00 0.00 H new ATOM 0 HB VAL A 102 7.847 -0.607 -7.480 1.00 0.00 H new ATOM 0 HG11 VAL A 102 5.343 -0.529 -7.639 1.00 0.00 H new ATOM 0 HG12 VAL A 102 5.943 -0.054 -6.032 1.00 0.00 H new ATOM 0 HG13 VAL A 102 5.395 1.190 -7.181 1.00 0.00 H new ATOM 0 HG21 VAL A 102 6.675 -0.234 -9.629 1.00 0.00 H new ATOM 0 HG22 VAL A 102 6.832 1.522 -9.385 1.00 0.00 H new ATOM 0 HG23 VAL A 102 8.288 0.516 -9.573 1.00 0.00 H new ATOM 1633 N PHE A 103 10.535 0.916 -7.155 1.00 0.00 N ATOM 1634 CA PHE A 103 11.883 0.998 -7.722 1.00 0.00 C ATOM 1635 C PHE A 103 12.250 -0.330 -8.381 1.00 0.00 C ATOM 1636 O PHE A 103 11.795 -1.399 -7.951 1.00 0.00 O ATOM 1637 CB PHE A 103 12.901 1.375 -6.612 1.00 0.00 C ATOM 1638 CG PHE A 103 12.638 2.749 -5.981 1.00 0.00 C ATOM 1639 CD1 PHE A 103 13.200 3.906 -6.519 1.00 0.00 C ATOM 1640 CD2 PHE A 103 11.813 2.881 -4.857 1.00 0.00 C ATOM 1641 CE1 PHE A 103 12.955 5.144 -5.957 1.00 0.00 C ATOM 1642 CE2 PHE A 103 11.570 4.120 -4.295 1.00 0.00 C ATOM 1643 CZ PHE A 103 12.139 5.253 -4.847 1.00 0.00 C ATOM 0 H PHE A 103 10.445 0.220 -6.415 1.00 0.00 H new ATOM 0 HA PHE A 103 11.911 1.775 -8.486 1.00 0.00 H new ATOM 0 HB2 PHE A 103 12.874 0.614 -5.832 1.00 0.00 H new ATOM 0 HB3 PHE A 103 13.906 1.364 -7.033 1.00 0.00 H new ATOM 0 HD1 PHE A 103 13.837 3.833 -7.388 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.360 2.002 -4.423 1.00 0.00 H new ATOM 0 HE1 PHE A 103 13.402 6.029 -6.386 1.00 0.00 H new ATOM 0 HE2 PHE A 103 10.936 4.203 -3.425 1.00 0.00 H new ATOM 0 HZ PHE A 103 11.946 6.222 -4.411 1.00 0.00 H new ATOM 1653 N ASN A 104 13.097 -0.244 -9.422 1.00 0.00 N ATOM 1654 CA ASN A 104 13.591 -1.418 -10.175 1.00 0.00 C ATOM 1655 C ASN A 104 14.852 -2.016 -9.483 1.00 0.00 C ATOM 1656 O ASN A 104 15.547 -2.872 -10.032 1.00 0.00 O ATOM 1657 CB ASN A 104 13.859 -1.003 -11.662 1.00 0.00 C ATOM 1658 CG ASN A 104 14.063 -2.190 -12.618 1.00 0.00 C ATOM 1659 OD1 ASN A 104 15.193 -2.619 -12.870 1.00 0.00 O ATOM 1660 ND2 ASN A 104 12.967 -2.730 -13.154 1.00 0.00 N ATOM 0 H ASN A 104 13.461 0.643 -9.768 1.00 0.00 H new ATOM 0 HA ASN A 104 12.837 -2.205 -10.180 1.00 0.00 H new ATOM 0 HB2 ASN A 104 13.021 -0.404 -12.017 1.00 0.00 H new ATOM 0 HB3 ASN A 104 14.743 -0.366 -11.697 1.00 0.00 H new ATOM 0 HD21 ASN A 104 13.048 -3.521 -13.793 1.00 0.00 H new ATOM 0 HD22 ASN A 104 12.048 -2.352 -12.925 1.00 0.00 H new ATOM 1667 N ASP A 105 15.083 -1.604 -8.217 1.00 0.00 N ATOM 1668 CA ASP A 105 16.206 -2.088 -7.380 1.00 0.00 C ATOM 1669 C ASP A 105 15.816 -3.399 -6.640 1.00 0.00 C ATOM 1670 O ASP A 105 16.599 -3.955 -5.855 1.00 0.00 O ATOM 1671 CB ASP A 105 16.609 -0.963 -6.382 1.00 0.00 C ATOM 1672 CG ASP A 105 17.842 -1.299 -5.510 1.00 0.00 C ATOM 1673 OD1 ASP A 105 18.963 -1.375 -6.053 1.00 0.00 O ATOM 1674 OD2 ASP A 105 17.690 -1.505 -4.285 1.00 0.00 O ATOM 0 H ASP A 105 14.492 -0.921 -7.743 1.00 0.00 H new ATOM 0 HA ASP A 105 17.063 -2.324 -8.011 1.00 0.00 H new ATOM 0 HB2 ASP A 105 16.813 -0.051 -6.943 1.00 0.00 H new ATOM 0 HB3 ASP A 105 15.762 -0.753 -5.728 1.00 0.00 H new ATOM 1679 N GLY A 106 14.594 -3.890 -6.913 1.00 0.00 N ATOM 1680 CA GLY A 106 14.096 -5.152 -6.357 1.00 0.00 C ATOM 1681 C GLY A 106 13.816 -6.185 -7.453 1.00 0.00 C ATOM 1682 O GLY A 106 13.332 -5.808 -8.522 1.00 0.00 O ATOM 0 H GLY A 106 13.927 -3.420 -7.526 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.828 -5.554 -5.657 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.183 -4.965 -5.792 1.00 0.00 H new ATOM 1686 N PRO A 107 14.104 -7.508 -7.223 1.00 0.00 N ATOM 1687 CA PRO A 107 13.869 -8.575 -8.230 1.00 0.00 C ATOM 1688 C PRO A 107 12.372 -8.940 -8.345 1.00 0.00 C ATOM 1689 O PRO A 107 11.665 -8.983 -7.332 1.00 0.00 O ATOM 1690 CB PRO A 107 14.711 -9.757 -7.676 1.00 0.00 C ATOM 1691 CG PRO A 107 14.673 -9.569 -6.185 1.00 0.00 C ATOM 1692 CD PRO A 107 14.669 -8.065 -5.959 1.00 0.00 C ATOM 0 HA PRO A 107 14.152 -8.281 -9.241 1.00 0.00 H new ATOM 0 HB2 PRO A 107 14.288 -10.718 -7.967 1.00 0.00 H new ATOM 0 HB3 PRO A 107 15.733 -9.730 -8.055 1.00 0.00 H new ATOM 0 HG2 PRO A 107 13.785 -10.032 -5.755 1.00 0.00 H new ATOM 0 HG3 PRO A 107 15.537 -10.034 -5.710 1.00 0.00 H new ATOM 0 HD2 PRO A 107 14.060 -7.793 -5.097 1.00 0.00 H new ATOM 0 HD3 PRO A 107 15.674 -7.687 -5.771 1.00 0.00 H new ATOM 1700 N GLY A 108 11.897 -9.187 -9.581 1.00 0.00 N ATOM 1701 CA GLY A 108 10.516 -9.614 -9.799 1.00 0.00 C ATOM 1702 C GLY A 108 10.174 -9.905 -11.253 1.00 0.00 C ATOM 1703 O GLY A 108 11.066 -9.871 -12.110 1.00 0.00 O ATOM 0 H GLY A 108 12.450 -9.097 -10.433 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.327 -10.509 -9.207 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.845 -8.839 -9.428 1.00 0.00 H new ATOM 1707 N PRO A 109 8.863 -10.212 -11.558 1.00 0.00 N ATOM 1708 CA PRO A 109 8.368 -10.427 -12.947 1.00 0.00 C ATOM 1709 C PRO A 109 8.649 -9.217 -13.860 1.00 0.00 C ATOM 1710 