USER MOD reduce.3.24.130724 H: found=0, std=0, add=1195, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1198 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 164 CYS SG : rot 180:sc= -2.5! USER MOD Set 1.2: A 167 THR OG1 : rot 85:sc= 0.331 USER MOD Set 2.1: A 161 HIS : no HE2:sc= -9.33! C(o=-20!,f=-28!) USER MOD Set 2.2: A 172 CYS SG : rot 78:sc= -10.8! USER MOD Set 3.1: A 75 ASN : amide:sc= -9.99! C(o=-26!,f=-26!) USER MOD Set 3.2: A 152 HIS : no HE2:sc= -15.9! C(o=-26!,f=-26!) USER MOD Set 4.1: A 28 LYS NZ :NH3+ 176:sc= -7.74! (180deg=-1.78) USER MOD Set 4.2: A 29 HIS : no HE2:sc= -5.77! C(o=-14!,f=-15!) USER MOD Single : A 7 ASN : amide:sc= -0.372 K(o=-0.37,f=-1.8!) USER MOD Single : A 12 MET CE :methyl -130:sc= -1.47 (180deg=-3.82!) USER MOD Single : A 16 GLN : amide:sc= -0.464 K(o=-0.46,f=-1.8) USER MOD Single : A 17 CYS SG : rot 180:sc= -0.0187 USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN :FLIP amide:sc= -0.178 F(o=-2.1!,f=-0.18) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot -40:sc= 1.2 USER MOD Single : A 52 GLN : amide:sc= -1.19 X(o=-1.2,f=-1.6) USER MOD Single : A 56 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.31) USER MOD Single : A 59 ASN : amide:sc= -0.0825 K(o=-0.082,f=-2.2!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 154:sc= 0.146 (180deg=0.000694) USER MOD Single : A 71 GLN : amide:sc= -0.19 K(o=-0.19,f=-3!) USER MOD Single : A 79 SER OG : rot -90:sc= 0.865 USER MOD Single : A 81 HIS : no HD1:sc= -0.139 X(o=-0.14,f=-0.039) USER MOD Single : A 82 THR OG1 : rot -62:sc= 1.04 USER MOD Single : A 87 LYS NZ :NH3+ 142:sc= -0.105 (180deg=-0.844) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot -37:sc= 0.633 USER MOD Single : A 96 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 HIS : no HE2:sc= -4.37! C(o=-4.4!,f=-4!) USER MOD Single : A 103 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.18) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 119 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -1 K(o=-1,f=-3.1!) USER MOD Single : A 126 ASN : amide:sc= -1.45! C(o=-1.5!,f=-3.4!) USER MOD Single : A 127 GLN :FLIP amide:sc= 0 F(o=-1.4!,f=0) USER MOD Single : A 132 TYR OH : rot 0:sc= -0.0575 USER MOD Single : A 133 SER OG : rot 180:sc= -0.467 USER MOD Single : A 134 SER OG : rot 49:sc= 0.872 USER MOD Single : A 139 CYS SG : rot -71:sc= 0.622 USER MOD Single : A 141 CYS SG : rot -6:sc= 0.202 USER MOD Single : A 151 GLN :FLIP amide:sc= -0.271 F(o=-0.84,f=-0.27) USER MOD Single : A 154 GLN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : A 155 GLN : amide:sc= -0.763 X(o=-0.76,f=-0.28) USER MOD Single : A 156 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 THR OG1 : rot 180:sc= -0.0131 USER MOD Single : A 165 MET CE :methyl -135:sc= -1.03 (180deg=-2.95!) USER MOD Single : A 166 HIS : no HD1:sc= -0.121 X(o=-0.12,f=-0.3) USER MOD Single : A 171 HIS : no HD1:sc= -2.33 K(o=-2.3,f=-5.5!) USER MOD Single : A 173 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 179 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD ----------------------------------------------------------------- ATOM 42 N GLY A 3 17.606 4.295 5.956 1.00 0.00 N ATOM 43 CA GLY A 3 16.147 4.168 6.036 1.00 0.00 C ATOM 44 C GLY A 3 15.498 4.224 4.657 1.00 0.00 C ATOM 45 O GLY A 3 15.292 5.303 4.103 1.00 0.00 O ATOM 0 HA2 GLY A 3 15.890 3.226 6.521 1.00 0.00 H new ATOM 0 HA3 GLY A 3 15.746 4.967 6.659 1.00 0.00 H new ATOM 49 N ILE A 4 15.164 3.061 4.112 1.00 0.00 N ATOM 50 CA ILE A 4 14.529 3.006 2.804 1.00 0.00 C ATOM 51 C ILE A 4 13.071 3.452 2.904 1.00 0.00 C ATOM 52 O ILE A 4 12.574 4.176 2.048 1.00 0.00 O ATOM 53 CB ILE A 4 14.606 1.580 2.247 1.00 0.00 C ATOM 54 CG1 ILE A 4 14.104 1.562 0.791 1.00 0.00 C ATOM 55 CG2 ILE A 4 13.735 0.653 3.095 1.00 0.00 C ATOM 56 CD1 ILE A 4 15.056 2.364 -0.112 1.00 0.00 C ATOM 0 H ILE A 4 15.320 2.153 4.550 1.00 0.00 H new ATOM 0 HA ILE A 4 15.054 3.681 2.129 1.00 0.00 H new ATOM 0 HB ILE A 4 15.641 1.238 2.277 1.00 0.00 H new ATOM 0 HG12 ILE A 4 14.035 0.534 0.436 1.00 0.00 H new ATOM 0 HG13 ILE A 4 13.101 1.985 0.740 1.00 0.00 H new ATOM 0 HG21 ILE A 4 13.790 -0.361 2.699 1.00 0.00 H new ATOM 0 HG22 ILE A 4 14.092 0.660 4.125 1.00 0.00 H new ATOM 0 HG23 ILE A 4 12.701 0.998 3.067 1.00 0.00 H new ATOM 0 HD11 ILE A 4 14.689 2.343 -1.138 1.00 0.00 H new ATOM 0 HD12 ILE A 4 15.103 3.396 0.235 1.00 0.00 H new ATOM 0 HD13 ILE A 4 16.052 1.922 -0.074 1.00 0.00 H new ATOM 68 N ILE A 5 12.397 3.015 3.963 1.00 0.00 N ATOM 69 CA ILE A 5 10.994 3.378 4.174 1.00 0.00 C ATOM 70 C ILE A 5 10.858 4.885 4.387 1.00 0.00 C ATOM 71 O ILE A 5 9.986 5.523 3.795 1.00 0.00 O ATOM 72 CB ILE A 5 10.427 2.638 5.401 1.00 0.00 C