O PRO A 109 9.140 -9.370 -14.986 1.00 0.00 O ATOM 1711 CB PRO A 109 6.840 -10.654 -12.755 1.00 0.00 C ATOM 1712 CG PRO A 109 6.713 -11.158 -11.348 1.00 0.00 C ATOM 1713 CD PRO A 109 7.769 -10.414 -10.560 1.00 0.00 C ATOM 0 HA PRO A 109 8.866 -11.262 -13.441 1.00 0.00 H new ATOM 0 HB2 PRO A 109 6.280 -9.730 -12.898 1.00 0.00 H new ATOM 0 HB3 PRO A 109 6.452 -11.377 -13.473 1.00 0.00 H new ATOM 0 HG2 PRO A 109 5.717 -10.966 -10.950 1.00 0.00 H new ATOM 0 HG3 PRO A 109 6.873 -12.235 -11.300 1.00 0.00 H new ATOM 0 HD2 PRO A 109 7.392 -9.465 -10.178 1.00 0.00 H new ATOM 0 HD3 PRO A 109 8.110 -10.990 -9.700 1.00 0.00 H new ATOM 1721 N ASN A 110 8.341 -8.012 -13.347 1.00 0.00 N ATOM 1722 CA ASN A 110 8.598 -6.734 -14.049 1.00 0.00 C ATOM 1723 C ASN A 110 9.882 -6.066 -13.492 1.00 0.00 C ATOM 1724 O ASN A 110 10.184 -4.910 -13.809 1.00 0.00 O ATOM 1725 CB ASN A 110 7.354 -5.800 -13.901 1.00 0.00 C ATOM 1726 CG ASN A 110 7.249 -4.739 -15.003 1.00 0.00 C ATOM 1727 OD1 ASN A 110 6.607 -4.961 -16.025 1.00 0.00 O ATOM 1728 ND2 ASN A 110 7.896 -3.597 -14.820 1.00 0.00 N ATOM 0 H ASN A 110 7.906 -7.893 -12.432 1.00 0.00 H new ATOM 0 HA ASN A 110 8.760 -6.923 -15.110 1.00 0.00 H new ATOM 0 HB2 ASN A 110 6.450 -6.409 -13.907 1.00 0.00 H new ATOM 0 HB3 ASN A 110 7.397 -5.303 -12.932 1.00 0.00 H new ATOM 0 HD21 ASN A 110 7.868 -2.874 -15.539 1.00 0.00 H new ATOM 0 HD22 ASN A 110 8.422 -3.441 -13.960 1.00 0.00 H new ATOM 1735 N GLY A 111 10.663 -6.845 -12.713 1.00 0.00 N ATOM 1736 CA GLY A 111 11.837 -6.346 -11.991 1.00 0.00 C ATOM 1737 C GLY A 111 11.559 -5.162 -11.063 1.00 0.00 C ATOM 1738 O GLY A 111 12.436 -4.329 -10.846 1.00 0.00 O ATOM 0 H GLY A 111 10.490 -7.840 -12.571 1.00 0.00 H new ATOM 0 HA2 GLY A 111 12.258 -7.161 -11.402 1.00 0.00 H new ATOM 0 HA3 GLY A 111 12.595 -6.052 -12.717 1.00 0.00 H new ATOM 1742 N LEU A 112 10.347 -5.112 -10.490 1.00 0.00 N ATOM 1743 CA LEU A 112 9.902 -3.990 -9.635 1.00 0.00 C ATOM 1744 C LEU A 112 9.799 -4.448 -8.181 1.00 0.00 C ATOM 1745 O LEU A 112 9.784 -5.650 -7.892 1.00 0.00 O ATOM 1746 CB LEU A 112 8.534 -3.418 -10.118 1.00 0.00 C ATOM 1747 CG LEU A 112 8.547 -2.678 -11.493 1.00 0.00 C ATOM 1748 CD1 LEU A 112 7.135 -2.175 -11.875 1.00 0.00 C ATOM 1749 CD2 LEU A 112 9.592 -1.533 -11.515 1.00 0.00 C ATOM 0 H LEU A 112 9.646 -5.844 -10.603 1.00 0.00 H new ATOM 0 HA LEU A 112 10.643 -3.194 -9.709 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.820 -4.239 -10.177 1.00 0.00 H new ATOM 0 HB3 LEU A 112 8.164 -2.728 -9.360 1.00 0.00 H new ATOM 0 HG LEU A 112 8.850 -3.400 -12.251 1.00 0.00 H new ATOM 0 HD11 LEU A 112 7.179 -1.664 -12.837 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.453 -3.023 -11.945 1.00 0.00 H new ATOM 0 HD13 LEU A 112 6.777 -1.483 -11.113 1.00 0.00 H new ATOM 0 HD21 LEU A 112 9.572 -1.041 -12.487 1.00 0.00 H new ATOM 0 HD22 LEU A 112 9.354 -0.808 -10.737 1.00 0.00 H new ATOM 0 HD23 LEU A 112 10.586 -1.944 -11.336 1.00 0.00 H new ATOM 1761 N ARG A 113 9.736 -3.468 -7.282 1.00 0.00 N ATOM 1762 CA ARG A 113 9.510 -3.683 -5.855 1.00 0.00 C ATOM 1763 C ARG A 113 8.745 -2.486 -5.302 1.00 0.00 C ATOM 1764 O ARG A 113 9.260 -1.357 -5.335 1.00 0.00 O ATOM 1765 CB ARG A 113 10.852 -3.859 -5.100 1.00 0.00 C ATOM 1766 CG ARG A 113 10.709 -4.055 -3.572 1.00 0.00 C ATOM 1767 CD ARG A 113 12.056 -4.309 -2.880 1.00 0.00 C ATOM 1768 NE ARG A 113 13.006 -3.196 -3.076 1.00 0.00 N ATOM 1769 CZ ARG A 113 14.346 -3.313 -3.110 1.00 0.00 C ATOM 1770 NH1 ARG A 113 14.942 -4.496 -3.026 1.00 0.00 N ATOM 1771 NH2 ARG A 113 15.091 -2.235 -3.273 1.00 0.00 N ATOM 0 H ARG A 113 9.843 -2.484 -7.530 1.00 0.00 H new ATOM 0 HA ARG A 113 8.932 -4.596 -5.713 1.00 0.00 H new ATOM 0 HB2 ARG A 113 11.378 -4.718 -5.516 1.00 0.00 H new ATOM 0 HB3 ARG A 113 11.475 -2.984 -5.284 1.00 0.00 H new ATOM 0 HG2 ARG A 113 10.243 -3.170 -3.138 1.00 0.00 H new ATOM 0 HG3 ARG A 113 10.041 -4.894 -3.378 1.00 0.00 H new ATOM 0 HD2 ARG A 113 11.891 -4.459 -1.813 1.00 0.00 H new ATOM 0 HD3 ARG A 113 12.493 -5.229 -3.268 1.00 0.00 H new ATOM 0 HE ARG A 113 12.614 -2.262 -3.195 1.00 0.00 H new ATOM 0 HH11 ARG A 113 14.382 -5.344 -2.933 1.00 0.00 H new ATOM 0 HH12 ARG A 113 15.960 -4.557 -3.054 1.00 0.00 H new ATOM 0 HH21 ARG A 113 14.650 -1.321 -3.372 1.00 0.00 H new ATOM 0 HH22 ARG A 113 16.107 -2.317 -3.300 1.00 0.00 H new ATOM 1785 N TYR A 114 7.515 -2.736 -4.804 1.00 0.00 N ATOM 1786 CA TYR A 114 6.682 -1.691 -4.207 1.00 0.00 C ATOM 1787 C TYR A 114 7.322 -1.178 -2.914 1.00 0.00 C ATOM 1788 O TYR A 114 7.842 -1.963 -2.117 1.00 0.00 O ATOM 1789 CB TYR A 114 5.206 -2.163 -3.979 1.00 0.00 C ATOM 1790 CG TYR A 114 4.986 -3.337 -2.989 1.00 0.00 C ATOM 1791 CD1 TYR A 114 5.057 -3.151 -1.603 1.00 0.00 C ATOM 1792 CD2 TYR A 114 4.701 -4.624 -3.442 1.00 0.00 C ATOM 1793 CE1 TYR A 114 4.865 -4.189 -0.721 1.00 0.00 C ATOM 1794 CE2 TYR A 114 4.504 -5.662 -2.555 1.00 0.00 C ATOM 1795 CZ TYR A 114 4.586 -5.442 -1.202 1.00 0.00 C ATOM 1796 OH TYR A 114 4.392 -6.491 -0.327 1.00 0.00 O ATOM 0 H TYR A 114 7.083 -3.660 -4.808 1.00 0.00 H new ATOM 0 HA TYR A 114 6.628 -0.864 -4.915 1.00 0.00 H new ATOM 0 HB2 TYR A 114 4.628 -1.309 -3.625 1.00 0.00 H new ATOM 0 HB3 TYR A 114 4.790 -2.452 -4.944 1.00 0.00 H new ATOM 0 HD1 TYR A 114 5.268 -2.165 -1.216 1.00 0.00 H new ATOM 0 HD2 TYR A 114 4.633 -4.811 -4.503 1.00 0.00 H new ATOM 0 HE1 TYR A 114 4.934 -4.018 0.343 1.00 0.00 H new ATOM 0 HE2 TYR A 114 4.284 -6.652 -2.926 1.00 0.00 H new ATOM 0 HH TYR A 114 3.680 -6.262 0.306 1.00 0.00 H new ATOM 1806 N CYS A 115 7.356 0.142 -2.768 1.00 0.00 N ATOM 1807 CA CYS A 115 7.668 0.799 -1.505 1.00 0.00 C ATOM 1808 C CYS A 115 6.435 1.622 -1.141 1.00 0.00 C ATOM 1809 O CYS A 115 6.242 2.751 -1.622 1.00 0.00 O ATOM 1810 CB CYS A 115 8.936 1.674 -1.664 1.00 0.00 C ATOM 1811 SG CYS A 115 10.358 0.756 -2.281 1.00 0.00 S ATOM 0 H CYS A 115 7.166 0.792 -3.531 1.00 0.00 H new ATOM 0 HA CYS A 115 7.889 0.088 -0.709 1.00 0.00 H new ATOM 0 HB2 CYS A 115 8.719 2.497 -2.346 1.00 0.00 H new ATOM 0 HB3 CYS A 115 9.188 2.117 -0.700 1.00 0.00 H new ATOM 0 HG CYS A 115 11.377 1.556 -2.389 1.00 0.00 H new ATOM 1817 N ILE A 116 5.571 1.015 -0.321 1.00 0.00 N ATOM 1818 CA ILE A 116 4.289 1.599 0.075 1.00 0.00 C ATOM 1819 C ILE A 116 4.467 2.217 1.456 1.00 0.00 C ATOM 1820 O ILE A 116 4.971 1.550 2.372 1.00 0.00 O ATOM 1821 CB ILE A 116 3.145 0.515 0.081 1.00 0.00 C ATOM 1822 CG1 ILE A 116 3.079 -0.246 -1.281 1.00 0.00 C ATOM 1823 CG2 ILE A 116 1.780 1.150 0.408 1.00 0.00 C ATOM 1824 CD1 ILE A 116 2.786 0.619 -2.492 1.00 0.00 C ATOM 0 H ILE A 116 5.745 0.097 0.089 1.00 0.00 H new ATOM 0 HA ILE A 116 3.990 2.363 -0.642 1.00 0.00 H new ATOM 0 HB ILE A 116 3.383 -0.206 0.863 1.00 0.00 H new ATOM 0 HG12 ILE A 116 4.029 -0.756 -1.440 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.312 -1.017 -1.211 1.00 0.00 H new ATOM 0 HG21 ILE A 116 1.010 0.379 0.405 1.00 0.00 H new ATOM 0 HG22 ILE A 116 1.822 1.617 1.392 1.00 0.00 H new ATOM 0 HG23 ILE A 116 1.541 1.904 -0.342 1.00 0.00 H new ATOM 0 HD11 ILE A 116 2.761 -0.004 -3.386 1.00 0.00 H new ATOM 0 HD12 ILE A 116 1.821 1.109 -2.364 1.00 0.00 H new ATOM 0 HD13 ILE A 116 3.565 1.374 -2.597 1.00 0.00 H new ATOM 1836 N ASN A 117 4.055 3.486 1.603 1.00 0.00 N ATOM 1837 CA ASN A 117 4.377 4.281 2.780 1.00 0.00 C ATOM 1838 C ASN A 117 3.588 3.764 3.990 1.00 0.00 C ATOM 1839 O ASN A 117 2.392 3.478 3.881 1.00 0.00 O ATOM 1840 CB ASN A 117 4.119 5.774 2.493 1.00 0.00 C ATOM 1841 CG ASN A 117 2.649 6.108 2.277 1.00 0.00 C ATOM 1842 OD1 ASN A 117 1.949 6.510 3.206 1.00 0.00 O ATOM 1843 ND2 ASN A 117 2.164 5.922 1.061 1.00 0.00 N ATOM 0 H ASN A 117 3.493 3.980 0.909 1.00 0.00 H new ATOM 0 HA ASN A 117 5.435 4.181 3.021 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.499 6.366 3.325 1.00 0.00 H new ATOM 0 HB3 ASN A 117 4.684 6.068 1.608 1.00 0.00 H new ATOM 0 HD21 ASN A 117 1.181 6.113 0.869 1.00 0.00 H new ATOM 0 HD22 ASN A 117 2.773 5.588 0.315 1.00 0.00 H new ATOM 1850 N SER A 118 4.287 3.630 5.122 1.00 0.00 N ATOM 1851 CA SER A 118 3.764 2.966 6.328 1.00 0.00 C ATOM 1852 C SER A 118 2.514 3.683 6.896 1.00 0.00 C ATOM 1853 O SER A 118 1.626 3.033 7.459 1.00 0.00 O ATOM 1854 CB SER A 118 4.885 2.887 7.389 1.00 0.00 C ATOM 1855 OG SER A 118 4.506 2.100 8.513 1.00 0.00 O ATOM 0 H SER A 118 5.239 3.981 5.231 1.00 0.00 H new ATOM 0 HA SER A 118 3.445 1.960 6.055 1.00 0.00 H new ATOM 0 HB2 SER A 118 5.782 2.464 6.937 1.00 0.00 H new ATOM 0 HB3 SER A 118 5.140 3.893 7.721 1.00 0.00 H new ATOM 0 HG SER A 118 5.243 2.075 9.158 1.00 0.00 H new ATOM 1861 N ALA A 119 2.453 5.022 6.717 1.00 0.00 N ATOM 1862 CA ALA A 119 1.374 5.872 7.269 1.00 0.00 C ATOM 1863 C ALA A 119 0.059 5.723 6.473 1.00 0.00 C ATOM 1864 O ALA A 119 -1.010 6.120 6.956 1.00 0.00 O ATOM 1865 CB ALA A 119 1.816 7.343 7.307 1.00 0.00 C ATOM 0 H ALA A 119 3.150 5.543 6.186 1.00 0.00 H new ATOM 0 HA ALA A 119 1.179 5.534 8.287 1.00 0.00 H new ATOM 0 HB1 ALA A 119 1.011 7.954 7.715 1.00 0.00 H new ATOM 0 HB2 ALA A 119 2.701 7.441 7.936 1.00 0.00 H new ATOM 0 HB3 ALA A 119 2.050 7.679 6.297 1.00 0.00 H new ATOM 1871 N ALA A 120 0.154 5.176 5.240 1.00 0.00 N ATOM 1872 CA ALA A 120 -1.033 4.855 4.420 1.00 0.00 C ATOM 1873 C ALA A 120 -1.618 3.495 4.804 1.00 0.00 C ATOM 1874 O ALA A 120 -2.742 3.191 4.435 1.00 0.00 O ATOM 1875 CB ALA A 120 -0.703 4.867 2.914 1.00 0.00 C ATOM 0 H ALA A 120 1.042 4.948 4.792 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.773 5.630 4.619 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -1.600 4.627 2.343 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -0.345 5.856 2.628 1.00 0.00 H new ATOM 0 HB3 ALA A 120 0.069 4.127 2.705 1.00 0.00 H new ATOM 1881 N LEU A 121 -0.858 2.692 5.561 1.00 0.00 N ATOM 1882 CA LEU A 121 -1.144 1.264 5.743 