ATOM 73 CG1 ILE A 5 10.808 1.135 5.357 1.00 0.00 C ATOM 74 CG2 ILE A 5 8.903 2.788 5.433 1.00 0.00 C ATOM 75 CD1 ILE A 5 9.977 0.389 4.299 1.00 0.00 C ATOM 0 H ILE A 5 12.793 2.413 4.685 1.00 0.00 H new ATOM 0 HA ILE A 5 10.432 3.088 3.286 1.00 0.00 H new ATOM 0 HB ILE A 5 10.855 3.076 6.303 1.00 0.00 H new ATOM 0 HG12 ILE A 5 11.869 1.031 5.131 1.00 0.00 H new ATOM 0 HG13 ILE A 5 10.645 0.686 6.337 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.504 2.264 6.301 1.00 0.00 H new ATOM 0 HG22 ILE A 5 8.643 3.845 5.496 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.476 2.362 4.525 1.00 0.00 H new ATOM 0 HD11 ILE A 5 10.263 -0.663 4.287 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.918 0.475 4.541 1.00 0.00 H new ATOM 0 HD13 ILE A 5 10.161 0.826 3.317 1.00 0.00 H new ATOM 87 N PHE A 6 11.710 5.450 5.229 1.00 0.00 N ATOM 88 CA PHE A 6 11.655 6.884 5.500 1.00 0.00 C ATOM 89 C PHE A 6 12.043 7.690 4.256 1.00 0.00 C ATOM 90 O PHE A 6 11.565 8.805 4.060 1.00 0.00 O ATOM 91 CB PHE A 6 12.583 7.236 6.664 1.00 0.00 C ATOM 92 CG PHE A 6 12.163 6.463 7.889 1.00 0.00 C ATOM 93 CD1 PHE A 6 12.644 5.165 8.094 1.00 0.00 C ATOM 94 CD2 PHE A 6 11.288 7.040 8.816 1.00 0.00 C ATOM 95 CE1 PHE A 6 12.252 4.445 9.227 1.00 0.00 C ATOM 96 CE2 PHE A 6 10.896 6.319 9.951 1.00 0.00 C ATOM 97 CZ PHE A 6 11.379 5.022 10.156 1.00 0.00 C ATOM 0 H PHE A 6 12.441 4.947 5.733 1.00 0.00 H new ATOM 0 HA PHE A 6 10.631 7.142 5.770 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.615 6.998 6.406 1.00 0.00 H new ATOM 0 HB3 PHE A 6 12.543 8.307 6.864 1.00 0.00 H new ATOM 0 HD1 PHE A 6 13.318 4.719 7.377 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.915 8.041 8.656 1.00 0.00 H new ATOM 0 HE1 PHE A 6 12.623 3.443 9.385 1.00 0.00 H new ATOM 0 HE2 PHE A 6 10.221 6.764 10.667 1.00 0.00 H new ATOM 0 HZ PHE A 6 11.078 4.466 11.032 1.00 0.00 H new ATOM 107 N ASN A 7 12.910 7.124 3.426 1.00 0.00 N ATOM 108 CA ASN A 7 13.352 7.810 2.208 1.00 0.00 C ATOM 109 C ASN A 7 12.190 7.992 1.222 1.00 0.00 C ATOM 110 O ASN A 7 11.970 9.087 0.704 1.00 0.00 O ATOM 111 CB ASN A 7 14.468 7.009 1.535 1.00 0.00 C ATOM 112 CG ASN A 7 15.087 7.826 0.407 1.00 0.00 C ATOM 113 OD1 ASN A 7 14.634 8.934 0.120 1.00 0.00 O ATOM 114 ND2 ASN A 7 16.103 7.343 -0.255 1.00 0.00 N ATOM 0 H ASN A 7 13.320 6.201 3.567 1.00 0.00 H new ATOM 0 HA ASN A 7 13.723 8.795 2.492 1.00 0.00 H new ATOM 0 HB2 ASN A 7 15.232 6.747 2.267 1.00 0.00 H new ATOM 0 HB3 ASN A 7 14.070 6.074 1.142 1.00 0.00 H new ATOM 0 HD21 ASN A 7 16.523 7.884 -1.011 1.00 0.00 H new ATOM 0 HD22 ASN A 7 16.477 6.425 -0.016 1.00 0.00 H new ATOM 121 N VAL A 8 11.458 6.912 0.966 1.00 0.00 N ATOM 122 CA VAL A 8 10.327 6.972 0.033 1.00 0.00 C ATOM 123 C VAL A 8 9.208 7.835 0.614 1.00 0.00 C ATOM 124 O VAL A 8 8.448 8.464 -0.123 1.00 0.00 O ATOM 125 CB VAL A 8 9.797 5.553 -0.273 1.00 0.00 C ATOM 126 CG1 VAL A 8 8.792 5.610 -1.439 1.00 0.00 C ATOM 127 CG2 VAL A 8 10.964 4.628 -0.662 1.00 0.00 C ATOM 0 H VAL A 8 11.620 5.995 1.382 1.00 0.00 H new ATOM 0 HA VAL A 8 10.674 7.421 -0.898 1.00 0.00 H new ATOM 0 HB VAL A 8 9.304 5.164 0.618 1.00 0.00 H new ATOM 0 HG11 VAL A 8 8.422 4.607 -1.650 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.956 6.255 -1.168 1.00 0.00 H new ATOM 0 HG13 VAL A 8 9.285 6.008 -2.325 1.00 0.00 H new ATOM 0 HG21 VAL A 8 10.581 3.630 -0.876 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.462 5.023 -1.547 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.676 4.575 0.161 1.00 0.00 H new ATOM 137 N LEU A 9 9.123 7.866 1.938 1.00 0.00 N ATOM 138 CA LEU A 9 8.107 8.664 2.623 1.00 0.00 C ATOM 139 C LEU A 9 8.402 10.154 2.454 1.00 0.00 C ATOM 140 O LEU A 9 7.551 10.916 1.995 1.00 0.00 O ATOM 141 CB LEU A 9 8.085 8.276 4.108 1.00 0.00 C ATOM 142 CG LEU A 9 7.180 9.218 4.929 1.00 0.00 C ATOM 143 CD1 LEU A 9 5.847 9.462 4.214 1.00 0.00 C ATOM 144 CD2 LEU A 9 6.897 8.567 6.291 1.00 0.00 C ATOM 0 H LEU A 9 9.744 7.349 2.561 1.00 0.00 H new ATOM 0 HA LEU A 9 7.128 8.466 2.187 1.00 0.00 H new ATOM 0 HB2 LEU A 9 7.732 7.250 4.211 1.00 0.00 H new ATOM 0 HB3 LEU A 9 9.099 8.306 4.507 1.00 0.00 H new ATOM 0 HG LEU A 9 7.690 10.173 5.051 1.00 0.00 H new ATOM 0 HD11 LEU A 9 5.229 10.129 4.815 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.034 9.918 3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 9 5.329 8.513 4.076 1.00 0.00 H new ATOM 0 HD21 LEU A 9 6.258 9.223 6.882 1.00 0.00 H new ATOM 0 HD22 LEU A 9 6.395 7.611 6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 9 7.837 8.404 6.819 1.00 0.00 H new ATOM 156 N GLU A 10 9.605 10.564 2.801 1.00 0.00 N ATOM 157 CA GLU A 10 9.980 11.971 2.660 1.00 0.00 C ATOM 158 C GLU A 10 9.501 12.513 1.307 1.00 0.00 C ATOM 159 O GLU A 10 9.223 13.700 1.163 1.00 0.00 O ATOM 160 CB GLU A 10 11.501 12.121 2.767 1.00 0.00 C ATOM 161 CG GLU A 10 11.884 13.598 2.649 1.00 0.00 C ATOM 162 CD GLU A 10 13.380 13.769 2.882 1.00 0.00 C ATOM 163 OE1 GLU A 10 14.064 12.762 2.975 1.00 0.00 O ATOM 164 OE2 GLU A 10 13.822 14.903 2.964 1.00 0.00 O ATOM 0 H GLU A 10 10.335 9.960 3.178 1.00 0.00 H new ATOM 0 HA GLU A 10 9.506 12.541 3.459 1.00 0.00 H new ATOM 0 HB2 GLU A 10 11.849 11.720 3.719 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.989 11.545 1.981 1.00 0.00 H new ATOM 0 HG2 GLU A 10 11.616 13.974 1.661 1.00 0.00 H new ATOM 0 HG3 GLU A 10 11.325 14.186 3.376 1.00 0.00 H new ATOM 171 N ASP A 11 9.422 11.625 0.323 1.00 0.00 N ATOM 172 CA ASP A 11 8.991 12.013 -1.018 1.00 0.00 C ATOM 173 C ASP A 11 7.490 12.303 -1.064 1.00 0.00 C ATOM 174 O ASP A 11 7.041 13.172 -1.813 1.00 0.00 O ATOM 175 CB ASP A 11 9.327 10.902 -2.014 1.00 0.00 C ATOM 176 CG ASP A 11 9.155 11.411 -3.441 1.00 0.00 C ATOM 177 OD1 ASP A 11 8.943 12.602 -3.603 1.00 0.00 O ATOM 178 OD2 ASP A 11 9.237 10.603 -4.352 1.00 0.00 O ATOM 0 H ASP A 11 9.649 10.636 0.426 1.00 0.00 H new ATOM 0 HA ASP A 11 9.522 12.926 -1.287 1.00 0.00 H new ATOM 0 HB2 ASP A 11 10.352 10.563 -1.861 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.678 10.042 -1.845 1.00 0.00 H new ATOM 183 N MET A 12 6.722 11.575 -0.268 1.00 0.00 N ATOM 184 CA MET A 12 5.271 11.775 -0.243 1.00 0.00 C ATOM 185 C MET A 12 4.915 13.091 0.434 1.00 0.00 C ATOM 186 O MET A 12 4.195 13.911 -0.131 1.00 0.00 O ATOM 187 CB MET A 12 4.581 10.631 0.497 1.00 0.00 C ATOM 188 CG MET A 12 5.207 9.303 0.095 1.00 0.00 C ATOM 189 SD MET A 12 4.397 7.966 1.022 1.00 0.00 S ATOM 190 CE MET A 12 5.705 6.714 0.899 1.00 0.00 C ATOM 0 H MET A 12 7.066 10.850 0.362 1.00 0.00 H new ATOM 0 HA MET A 12 4.926 11.799 -1.277 1.00 0.00 H new ATOM 0 HB2 MET A 12 4.672 10.775 1.574 1.00 0.00 H new ATOM 0 HB3 MET A 12 3.516 10.626 0.265 1.00 0.00 H new ATOM 0 HG2 MET A 12 5.093 9.141 -0.977 1.00 0.00 H new ATOM 0 HG3 MET A 12 6.277 9.312 0.304 1.00 0.00 H new ATOM 0 HE1 MET A 12 5.276 5.773 0.555 1.00 0.00 H new ATOM 0 HE2 MET A 12 6.463 7.048 0.191 1.00 0.00 H new ATOM 0 HE3 MET A 12 6.162 6.568 1.878 1.00 0.00 H new ATOM 200 N VAL A 13 5.415 13.286 1.648 1.00 0.00 N ATOM 201 CA VAL A 13 5.127 14.513 2.390 1.00 0.00 C ATOM 202 C VAL A 13 5.571 15.746 1.605 1.00 0.00 C ATOM 203 O VAL A 13 4.840 16.733 1.523 1.00 0.00 O ATOM 204 CB VAL A 13 5.838 14.471 3.742 1.00 0.00 C ATOM 205 CG1 VAL A 13 5.301 13.292 4.564 1.00 0.00 C ATOM 206 CG2 VAL A 13 7.343 14.292 3.511 1.00 0.00 C ATOM 0 H VAL A 13 6.015 12.621 2.137 1.00 0.00 H new ATOM 0 HA VAL A 13 4.050 14.580 2.544 1.00 0.00 H new ATOM 0 HB VAL A 13 5.658 15.400 4.283 1.00 0.00 H new ATOM 0 HG11 VAL A 13 5.807 13.261 5.529 1.00 0.00 H new ATOM 0 HG12 VAL A 13 4.229 13.416 4.720 1.00 0.00 H new ATOM 0 HG13 VAL A 13 5.484 12.361 4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.857 14.261 4.471 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.520 13.360 2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 13 7.723 15.127 2.923 1.00 0.00 H new ATOM 216 N VAL A 14 6.764 15.687 1.032 1.00 0.00 N ATOM 217 CA VAL A 14 7.280 16.813 0.263 1.00 0.00 C ATOM 218 C VAL A 14 6.278 17.242 -0.810 1.00 0.00 C ATOM 219 O VAL A 14 6.260 18.400 -1.228 1.00 0.00 O ATOM 220 CB VAL A 14 8.622 16.431 -0.389 1.00 0.00 C ATOM 221 CG1 VAL A 14 8.990 17.459 -1.470 1.00 0.00 C ATOM 222 CG2 VAL A 14 9.722 16.409 0.684 1.00 0.00 C ATOM 0 H VAL A 14 7.388 14.882 1.083 1.00 0.00 H new ATOM 0 HA VAL A 14 7.436 17.652 0.941 1.00 0.00 H new ATOM 0 HB VAL A 14 8.530 15.445 -0.845 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.940 17.182 -1.927 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.212 17.478 -2.234 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.079 18.447 -1.018 1.00 0.00 H new ATOM 0 HG21 VAL A 14 10.673 16.139 0.225 1.00 0.00 H new ATOM 0 HG22 VAL A 14 9.806 17.396 1.139 1.00 0.00 H new ATOM 0 HG23 VAL A 14 9.468 15.677 1.450 1.00 0.00 H new ATOM 232 N ALA A 15 5.456 16.302 -1.257 1.00 0.00 N ATOM 233 CA ALA A 15 4.465 16.596 -2.291 1.00 0.00 C ATOM 234 C ALA A 15 3.179 17.162 -1.685 1.00 0.00 C ATOM 235 O ALA A 15 2.344 17.721 -2.396 1.00 0.00 O ATOM 236 CB ALA A 15 4.138 15.320 -3.067 1.00 0.00 C ATOM 0 H ALA A 15 5.453 15.337 -0.926 1.00 0.00 H new ATOM 0 HA ALA A 15 4.888 17.345 -2.961 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.399 15.542 -3.837 1.00 0.00 H new ATOM 0 HB2 ALA A 15 5.045 14.936 -3.534 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.737 14.571 -2.384 1.00 0.00 H new ATOM 242 N GLN A 16 3.010 16.986 -0.373 1.00 0.00 N ATOM 243 CA GLN