1.00 0.00 C ATOM 1883 C LEU A 121 -1.725 0.919 7.107 1.00 0.00 C ATOM 1884 O LEU A 121 -1.374 1.508 8.131 1.00 0.00 O ATOM 1885 CB LEU A 121 0.148 0.450 5.525 1.00 0.00 C ATOM 1886 CG LEU A 121 0.758 0.567 4.110 1.00 0.00 C ATOM 1887 CD1 LEU A 121 2.019 -0.291 3.985 1.00 0.00 C ATOM 1888 CD2 LEU A 121 -0.299 0.234 3.036 1.00 0.00 C ATOM 0 H LEU A 121 -0.030 3.014 6.063 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.905 1.008 5.006 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.891 0.773 6.254 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -0.062 -0.600 5.729 1.00 0.00 H new ATOM 0 HG LEU A 121 1.068 1.599 3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.429 -0.191 2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.759 0.041 4.713 1.00 0.00 H new ATOM 0 HD13 LEU A 121 1.769 -1.335 4.173 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.148 0.322 2.046 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -0.659 -0.784 3.183 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -1.134 0.929 3.120 1.00 0.00 H new ATOM 1900 N ARG A 122 -2.614 -0.068 7.059 1.00 0.00 N ATOM 1901 CA ARG A 122 -3.087 -0.823 8.217 1.00 0.00 C ATOM 1902 C ARG A 122 -3.309 -2.257 7.751 1.00 0.00 C ATOM 1903 O ARG A 122 -3.748 -2.492 6.618 1.00 0.00 O ATOM 1904 CB ARG A 122 -4.402 -0.253 8.833 1.00 0.00 C ATOM 1905 CG ARG A 122 -5.631 -0.286 7.892 1.00 0.00 C ATOM 1906 CD ARG A 122 -6.948 0.084 8.595 1.00 0.00 C ATOM 1907 NE ARG A 122 -7.422 -0.974 9.520 1.00 0.00 N ATOM 1908 CZ ARG A 122 -8.681 -1.457 9.561 1.00 0.00 C ATOM 1909 NH1 ARG A 122 -9.596 -1.041 8.689 1.00 0.00 N ATOM 1910 NH2 ARG A 122 -9.017 -2.377 10.452 1.00 0.00 N ATOM 0 H ARG A 122 -3.040 -0.375 6.185 1.00 0.00 H new ATOM 0 HA ARG A 122 -2.340 -0.757 9.008 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -4.638 -0.818 9.735 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -4.225 0.778 9.140 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.464 0.403 7.064 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -5.724 -1.284 7.463 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -6.810 1.011 9.151 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -7.715 0.274 7.844 1.00 0.00 H new ATOM 0 HE ARG A 122 -6.745 -1.366 10.175 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -9.348 -0.350 7.980 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -10.545 -1.413 8.729 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -8.322 -2.725 11.113 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -9.971 -2.738 10.478 1.00 0.00 H new ATOM 1924 N PHE A 123 -2.993 -3.207 8.610 1.00 0.00 N ATOM 1925 CA PHE A 123 -3.260 -4.616 8.363 1.00 0.00 C ATOM 1926 C PHE A 123 -4.635 -4.949 8.938 1.00 0.00 C ATOM 1927 O PHE A 123 -5.029 -4.411 9.980 1.00 0.00 O ATOM 1928 CB PHE A 123 -2.149 -5.513 8.958 1.00 0.00 C ATOM 1929 CG PHE A 123 -1.786 -5.161 10.394 1.00 0.00 C ATOM 1930 CD1 PHE A 123 -0.789 -4.225 10.666 1.00 0.00 C ATOM 1931 CD2 PHE A 123 -2.472 -5.726 11.468 1.00 0.00 C ATOM 1932 CE1 PHE A 123 -0.495 -3.874 11.955 1.00 0.00 C ATOM 1933 CE2 PHE A 123 -2.166 -5.376 12.756 1.00 0.00 C ATOM 1934 CZ PHE A 123 -1.182 -4.450 12.999 1.00 0.00 C ATOM 0 H PHE A 123 -2.541 -3.024 9.506 1.00 0.00 H new ATOM 0 HA PHE A 123 -3.262 -4.812 7.291 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -2.473 -6.553 8.918 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -1.257 -5.433 8.336 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -0.244 -3.773 9.851 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -3.254 -6.448 11.282 1.00 0.00 H new ATOM 0 HE1 PHE A 123 0.276 -3.145 12.153 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -2.698 -5.828 13.580 1.00 0.00 H new ATOM 0 HZ PHE A 123 -0.946 -4.172 14.015 1.00 0.00 H new ATOM 1944 N VAL A 124 -5.360 -5.812 8.245 1.00 0.00 N ATOM 1945 CA VAL A 124 -6.712 -6.211 8.607 1.00 0.00 C ATOM 1946 C VAL A 124 -6.703 -7.744 8.700 1.00 0.00 C ATOM 1947 O VAL A 124 -6.531 -8.398 7.663 1.00 0.00 O ATOM 1948 CB VAL A 124 -7.770 -5.708 7.550 1.00 0.00 C ATOM 1949 CG1 VAL A 124 -9.216 -6.017 8.019 1.00 0.00 C ATOM 1950 CG2 VAL A 124 -7.581 -4.196 7.235 1.00 0.00 C ATOM 0 H VAL A 124 -5.019 -6.265 7.397 1.00 0.00 H new ATOM 0 HA VAL A 124 -7.004 -5.763 9.556 1.00 0.00 H new ATOM 0 HB VAL A 124 -7.601 -6.255 6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -9.925 -5.660 7.272 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -9.335 -7.093 8.147 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -9.406 -5.516 8.968 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -8.325 -3.881 6.504 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -7.703 -3.616 8.150 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -6.582 -4.031 6.831 1.00 0.00 H new ATOM 1960 N PRO A 125 -6.804 -8.333 9.943 1.00 0.00 N ATOM 1961 CA PRO A 125 -6.809 -9.809 10.151 1.00 