A 16 1.794 17.457 0.308 1.00 0.00 C ATOM 244 C GLN A 16 1.973 18.834 0.958 1.00 0.00 C ATOM 245 O GLN A 16 1.142 19.723 0.773 1.00 0.00 O ATOM 246 CB GLN A 16 1.401 16.451 1.392 1.00 0.00 C ATOM 247 CG GLN A 16 1.128 15.082 0.755 1.00 0.00 C ATOM 248 CD GLN A 16 0.263 14.233 1.683 1.00 0.00 C ATOM 249 OE1 GLN A 16 -0.738 14.715 2.212 1.00 0.00 O ATOM 250 NE2 GLN A 16 0.592 12.991 1.911 1.00 0.00 N ATOM 0 H GLN A 16 3.688 16.527 0.236 1.00 0.00 H new ATOM 0 HA GLN A 16 1.016 17.547 -0.450 1.00 0.00 H new ATOM 0 HB2 GLN A 16 2.199 16.367 2.130 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.514 16.800 1.921 1.00 0.00 H new ATOM 0 HG2 GLN A 16 0.626 15.212 -0.204 1.00 0.00 H new ATOM 0 HG3 GLN A 16 2.070 14.571 0.555 1.00 0.00 H new ATOM 0 HE21 GLN A 16 1.422 12.594 1.471 1.00 0.00 H new ATOM 0 HE22 GLN A 16 0.019 12.417 2.529 1.00 0.00 H new ATOM 259 N CYS A 17 3.037 18.994 1.743 1.00 0.00 N ATOM 260 CA CYS A 17 3.281 20.270 2.447 1.00 0.00 C ATOM 261 C CYS A 17 4.698 20.805 2.195 1.00 0.00 C ATOM 262 O CYS A 17 4.970 21.980 2.446 1.00 0.00 O ATOM 263 CB CYS A 17 3.057 20.065 3.960 1.00 0.00 C ATOM 264 SG CYS A 17 1.367 20.557 4.401 1.00 0.00 S ATOM 0 H CYS A 17 3.739 18.274 1.912 1.00 0.00 H new ATOM 0 HA CYS A 17 2.581 21.010 2.059 1.00 0.00 H new ATOM 0 HB2 CYS A 17 3.222 19.020 4.224 1.00 0.00 H new ATOM 0 HB3 CYS A 17 3.777 20.655 4.527 1.00 0.00 H new ATOM 0 HG CYS A 17 1.182 20.380 5.676 1.00 0.00 H new ATOM 270 N GLY A 18 5.590 19.951 1.699 1.00 0.00 N ATOM 271 CA GLY A 18 6.973 20.375 1.419 1.00 0.00 C ATOM 272 C GLY A 18 7.973 19.648 2.315 1.00 0.00 C ATOM 273 O GLY A 18 7.604 18.777 3.096 1.00 0.00 O ATOM 0 H GLY A 18 5.392 18.974 1.483 1.00 0.00 H new ATOM 0 HA2 GLY A 18 7.210 20.179 0.373 1.00 0.00 H new ATOM 0 HA3 GLY A 18 7.063 21.451 1.570 1.00 0.00 H new ATOM 277 N MET A 19 9.243 20.008 2.175 1.00 0.00 N ATOM 278 CA MET A 19 10.306 19.378 2.960 1.00 0.00 C ATOM 279 C MET A 19 10.380 19.970 4.375 1.00 0.00 C ATOM 280 O MET A 19 10.832 19.307 5.308 1.00 0.00 O ATOM 281 CB MET A 19 11.667 19.558 2.243 1.00 0.00 C ATOM 282 CG MET A 19 11.628 20.815 1.364 1.00 0.00 C ATOM 283 SD MET A 19 13.316 21.399 1.073 1.00 0.00 S ATOM 284 CE MET A 19 12.893 22.789 -0.006 1.00 0.00 C ATOM 0 H MET A 19 9.564 20.729 1.529 1.00 0.00 H new ATOM 0 HA MET A 19 10.077 18.316 3.049 1.00 0.00 H new ATOM 0 HB2 MET A 19 12.468 19.642 2.978 1.00 0.00 H new ATOM 0 HB3 MET A 19 11.885 18.682 1.632 1.00 0.00 H new ATOM 0 HG2 MET A 19 11.140 20.593 0.415 1.00 0.00 H new ATOM 0 HG3 MET A 19 11.041 21.594 1.850 1.00 0.00 H new ATOM 0 HE1 MET A 19 13.804 23.303 -0.312 1.00 0.00 H new ATOM 0 HE2 MET A 19 12.371 22.419 -0.889 1.00 0.00 H new ATOM 0 HE3 MET A 19 12.248 23.484 0.532 1.00 0.00 H new ATOM 294 N SER A 20 9.947 21.218 4.524 1.00 0.00 N ATOM 295 CA SER A 20 9.989 21.876 5.830 1.00 0.00 C ATOM 296 C SER A 20 9.139 21.123 6.857 1.00 0.00 C ATOM 297 O SER A 20 9.503 21.045 8.031 1.00 0.00 O ATOM 298 CB SER A 20 9.500 23.318 5.710 1.00 0.00 C ATOM 299 OG SER A 20 10.217 23.973 4.671 1.00 0.00 O ATOM 0 H SER A 20 9.567 21.790 3.769 1.00 0.00 H new ATOM 0 HA SER A 20 11.023 21.873 6.174 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.431 23.335 5.497 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.645 23.843 6.654 1.00 0.00 H new ATOM 0 HG SER A 20 9.904 24.898 4.591 1.00 0.00 H new ATOM 305 N VAL A 21 8.016 20.568 6.417 1.00 0.00 N ATOM 306 CA VAL A 21 7.143 19.824 7.327 1.00 0.00 C ATOM 307 C VAL A 21 7.818 18.525 7.759 1.00 0.00 C ATOM 308 O VAL A 21 7.719 18.112 8.916 1.00 0.00 O ATOM 309 CB VAL A 21 5.794 19.514 6.632 1.00 0.00 C ATOM 310 CG1 VAL A 21 5.914 18.241 5.771 1.00 0.00 C ATOM 311 CG2 VAL A 21 4.707 19.303 7.691 1.00 0.00 C ATOM 0 H VAL A 21 7.689 20.615 5.452 1.00 0.00 H new ATOM 0 HA VAL A 21 6.955 20.434 8.211 1.00 0.00 H new ATOM 0 HB VAL A 21 5.530 20.355 5.991 1.00 0.00 H new ATOM 0 HG11 VAL A 21 4.958 18.036 5.289 1.00 0.00 H new ATOM 0 HG12 VAL A 21 6.680 18.388 5.010 1.00 0.00 H new ATOM 0 HG13 VAL A 21 6.189 17.398 6.405 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.758 19.085 7.200 1.00 0.00 H new ATOM 0 HG22 VAL A 21 4.983 18.468 8.334 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.605 20.206 8.293 1.00 0.00 H new ATOM 321 N TRP A 22 8.488 17.883 6.814 1.00 0.00 N ATOM 322 CA TRP A 22 9.163 16.628 7.085 1.00 0.00 C ATOM 323 C TRP A 22 10.301 16.819 8.064 1.00 0.00 C ATOM 324 O TRP A 22 10.510 15.999 8.942 1.00 0.00 O ATOM 325 CB TRP A 22 9.715 16.039 5.790 1.00 0.00 C ATOM 326 CG TRP A 22 10.302 14.704 6.083 1.00 0.00 C ATOM 327 CD1 TRP A 22 11.608 14.390 5.968 1.00 0.00 C ATOM 328 CD2 TRP A 22 9.628 13.505 6.546 1.00 0.00 C ATOM 329 NE1 TRP A 22 11.780 13.067 6.333 1.00 0.00 N ATOM 330 CE2 TRP A 22 10.584 12.480 6.697 1.00 0.00 C ATOM 331 CE3 TRP A 22 8.286 13.212 6.847 1.00 0.00 C ATOM 332 CZ2 TRP A 22 10.227 11.209 7.133 1.00 0.00 C ATOM 333 CZ3 TRP A 22 7.921 11.935 7.284 1.00 0.00 C ATOM 334 CH2 TRP A 22 8.892 10.933 7.428 1.00 0.00 C ATOM 0 H TRP A 22 8.577 18.213 5.853 1.00 0.00 H new ATOM 0 HA TRP A 22 8.433 15.947 7.522 1.00 0.00 H new ATOM 0 HB2 TRP A 22 8.921 15.948 5.048 1.00 0.00 H new ATOM 0 HB3 TRP A 22 10.472 16.700 5.367 1.00 0.00 H new ATOM 0 HD1 TRP A 22 12.390 15.060 5.644 1.00 0.00 H new ATOM 0 HE1 TRP A 22 12.679 12.585 6.333 1.00 0.00 H new ATOM 0 HE3 TRP A 22 7.532 13.978 6.740 1.00 0.00 H new ATOM 0 HZ2 TRP A 22 10.978 10.441 7.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 22 6.888 11.719 7.512 1.00 0.00 H new ATOM 0 HH2 TRP A 22 8.606 9.948 7.767 1.00 0.00 H new ATOM 345 N ASN A 23 11.030 17.906 7.906 1.00 0.00 N ATOM 346 CA ASN A 23 12.153 18.188 8.788 1.00 0.00 C ATOM 347 C ASN A 23 11.666 18.693 10.138 1.00 0.00 C ATOM 348 O ASN A 23 12.345 18.533 11.151 1.00 0.00 O ATOM 349 CB ASN A 23 13.066 19.236 8.150 1.00 0.00 C ATOM 350 CG ASN A 23 13.687 18.678 6.874 1.00 0.00 C ATOM 351 OD1 ASN A 23 13.376 17.473 6.480 1.00 0.00 O flip ATOM 352 ND2 ASN A 23 14.477 19.358 6.218 1.00 0.00 N flip ATOM 0 H ASN A 23 10.869 18.606 7.182 1.00 0.00 H new ATOM 0 HA ASN A 23 12.709 17.263 8.941 1.00 0.00 H new ATOM 0 HB2 ASN A 23 12.496 20.137 7.923 1.00 0.00 H new ATOM 0 HB3 ASN A 23 13.850 19.523 8.851 1.00 0.00 H new ATOM 0 HD21 ASN A 23 14.719 20.299 6.527 1.00 0.00 H new ATOM 0 HD22 ASN A 23 14.889 18.980 5.365 1.00 0.00 H new ATOM 359 N GLU A 24 10.507 19.329 10.144 1.00 0.00 N ATOM 360 CA GLU A 24 9.958 19.889 11.381 1.00 0.00 C ATOM 361 C GLU A 24 9.520 18.794 12.363 1.00 0.00 C ATOM 362 O GLU A 24 10.060 18.692 13.465 1.00 0.00 O ATOM 363 CB GLU A 24 8.758 20.808 11.040 1.00 0.00 C ATOM 364 CG GLU A 24 9.206 22.278 11.014 1.00 0.00 C ATOM 365 CD GLU A 24 9.566 22.738 12.422 1.00 0.00 C ATOM 366 OE1 GLU A 24 9.157 22.078 13.363 1.00 0.00 O ATOM 367 OE2 GLU A 24 10.243 23.746 12.540 1.00 0.00 O ATOM 0 H GLU A 24 9.927 19.473 9.317 1.00 0.00 H new ATOM 0 HA GLU A 24 10.744 20.466 11.868 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.341 20.530 10.072 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.967 20.674 11.778 1.00 0.00 H new ATOM 0 HG2 GLU A 24 10.066 22.393 10.354 1.00 0.00 H new ATOM 0 HG3 GLU A 24 8.409 22.903 10.611 1.00 0.00 H new ATOM 374 N LEU A 25 8.538 17.996 11.973 1.00 0.00 N ATOM 375 CA LEU A 25 8.043 16.942 12.846 1.00 0.00 C ATOM 376 C LEU A 25 9.106 15.856 13.041 1.00 0.00 C ATOM 377 O LEU A 25 9.071 15.111 14.019 1.00 0.00 O ATOM 378 CB LEU A 25 6.701 16.380 12.273 1.00 0.00 C ATOM 379 CG LEU A 25 6.888 15.054 11.477 1.00 0.00 C ATOM 380 CD1 LEU A 25 8.013 15.189 10.415 1.00 0.00 C ATOM 381 CD2 LEU A 25 7.192 13.878 12.449 1.00 0.00 C ATOM 0 H LEU A 25 8.072 18.056 11.068 1.00 0.00 H new ATOM 0 HA LEU A 25 7.836 17.348 13.836 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.005 16.209 13.094 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.249 17.128 11.622 1.00 0.00 H new ATOM 0 HG LEU A 25 5.957 14.842 10.951 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.120 14.248 9.876 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.757 15.982 9.713 1.00 0.00 H new ATOM 0 HD13 LEU A 25 8.953 15.432 10.910 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.320 12.958 11.878 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.106 14.091 13.004 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.363 13.759 13.147 1.00 0.00 H new ATOM 393 N LEU A 26 10.059 15.789 12.123 1.00 0.00 N ATOM 394 CA LEU A 26 11.137 14.804 12.223 1.00 0.00 C ATOM 395 C LEU A 26 12.105 15.197 13.334 1.00 0.00 C ATOM 396 O LEU A 26 12.586 14.347 14.081 1.00 0.00 O ATOM 397 CB LEU A 26 11.878 14.713 10.881 1.00 0.00 C ATOM 398 CG LEU A 26 13.162 13.886 11.015 1.00 0.00 C ATOM 399 CD1 LEU A 26 12.819 12.469 11.481 1.00 0.00 C ATOM 400 CD2 LEU A 26 13.849 13.821 9.647 1.00 0.00 C ATOM 0 H LEU A 26 10.112 16.397 11.306 1.00 0.00 H new ATOM 0 HA LEU A 26 10.711 13.829 12.462 1.00 0.00 H new ATOM 0 HB2 LEU A 26 11.227 14.261 10.132 1.00 0.00 H new ATOM 0 HB3 LEU A 26 12.122 15.715 10.528 1.00 0.00 H new ATOM 0 HG LEU A 26 13.825 14.350 11.746 1.00 0.00 H new ATOM 0 HD11 LEU A 26 13.735 11.885 11.575 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.318 12.515 12.448 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.160 11.996 10.753 1.00 0.00 H new ATOM 0 HD21 LEU A 26 14.765 13.235 9.727 1.00 0.00 H new ATOM 0 HD22 LEU A 26 13.180 13.352 8.926 1.00 0.00 H new ATOM 0 HD23 LEU A 26 