0.00 C ATOM 1962 C PRO A 125 -7.826 -10.549 9.250 1.00 0.00 C ATOM 1963 O PRO A 125 -8.874 -9.987 8.918 1.00 0.00 O ATOM 1964 CB PRO A 125 -7.182 -9.948 11.650 1.00 0.00 C ATOM 1965 CG PRO A 125 -6.664 -8.691 12.279 1.00 0.00 C ATOM 1966 CD PRO A 125 -6.891 -7.608 11.248 1.00 0.00 C ATOM 0 HA PRO A 125 -5.852 -10.261 9.889 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -8.259 -10.045 11.784 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.724 -10.832 12.093 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -7.192 -8.468 13.206 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.607 -8.782 12.528 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -7.863 -7.131 11.376 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -6.138 -6.823 11.320 1.00 0.00 H new ATOM 1974 N LYS A 126 -7.488 -11.797 8.865 1.00 0.00 N ATOM 1975 CA LYS A 126 -8.322 -12.655 7.990 1.00 0.00 C ATOM 1976 C LYS A 126 -9.787 -12.790 8.492 1.00 0.00 C ATOM 1977 O LYS A 126 -10.729 -12.828 7.688 1.00 0.00 O ATOM 1978 CB LYS A 126 -7.670 -14.052 7.867 1.00 0.00 C ATOM 1979 CG LYS A 126 -8.406 -15.042 6.930 1.00 0.00 C ATOM 1980 CD LYS A 126 -7.771 -16.450 6.949 1.00 0.00 C ATOM 1981 CE LYS A 126 -7.823 -17.122 8.342 1.00 0.00 C ATOM 1982 NZ LYS A 126 -7.039 -18.382 8.371 1.00 0.00 N ATOM 0 H LYS A 126 -6.619 -12.245 9.155 1.00 0.00 H new ATOM 0 HA LYS A 126 -8.371 -12.173 7.013 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -6.648 -13.928 7.508 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -7.608 -14.495 8.861 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -9.452 -15.113 7.230 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -8.392 -14.653 5.912 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.286 -17.084 6.227 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -6.733 -16.378 6.626 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -7.435 -16.434 9.093 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.859 -17.332 8.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -7.269 -18.914 9.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -7.274 -18.956 7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.023 -18.159 8.363 1.00 0.00 H new ATOM 1996 N HIS A 127 -9.955 -12.813 9.825 1.00 0.00 N ATOM 1997 CA HIS A 127 -11.279 -12.935 10.478 1.00 0.00 C ATOM 1998 C HIS A 127 -12.103 -11.649 10.277 1.00 0.00 C ATOM 1999 O HIS A 127 -13.339 -11.695 10.189 1.00 0.00 O ATOM 2000 CB HIS A 127 -11.110 -13.254 11.990 1.00 0.00 C ATOM 2001 CG HIS A 127 -10.682 -14.671 12.296 1.00 0.00 C ATOM 2002 ND1 HIS A 127 -11.249 -15.422 13.300 1.00 0.00 N ATOM 2003 CD2 HIS A 127 -9.731 -15.464 11.738 1.00 0.00 C ATOM 2004 CE1 HIS A 127 -10.673 -16.603 13.351 1.00 0.00 C ATOM 2005 NE2 HIS A 127 -9.744 -16.660 12.413 1.00 0.00 N ATOM 0 H HIS A 127 -9.180 -12.748 10.484 1.00 0.00 H new ATOM 0 HA HIS A 127 -11.820 -13.759 10.013 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -10.375 -12.569 12.411 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -12.055 -13.058 12.496 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -9.083 -15.202 10.914 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -10.918 -17.394 14.044 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -9.138 -17.458 12.222 1.00 0.00 H new ATOM 2014 N LYS A 128 -11.400 -10.511 10.170 1.00 0.00 N ATOM 2015 CA LYS A 128 -12.030 -9.193 10.010 1.00 0.00 C ATOM 2016 C LYS A 128 -12.269 -8.904 8.523 1.00 0.00 C ATOM 2017 O LYS A 128 -13.172 -8.143 8.181 1.00 0.00 O ATOM 2018 CB LYS A 128 -11.155 -8.073 10.648 1.00 0.00 C ATOM 2019 CG LYS A 128 -11.849 -6.689 10.707 1.00 0.00 C ATOM 2020 CD LYS A 128 -13.106 -6.693 11.617 1.00 0.00 C ATOM 2021 CE LYS A 128 -14.008 -5.466 11.399 1.00 0.00 C ATOM 2022 NZ LYS A 128 -13.276 -4.187 11.574 1.00 0.00 N ATOM 0 H LYS A 128 -10.381 -10.479 10.192 1.00 0.00 H new ATOM 0 HA LYS A 128 -12.989 -9.205 10.528 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -10.879 -8.373 11.659 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -10.230 -7.980 10.079 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -11.141 -5.946 11.074 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -12.135 -6.386 9.700 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -13.682 -7.599 11.428 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -12.793 -6.726 12.660 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -14.432 -5.504 10.396 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -14.842 -5.503 12.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -13.948 -3.394 11.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -12.793 -4.186 12.