14.092 14.830 9.313 1.00 0.00 H new ATOM 412 N GLU A 27 12.375 16.488 13.443 1.00 0.00 N ATOM 413 CA GLU A 27 13.280 16.983 14.474 1.00 0.00 C ATOM 414 C GLU A 27 12.584 16.997 15.834 1.00 0.00 C ATOM 415 O GLU A 27 13.220 16.794 16.869 1.00 0.00 O ATOM 416 CB GLU A 27 13.754 18.397 14.124 1.00 0.00 C ATOM 417 CG GLU A 27 14.790 18.326 12.999 1.00 0.00 C ATOM 418 CD GLU A 27 15.247 19.732 12.623 1.00 0.00 C ATOM 419 OE1 GLU A 27 14.666 20.678 13.129 1.00 0.00 O ATOM 420 OE2 GLU A 27 16.173 19.841 11.836 1.00 0.00 O ATOM 0 H GLU A 27 11.985 17.209 12.836 1.00 0.00 H new ATOM 0 HA GLU A 27 14.141 16.317 14.525 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.907 19.009 13.814 1.00 0.00 H new ATOM 0 HB3 GLU A 27 14.188 18.874 15.003 1.00 0.00 H new ATOM 0 HG2 GLU A 27 15.645 17.730 13.318 1.00 0.00 H new ATOM 0 HG3 GLU A 27 14.361 17.829 12.129 1.00 0.00 H new ATOM 427 N LYS A 28 11.279 17.246 15.827 1.00 0.00 N ATOM 428 CA LYS A 28 10.510 17.294 17.068 1.00 0.00 C ATOM 429 C LYS A 28 10.264 15.891 17.628 1.00 0.00 C ATOM 430 O LYS A 28 10.398 15.662 18.830 1.00 0.00 O ATOM 431 CB LYS A 28 9.167 17.983 16.816 1.00 0.00 C ATOM 432 CG LYS A 28 8.425 18.163 18.144 1.00 0.00 C ATOM 433 CD LYS A 28 7.281 19.164 17.961 1.00 0.00 C ATOM 434 CE LYS A 28 6.352 18.685 16.845 1.00 0.00 C ATOM 435 NZ LYS A 28 6.129 17.218 16.979 1.00 0.00 N ATOM 0 H LYS A 28 10.733 17.417 14.982 1.00 0.00 H new ATOM 0 HA LYS A 28 11.088 17.858 17.800 1.00 0.00 H new ATOM 0 HB2 LYS A 28 9.327 18.952 16.343 1.00 0.00 H new ATOM 0 HB3 LYS A 28 8.565 17.388 16.129 1.00 0.00 H new ATOM 0 HG2 LYS A 28 8.033 17.205 18.486 1.00 0.00 H new ATOM 0 HG3 LYS A 28 9.113 18.518 18.911 1.00 0.00 H new ATOM 0 HD2 LYS A 28 6.724 19.268 18.892 1.00 0.00 H new ATOM 0 HD3 LYS A 28 7.681 20.148 17.717 1.00 0.00 H new ATOM 0 HE2 LYS A 28 5.401 19.214 16.897 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.789 18.910 15.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 5.444 16.904 16.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 7.029 16.716 16.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 5.757 17.009 17.927 1.00 0.00 H new ATOM 449 N HIS A 29 9.890 14.959 16.751 1.00 0.00 N ATOM 450 CA HIS A 29 9.610 13.584 17.176 1.00 0.00 C ATOM 451 C HIS A 29 10.880 12.734 17.197 1.00 0.00 C ATOM 452 O HIS A 29 10.828 11.541 17.496 1.00 0.00 O ATOM 453 CB HIS A 29 8.590 12.945 16.229 1.00 0.00 C ATOM 454 CG HIS A 29 7.242 13.578 16.440 1.00 0.00 C ATOM 455 ND1 HIS A 29 6.235 12.950 17.159 1.00 0.00 N ATOM 456 CD2 HIS A 29 6.719 14.779 16.032 1.00 0.00 C ATOM 457 CE1 HIS A 29 5.167 13.772 17.160 1.00 0.00 C ATOM 458 NE2 HIS A 29 5.410 14.900 16.487 1.00 0.00 N ATOM 0 H HIS A 29 9.774 15.127 15.752 1.00 0.00 H new ATOM 0 HA HIS A 29 9.207 13.624 18.188 1.00 0.00 H new ATOM 0 HB2 HIS A 29 8.907 13.076 15.194 1.00 0.00 H new ATOM 0 HB3 HIS A 29 8.532 11.872 16.411 1.00 0.00 H new ATOM 0 HD1 HIS A 29 6.293 12.034 17.605 1.00 0.00 H new ATOM 0 HD2 HIS A 29 7.244 15.519 15.446 1.00 0.00 H new ATOM 0 HE1 HIS A 29 4.229 13.546 17.646 1.00 0.00 H new ATOM 565 N TYR A 36 17.684 7.669 10.055 1.00 0.00 N ATOM 566 CA TYR A 36 16.976 6.400 9.898 1.00 0.00 C ATOM 567 C TYR A 36 17.765 5.492 8.956 1.00 0.00 C ATOM 568 O TYR A 36 17.928 5.801 7.780 1.00 0.00 O ATOM 569 CB TYR A 36 15.555 6.649 9.336 1.00 0.00 C ATOM 570 CG TYR A 36 15.512 7.982 8.619 1.00 0.00 C ATOM 571 CD1 TYR A 36 15.961 8.085 7.296 1.00 0.00 C ATOM 572 CD2 TYR A 36 15.023 9.114 9.281 1.00 0.00 C ATOM 573 CE1 TYR A 36 15.921 9.320 6.637 1.00 0.00 C ATOM 574 CE2 TYR A 36 14.982 10.348 8.622 1.00 0.00 C ATOM 575 CZ TYR A 36 15.432 10.451 7.300 1.00 0.00 C ATOM 576 OH TYR A 36 15.392 11.668 6.650 1.00 0.00 O ATOM 0 HA TYR A 36 16.883 5.915 10.870 1.00 0.00 H new ATOM 0 HB2 TYR A 36 15.280 5.848 8.650 1.00 0.00 H new ATOM 0 HB3 TYR A 36 14.827 6.638 10.147 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.338 7.212 6.784 1.00 0.00 H new ATOM 0 HD2 TYR A 36 14.677 9.035 10.301 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.268 9.399 5.617 1.00 0.00 H new ATOM 0 HE2 TYR A 36 14.603 11.221 9.133 1.00 0.00 H new ATOM 0 HH TYR A 36 15.024 12.348 7.252 1.00 0.00 H new ATOM 586 N VAL A 37 18.262 4.376 9.488 1.00 0.00 N ATOM 587 CA VAL A 37 19.048 3.435 8.687 1.00 0.00 C ATOM 588 C VAL A 37 18.174 2.285 8.188 1.00 0.00 C ATOM 589 O VAL A 37 17.406 1.702 8.951 1.00 0.00 O ATOM 590 CB VAL A 37 20.200 2.878 9.527 1.00 0.00 C ATOM 591 CG1 VAL A 37 21.250 2.244 8.610 1.00 0.00 C ATOM 592 CG2 VAL A 37 20.842 4.016 10.328 1.00 0.00 C ATOM 0 H VAL A 37 18.136 4.102 10.462 1.00 0.00 H new ATOM 0 HA VAL A 37 19.448 3.967 7.824 1.00 0.00 H new ATOM 0 HB VAL A 37 19.815 2.121 10.210 1.00 