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -12.573 -4.083 10.815 1.00 0.00 H new ATOM 2036 N LEU A 129 -11.474 -9.546 7.645 1.00 0.00 N ATOM 2037 CA LEU A 129 -11.577 -9.373 6.189 1.00 0.00 C ATOM 2038 C LEU A 129 -12.940 -9.835 5.674 1.00 0.00 C ATOM 2039 O LEU A 129 -13.453 -9.297 4.690 1.00 0.00 O ATOM 2040 CB LEU A 129 -10.484 -10.179 5.481 1.00 0.00 C ATOM 2041 CG LEU A 129 -9.025 -9.704 5.644 1.00 0.00 C ATOM 2042 CD1 LEU A 129 -8.067 -10.675 4.922 1.00 0.00 C ATOM 2043 CD2 LEU A 129 -8.879 -8.266 5.143 1.00 0.00 C ATOM 0 H LEU A 129 -10.743 -10.199 7.929 1.00 0.00 H new ATOM 0 HA LEU A 129 -11.456 -8.311 5.974 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -10.543 -11.208 5.835 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -10.715 -10.194 4.416 1.00 0.00 H new ATOM 0 HG LEU A 129 -8.756 -9.708 6.700 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -7.040 -10.330 5.043 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.168 -11.672 5.351 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -8.315 -10.709 3.861 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -7.845 -7.942 5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -9.154 -8.218 4.089 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.534 -7.612 5.719 1.00 0.00 H new ATOM 2055 N LYS A 130 -13.500 -10.858 6.352 1.00 0.00 N ATOM 2056 CA LYS A 130 -14.848 -11.363 6.084 1.00 0.00 C ATOM 2057 C LYS A 130 -15.888 -10.254 6.282 1.00 0.00 C ATOM 2058 O LYS A 130 -16.792 -10.087 5.463 1.00 0.00 O ATOM 2059 CB LYS A 130 -15.135 -12.584 6.994 1.00 0.00 C ATOM 2060 CG LYS A 130 -16.535 -13.215 6.827 1.00 0.00 C ATOM 2061 CD LYS A 130 -16.684 -14.533 7.628 1.00 0.00 C ATOM 2062 CE LYS A 130 -16.509 -14.345 9.146 1.00 0.00 C ATOM 2063 NZ LYS A 130 -17.578 -13.513 9.738 1.00 0.00 N ATOM 0 H LYS A 130 -13.021 -11.355 7.103 1.00 0.00 H new ATOM 0 HA LYS A 130 -14.914 -11.687 5.045 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -14.384 -13.349 6.796 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -15.013 -12.279 8.033 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -17.293 -12.504 7.156 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -16.719 -13.411 5.771 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -17.668 -14.960 7.433 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -15.948 -15.253 7.271 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -16.501 -15.321 9.632 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -15.542 -13.883 9.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -17.624 -13.685 10.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -17.372 -12.508 9.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -18.490 -13.760 9.304 1.00 0.00 H new ATOM 2077 N GLU A 131 -15.700 -9.473 7.350 1.00 0.00 N ATOM 2078 CA GLU A 131 -16.552 -8.322 7.670 1.00 0.00 C ATOM 2079 C GLU A 131 -16.356 -7.206 6.637 1.00 0.00 C ATOM 2080 O GLU A 131 -17.298 -6.488 6.305 1.00 0.00 O ATOM 2081 CB GLU A 131 -16.221 -7.804 9.094 1.00 0.00 C ATOM 2082 CG GLU A 131 -16.220 -8.892 10.192 1.00 0.00 C ATOM 2083 CD GLU A 131 -17.560 -9.635 10.323 1.00 0.00 C ATOM 2084 OE1 GLU A 131 -18.451 -9.148 11.051 1.00 0.00 O ATOM 2085 OE2 GLU A 131 -17.728 -10.713 9.710 1.00 0.00 O ATOM 0 H GLU A 131 -14.947 -9.622 8.022 1.00 0.00 H new ATOM 0 HA GLU A 131 -17.595 -8.636 7.640 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -15.241 -7.326 9.074 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -16.945 -7.035 9.364 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -15.433 -9.614 9.975 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -15.975 -8.431 11.149 1.00 0.00 H new ATOM 2092 N GLU A 132 -15.121 -7.079 6.115 1.00 0.00 N ATOM 2093 CA GLU A 132 -14.771 -6.042 5.132 1.00 0.00 C ATOM 2094 C GLU A 132 -15.223 -6.443 3.706 1.00 0.00 C ATOM 2095 O GLU A 132 -15.225 -5.594 2.809 1.00 0.00 O ATOM 2096 CB GLU A 132 -13.238 -5.773 5.147 1.00 0.00 C ATOM 2097 CG GLU A 132 -12.636 -5.437 6.530 1.00 0.00 C ATOM 2098 CD GLU A 132 -13.283 -4.226 7.226 1.00 0.00 C ATOM 2099 OE1 GLU A 132 -12.968 -3.075 6.850 1.00 0.00 O ATOM 2100 OE2 GLU A 132 -14.110 -4.416 8.151 1.00 0.00 O ATOM 0 H GLU A 132 -14.343 -7.690 6.363 1.00 0.00 H new ATOM 0 HA GLU A 132 -15.296 -5.129 5.412 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.728 -6.652 4.752 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.025 -4.948 4.467 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -12.734 -6.308 7.177 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -11.569 -5.246 6.412 1.00 0.00 H new ATOM 2107 N GLY A 133 -15.611 -7.729 3.497 1.00 0.00 N ATOM 2108 CA GLY A 133 -16.038 -8.215 2.176 1.00 0.00 C ATOM 2109 C GLY A 133 -15.062 -9.210 1.547 1.00 0.00 C ATOM 2110 O GLY A 133 -14.656 -9.015 0.403 1.00 0.00 O ATOM 0 H GLY A 133 -15.634 -8.438 4.229 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -17.016 -8.688 2.270 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -16.159 -7.364 1.506 1.00 0.00 H new ATOM 2114 N TYR A 134 -14.657 -10.236 2.346 1.00 0.00 N ATOM 2115 CA TYR A 134 -13.856 -11.459 1.959 1.00 0.00 C ATOM 2116 C TYR A 134 -13.726 -11.783 0.447 1.00 0.00 C ATOM 2117 O TYR A 134 -12.659 -12.196 -0.007 1.00 0.00 O ATOM 2118 CB TYR A 134 -14.443 -12.713 2.689 1.00 0.00 C ATOM 2119 CG TYR A 134 -15.931 -13.001 2.377 1.00 0.00 C ATOM 2120 CD1 TYR A 134 -16.959 -12.384 3.091 1.00 0.00 C ATOM 2121 CD2 TYR A 134 -16.301 -13.871 1.347 1.00 0.00 C ATOM 2122 CE1 TYR A 134 -18.283 -12.627 2.793 1.00 0.00 C ATOM 2123 CE2 TYR A 134 -17.622 -14.110 1.041 1.00 0.00 C ATOM 2124 CZ TYR A 134 -18.613 -13.487 1.766 1.00 0.00 C ATOM 2125 OH TYR A 134 -19.941 -13.711 1.456 1.00 0.00 O ATOM 0 H TYR A 134 -14.889 -10.243 3.339 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.842 -11.210 2.271 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.852 -13.587 2.415 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.330 -12.577 3.765 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -16.713 -11.703 3.892 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -15.531 -14.369 0.777 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -19.062 -12.144 3.364 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -17.880 -14.783 0.236 1.00 0.00 H new ATOM 0 HH TYR A 134 -20.000 -14.341 0.708 1.00 0.00 H new ATOM 2135 N GLU A 135 -14.822 -11.623 -0.300 1.00 0.00 N ATOM 2136 CA GLU A 135 -14.898 -11.970 -1.745 1.00 0.00 C ATOM 2137 C GLU A 135 -13.854 -11.210 -2.603 1.00 0.00 C ATOM 2138 O GLU A 135 -13.469 -11.673 -3.686 1.00 0.00 O ATOM 2139 CB GLU A 135 -16.329 -11.718 -2.279 1.00 0.00 C ATOM 2140 CG GLU A 135 -16.876 -10.297 -2.019 1.00 0.00 C ATOM 2141 CD GLU A 135 -18.191 -10.020 -2.766 1.00 0.00 C ATOM 2142 OE1 GLU A 135 -19.248 -10.510 -2.326 1.00 0.00 O ATOM 2143 OE2 GLU A 135 -18.163 -9.349 -3.822 1.00 0.00 O ATOM 0 H GLU A 135 -15.694 -11.247 0.072 1.00 0.00 H new ATOM 0 HA GLU A 135 -14.659 -13.030 -1.832 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.339 -11.905 -3.353 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -17.005 -12.441 -1.823 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -17.036 -10.164 -0.949 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -16.129 -9.564 -2.323 1.00 0.00 H new ATOM 2150 N SER A 136 -13.418 -10.044 -2.109 1.00 0.00 N ATOM 2151 CA SER A 136 -12.321 -9.271 -2.707 1.00 0.00 C ATOM 2152 C SER A 136 -10.999 -9.705 -2.052 1.00 0.00 C ATOM 2153 O SER A 136 -10.029 -10.062 -2.720 1.00 0.00 O ATOM 2154 CB SER A 136 -12.561 -7.755 -2.490 1.00 0.00 C ATOM 2155 OG SER A 136 -11.503 -6.967 -3.015 1.00 0.00 O ATOM 0 H SER A 136 -13.818 -9.608 -1.279 1.00 0.00 H new ATOM 0 HA SER A 136 -12.275 -9.458 -3.780 1.00 0.00 H new ATOM 0 HB2 SER A 136 -13.498 -7.465 -2.965 1.00 0.00 H new ATOM 0 HB3 SER A 136 -12.668 -7.554 -1.424 1.00 0.00 H new ATOM 0 HG SER A 136 -11.693 -6.018 -2.860 1.00 0.00 H new ATOM 2161 N TYR A 137 -11.046 -9.737 -0.715 1.00 0.00 N ATOM 2162 CA TYR A 137 -9.871 -9.790 0.157 1.00 0.00 C ATOM 2163 C TYR A 137 -9.191 -11.178 0.171 1.00 0.00 C ATOM 2164 O TYR A 137 -8.019 -11.294 -0.169 1.00 0.00 O ATOM 2165 CB TYR A 137 -10.293 -9.348 1.589 1.00 0.00 C ATOM 2166 CG TYR A 137 -10.792 -7.889 1.666 1.00 0.00 C ATOM 2167 CD1 TYR A 137 -12.064 -7.557 1.237 1.00 0.00 C ATOM 2168 CD2 TYR A 137 -9.992 -6.850 2.154 1.00 0.00 C ATOM 2169 CE1 TYR A 137 -12.534 -6.268 1.285 1.00 0.00 C ATOM 2170 CE2 TYR A 137 -10.459 -5.550 2.210 1.00 0.00 C ATOM 2171 CZ TYR A 137 -11.736 -5.268 1.772 1.00 0.00 C ATOM 2172 OH TYR A 137 -12.223 -3.987 1.830 1.00 0.00 O ATOM 0 H TYR A 137 -11.925 -9.726 -0.198 1.00 0.00 H new ATOM 0 HA TYR A 137 -9.120 -9.105 -0.238 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -11.080 -10.011 1.947 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -9.444 -9.468 2.262 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -12.707 -8.335 0.853 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -8.990 -7.068 2.494 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -13.532 -6.043 0.939 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -9.829 -4.761 2.594 1.00 0.00 H new ATOM 0 HH TYR A 137 -11.532 -3.390 2.185 1.00 0.00 H new ATOM 2182 N LEU A 138 -9.947 -12.207 0.576 1.00 0.00 N ATOM 2183 CA LEU A 138 -9.455 -13.610 0.702 1.00 0.00 C ATOM 2184 C LEU A 138 -9.145 -14.247 -0.671 1.00 0.00 C ATOM 2185 O LEU A 138 -8.392 -15.218 -0.745 1.00 0.00 O ATOM 2186 CB LEU A 138 -10.469 -14.490 1.516 1.00 0.00 C ATOM 2187 CG LEU A 138 -10.472 -14.278 3.073 1.00 0.00 C ATOM 2188 CD1 LEU A 138 -10.682 -12.813 3.447 1.00 0.00 C ATOM 2189 CD2 LEU A 138 -11.529 -15.141 3.788 1.00 0.00 C ATOM 0 H LEU A 138 -10.929 -12.101 0.831 1.00 0.00 H new ATOM 0 HA LEU A 138 -8.515 -13.571 1.253 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -11.473 -14.293 1.141 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -10.253 -15.539 1.313 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.486 -14.596 3.411 