0.00 H new ATOM 0 HG11 VAL A 37 22.068 1.849 9.212 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.794 1.434 8.041 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.636 2.997 7.923 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.663 3.621 10.927 1.00 0.00 H new ATOM 0 HG22 VAL A 37 21.224 4.773 9.643 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.096 4.464 10.985 1.00 0.00 H new ATOM 602 N SER A 38 18.304 1.966 6.904 1.00 0.00 N ATOM 603 CA SER A 38 17.526 0.883 6.312 1.00 0.00 C ATOM 604 C SER A 38 18.084 -0.471 6.740 1.00 0.00 C ATOM 605 O SER A 38 17.349 -1.453 6.840 1.00 0.00 O ATOM 606 CB SER A 38 17.560 0.990 4.788 1.00 0.00 C ATOM 607 OG SER A 38 18.866 0.669 4.323 1.00 0.00 O ATOM 0 H SER A 38 18.936 2.438 6.257 1.00 0.00 H new ATOM 0 HA SER A 38 16.496 0.967 6.660 1.00 0.00 H new ATOM 0 HB2 SER A 38 16.828 0.313 4.348 1.00 0.00 H new ATOM 0 HB3 SER A 38 17.288 1.999 4.477 1.00 0.00 H new ATOM 0 HG SER A 38 18.891 0.735 3.346 1.00 0.00 H new ATOM 702 N SER A 45 9.752 2.294 15.071 1.00 0.00 N ATOM 703 CA SER A 45 8.639 2.737 15.903 1.00 0.00 C ATOM 704 C SER A 45 8.303 4.199 15.619 1.00 0.00 C ATOM 705 O SER A 45 7.143 4.604 15.690 1.00 0.00 O ATOM 706 CB SER A 45 8.995 2.572 17.381 1.00 0.00 C ATOM 707 OG SER A 45 7.835 2.804 18.172 1.00 0.00 O ATOM 0 HA SER A 45 7.769 2.125 15.667 1.00 0.00 H new ATOM 0 HB2 SER A 45 9.380 1.569 17.565 1.00 0.00 H new ATOM 0 HB3 SER A 45 9.784 3.272 17.657 1.00 0.00 H new ATOM 0 HG SER A 45 8.059 2.698 19.120 1.00 0.00 H new ATOM 713 N GLU A 46 9.326 4.986 15.301 1.00 0.00 N ATOM 714 CA GLU A 46 9.128 6.403 15.012 1.00 0.00 C ATOM 715 C GLU A 46 8.239 6.585 13.784 1.00 0.00 C ATOM 716 O GLU A 46 7.546 7.589 13.656 1.00 0.00 O ATOM 717 CB GLU A 46 10.477 7.084 14.770 1.00 0.00 C ATOM 718 CG GLU A 46 11.278 7.111 16.074 1.00 0.00 C ATOM 719 CD GLU A 46 12.663 7.697 15.821 1.00 0.00 C ATOM 720 OE1 GLU A 46 13.021 7.843 14.665 1.00 0.00 O ATOM 721 OE2 GLU A 46 13.345 7.991 16.789 1.00 0.00 O ATOM 0 H GLU A 46 10.294 4.670 15.237 1.00 0.00 H new ATOM 0 HA GLU A 46 8.639 6.860 15.872 1.00 0.00 H new ATOM 0 HB2 GLU A 46 11.033 6.549 14.000 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.323 8.099 14.404 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.753 7.706 16.821 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.369 6.102 16.476 1.00 0.00 H new ATOM 728 N LEU A 47 8.269 5.610 12.883 1.00 0.00 N ATOM 729 CA LEU A 47 7.460 5.688 11.669 1.00 0.00 C ATOM 730 C LEU A 47 5.983 5.842 12.020 1.00 0.00 C ATOM 731 O LEU A 47 5.273 6.632 11.404 1.00 0.00 O ATOM 732 CB LEU A 47 7.657 4.429 10.814 1.00 0.00 C ATOM 733 CG LEU A 47 6.989 4.621 9.433 1.00 0.00 C ATOM 734 CD1 LEU A 47 7.871 5.497 8.527 1.00 0.00 C ATOM 735 CD2 LEU A 47 6.791 3.251 8.773 1.00 0.00 C ATOM 0 H LEU A 47 8.836 4.766 12.966 1.00 0.00 H new ATOM 0 HA LEU A 47 7.783 6.560 11.100 1.00 0.00 H new ATOM 0 HB2 LEU A 47 8.721 4.227 10.688 1.00 0.00 H new ATOM 0 HB3 LEU A 47 7.226 3.565 11.319 1.00 0.00 H new ATOM 0 HG LEU A 47 6.026 5.113 9.572 1.00 0.00 H new ATOM 0 HD11 LEU A 47 7.386 5.622 7.559 1.00 0.00 H new ATOM 0 HD12 LEU A 47 8.013 6.473 8.991 1.00 0.00 H new ATOM 0 HD13 LEU A 47 8.840 5.017 8.388 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.320 3.381 7.799 1.00 0.00 H new ATOM 0 HD22 LEU A 47 7.758 2.765 8.646 1.00 0.00 H new ATOM 0 HD23 LEU A 47 6.154 2.632 9.404 1.00 0.00 H new ATOM 747 N PHE A 48 5.526 5.082 13.010 1.00 0.00 N ATOM 748 CA PHE A 48 4.129 5.150 13.426 1.00 0.00 C ATOM 749 C PHE A 48 3.807 6.524 14.008 1.00 0.00 C ATOM 750 O PHE A 48 2.788 7.124 13.670 1.00 0.00 O ATOM 751 CB PHE A 48 3.834 4.067 14.463 1.00 0.00 C ATOM 752 CG PHE A 48 2.343 3.961 14.671 1.00 0.00 C ATOM 753 CD1 PHE A 48 1.566 3.205 13.787 1.00 0.00 C ATOM 754 CD2 PHE A 48 1.738 4.620 15.748 1.00 0.00 C ATOM 755 CE1 PHE A 48 0.183 3.107 13.979 1.00 0.00 C ATOM 756 CE2 PHE A 48 0.355 4.523 15.940 1.00 0.00 C ATOM 757 CZ PHE A 48 -0.423 3.766 15.056 1.00 0.00 C ATOM 0 H PHE A 48 6.096 4.418 13.535 1.00 0.00 H new ATOM 0 HA PHE A 48 3.503 4.986 12.549 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.234 3.110 14.128 1.00 0.00 H new ATOM 0 HB3 PHE A 48 4.327 4.307 15.405 1.00 0.00 H new ATOM 0 HD1 PHE A 48 2.033 2.697 12.956 1.00 0.00 H new ATOM 0 HD2 PHE A 48 2.338 5.203 16.431 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -0.417 2.523 13.297 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.112 5.032 16.770 1.00 0.00 H new ATOM 0 HZ PHE A 48 -1.490 3.690 15.204 1.00 0.00 H new ATOM 767 N SER A 49 4.681 7.022 14.874 1.00 0.00 N ATOM 768 CA SER A 49 4.471 8.332 15.481 1.00 0.00 C ATOM 769 C SER A 49 4.438 9.412 14.401 1.00 0.00 C ATOM 770 O