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -10.677 -12.710 4.532 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -9.879 -12.210 3.022 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -11.639 -12.471 3.054 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -11.486 -14.954 4.861 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -12.521 -14.885 3.414 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -11.329 -16.195 3.595 1.00 0.00 H new ATOM 2201 N HIS A 139 -9.748 -13.694 -1.741 1.00 0.00 N ATOM 2202 CA HIS A 139 -9.450 -14.088 -3.141 1.00 0.00 C ATOM 2203 C HIS A 139 -7.986 -13.757 -3.491 1.00 0.00 C ATOM 2204 O HIS A 139 -7.346 -14.461 -4.277 1.00 0.00 O ATOM 2205 CB HIS A 139 -10.420 -13.365 -4.119 1.00 0.00 C ATOM 2206 CG HIS A 139 -10.230 -13.718 -5.581 1.00 0.00 C ATOM 2207 ND1 HIS A 139 -10.943 -14.713 -6.219 1.00 0.00 N ATOM 2208 CD2 HIS A 139 -9.394 -13.209 -6.518 1.00 0.00 C ATOM 2209 CE1 HIS A 139 -10.548 -14.799 -7.477 1.00 0.00 C ATOM 2210 NE2 HIS A 139 -9.611 -13.894 -7.683 1.00 0.00 N ATOM 0 H HIS A 139 -10.455 -12.963 -1.665 1.00 0.00 H new ATOM 0 HA HIS A 139 -9.593 -15.164 -3.240 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -11.445 -13.602 -3.833 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -10.297 -12.288 -4.001 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -8.685 -12.408 -6.372 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -10.928 -15.493 -8.212 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -9.127 -13.731 -8.566 1.00 0.00 H new ATOM 2219 N LEU A 140 -7.487 -12.667 -2.897 1.00 0.00 N ATOM 2220 CA LEU A 140 -6.128 -12.150 -3.116 1.00 0.00 C ATOM 2221 C LEU A 140 -5.163 -12.732 -2.077 1.00 0.00 C ATOM 2222 O LEU A 140 -4.023 -13.067 -2.405 1.00 0.00 O ATOM 2223 CB LEU A 140 -6.175 -10.610 -3.029 1.00 0.00 C ATOM 2224 CG LEU A 140 -7.078 -9.941 -4.104 1.00 0.00 C ATOM 2225 CD1 LEU A 140 -7.367 -8.471 -3.767 1.00 0.00 C ATOM 2226 CD2 LEU A 140 -6.457 -10.106 -5.508 1.00 0.00 C ATOM 0 H LEU A 140 -8.026 -12.107 -2.237 1.00 0.00 H new ATOM 0 HA LEU A 140 -5.766 -12.447 -4.100 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -6.533 -10.323 -2.040 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.162 -10.220 -3.127 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.042 -10.451 -4.106 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.001 -8.038 -4.541 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.877 -8.412 -2.805 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -6.429 -7.918 -3.715 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.101 -9.632 -6.249 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -5.474 -9.636 -5.529 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.357 -11.166 -5.739 1.00 0.00 H new ATOM 2238 N PHE A 141 -5.641 -12.852 -0.823 1.00 0.00 N ATOM 2239 CA PHE A 141 -4.867 -13.444 0.288 1.00 0.00 C ATOM 2240 C PHE A 141 -4.543 -14.936 0.006 1.00 0.00 C ATOM 2241 O PHE A 141 -3.546 -15.459 0.489 1.00 0.00 O ATOM 2242 CB PHE A 141 -5.637 -13.257 1.624 1.00 0.00 C ATOM 2243 CG PHE A 141 -4.956 -13.879 2.853 1.00 0.00 C ATOM 2244 CD1 PHE A 141 -3.681 -13.469 3.248 1.00 0.00 C ATOM 2245 CD2 PHE A 141 -5.588 -14.872 3.608 1.00 0.00 C ATOM 2246 CE1 PHE A 141 -3.059 -14.036 4.345 1.00 0.00 C ATOM 2247 CE2 PHE A 141 -4.961 -15.434 4.705 1.00 0.00 C ATOM 2248 CZ PHE A 141 -3.702 -15.014 5.074 1.00 0.00 C ATOM 0 H PHE A 141 -6.574 -12.542 -0.551 1.00 0.00 H new ATOM 0 HA PHE A 141 -3.912 -12.926 0.374 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -5.773 -12.190 1.802 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -6.631 -13.692 1.518 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -3.173 -12.698 2.688 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -6.578 -15.204 3.331 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -2.069 -13.713 4.631 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -5.460 -16.204 5.274 1.00 0.00 H new ATOM 0 HZ PHE A 141 -3.218 -15.451 5.935 1.00 0.00 H new ATOM 2258 N ASN A 142 -5.402 -15.597 -0.778 1.00 0.00 N ATOM 2259 CA ASN A 142 -5.144 -16.946 -1.329 1.00 0.00 C ATOM 2260 C ASN A 142 -4.677 -16.806 -2.793 1.00 0.00 C ATOM 2261 O ASN A 142 -5.089 -15.877 -3.486 1.00 0.00 O ATOM 2262 CB ASN A 142 -6.434 -17.815 -1.247 1.00 0.00 C ATOM 2263 CG ASN A 142 -6.276 -19.236 -1.810 1.00 0.00 C ATOM 2264 OD1 ASN A 142 -5.190 -19.824 -1.773 1.00 0.00 O ATOM 2265 ND2 ASN A 142 -7.359 -19.797 -2.330 1.00 0.00 N ATOM 0 H ASN A 142 -6.306 -15.213 -1.054 1.00 0.00 H new ATOM 0 HA ASN A 142 -4.366 -17.440 -0.747 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -6.747 -17.882 -0.205 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -7.234 -17.309 -1.788 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -7.310 -20.741 -2.714 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -8.241 -19.285 -2.346 1.00 0.00 H new