SER A 49 3.743 10.421 14.531 1.00 0.00 O ATOM 771 CB SER A 49 5.595 8.634 16.471 1.00 0.00 C ATOM 772 OG SER A 49 6.803 8.861 15.755 1.00 0.00 O ATOM 0 H SER A 49 5.533 6.546 15.170 1.00 0.00 H new ATOM 0 HA SER A 49 3.517 8.325 16.009 1.00 0.00 H new ATOM 0 HB2 SER A 49 5.343 9.510 17.069 1.00 0.00 H new ATOM 0 HB3 SER A 49 5.720 7.801 17.163 1.00 0.00 H new ATOM 0 HG SER A 49 6.868 8.224 15.013 1.00 0.00 H new ATOM 778 N ILE A 50 5.206 9.189 13.343 1.00 0.00 N ATOM 779 CA ILE A 50 5.283 10.138 12.238 1.00 0.00 C ATOM 780 C ILE A 50 4.034 10.066 11.354 1.00 0.00 C ATOM 781 O ILE A 50 3.575 11.080 10.831 1.00 0.00 O ATOM 782 CB ILE A 50 6.531 9.838 11.392 1.00 0.00 C ATOM 783 CG1 ILE A 50 7.797 10.181 12.200 1.00 0.00 C ATOM 784 CG2 ILE A 50 6.503 10.672 10.103 1.00 0.00 C ATOM 785 CD1 ILE A 50 9.002 9.445 11.607 1.00 0.00 C ATOM 0 H ILE A 50 5.786 8.358 13.226 1.00 0.00 H new ATOM 0 HA ILE A 50 5.346 11.143 12.654 1.00 0.00 H new ATOM 0 HB ILE A 50 6.540 8.779 11.133 1.00 0.00 H new ATOM 0 HG12 ILE A 50 7.971 11.257 12.183 1.00 0.00 H new ATOM 0 HG13 ILE A 50 7.662 9.897 13.244 1.00 0.00 H new ATOM 0 HG21 ILE A 50 7.391 10.454 9.509 1.00 0.00 H new ATOM 0 HG22 ILE A 50 5.611 10.423 9.528 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.487 11.732 10.356 1.00 0.00 H new ATOM 0 HD11 ILE A 50 9.896 9.690 12.181 1.00 0.00 H new ATOM 0 HD12 ILE A 50 8.828 8.370 11.648 1.00 0.00 H new ATOM 0 HD13 ILE A 50 9.141 9.751 10.570 1.00 0.00 H new ATOM 797 N VAL A 51 3.501 8.865 11.182 1.00 0.00 N ATOM 798 CA VAL A 51 2.319 8.679 10.346 1.00 0.00 C ATOM 799 C VAL A 51 1.077 9.292 10.998 1.00 0.00 C ATOM 800 O VAL A 51 0.230 9.856 10.314 1.00 0.00 O ATOM 801 CB VAL A 51 2.094 7.178 10.085 1.00 0.00 C ATOM 802 CG1 VAL A 51 0.698 6.952 9.473 1.00 0.00 C ATOM 803 CG2 VAL A 51 3.165 6.668 9.112 1.00 0.00 C ATOM 0 H VAL A 51 3.863 8.010 11.605 1.00 0.00 H new ATOM 0 HA VAL A 51 2.488 9.190 9.398 1.00 0.00 H new ATOM 0 HB VAL A 51 2.162 6.636 11.028 1.00 0.00 H new ATOM 0 HG11 VAL A 51 0.548 5.888 9.292 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -0.065 7.314 10.163 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.622 7.495 8.531 1.00 0.00 H new ATOM 0 HG21 VAL A 51 3.010 5.606 8.924 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.094 7.217 8.173 1.00 0.00 H new ATOM 0 HG23 VAL A 51 4.153 6.819 9.547 1.00 0.00 H new ATOM 813 N GLN A 52 0.966 9.169 12.315 1.00 0.00 N ATOM 814 CA GLN A 52 -0.192 9.714 13.020 1.00 0.00 C ATOM 815 C GLN A 52 -0.102 11.239 13.131 1.00 0.00 C ATOM 816 O GLN A 52 -1.111 11.934 13.032 1.00 0.00 O ATOM 817 CB GLN A 52 -0.292 9.102 14.417 1.00 0.00 C ATOM 818 CG GLN A 52 0.993 9.383 15.189 1.00 0.00 C ATOM 819 CD GLN A 52 0.983 8.627 16.512 1.00 0.00 C ATOM 820 OE1 GLN A 52 1.270 7.430 16.547 1.00 0.00 O ATOM 821 NE2 GLN A 52 0.666 9.257 17.610 1.00 0.00 N ATOM 0 H GLN A 52 1.651 8.704 12.911 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.085 9.462 12.448 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -1.147 9.520 14.948 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -0.457 8.027 14.344 1.00 0.00 H new ATOM 0 HG2 GLN A 52 1.856 9.082 14.596 1.00 0.00 H new ATOM 0 HG3 GLN A 52 1.090 10.453 15.373 1.00 0.00 H new ATOM 0 HE21 GLN A 52 0.429 10.249 17.579 1.00 0.00 H new ATOM 0 HE22 GLN A 52 0.656 8.758 18.499 1.00 0.00 H new ATOM 830 N ASP A 53 1.112 11.751 13.341 1.00 0.00 N ATOM 831 CA ASP A 53 1.309 13.199 13.466 1.00 0.00 C ATOM 832 C ASP A 53 1.147 13.882 12.116 1.00 0.00 C ATOM 833 O ASP A 53 0.310 14.769 11.959 1.00 0.00 O ATOM 834 CB ASP A 53 2.699 13.496 14.032 1.00 0.00 C ATOM 835 CG ASP A 53 2.784 14.956 14.464 1.00 0.00 C ATOM 836 OD1 ASP A 53 2.414 15.243 15.590 1.00 0.00 O ATOM 837 OD2 ASP A 53 3.220 15.766 13.662 1.00 0.00 O ATOM 0 H ASP A 53 1.963 11.195 13.427 1.00 0.00 H new ATOM 0 HA ASP A 53 0.553 13.589 14.148 1.00 0.00 H new ATOM 0 HB2 ASP A 53 2.902 12.844 14.882 1.00 0.00 H new ATOM 0 HB3 ASP A 53 3.460 13.286 13.280 1.00 0.00 H new ATOM 842 N VAL A 54 1.939 13.466 11.140 1.00 0.00 N ATOM 843 CA VAL A 54 1.849 14.053 9.814 1.00 0.00 C ATOM 844 C VAL A 54 0.384 14.118 9.372 1.00 0.00 C ATOM 845 O VAL A 54 -0.017 15.025 8.643 1.00 0.00 O ATOM 846 CB VAL A 54 2.677 13.220 8.817 1.00 0.00 C ATOM 847 CG1 VAL A 54 1.888 11.970 8.396 1.00 0.00 C ATOM 848 CG2 VAL A 54 3.006 14.074 7.576 1.00 0.00 C ATOM 0 H VAL A 54 2.642 12.734 11.239 1.00 0.00 H new ATOM 0 HA VAL A 54 2.250 15.066 9.840 1.00 0.00 H new ATOM 0 HB VAL A 54 3.605 12.908 9.295 1.00 0.00 H new ATOM 0 HG11 VAL A 54 2.480 11.386 7.691 1.00 0.00 H new ATOM 0 HG12 VAL A 54 1.670 11.364 9.275 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.954 12.272 7.922 1.00 0.00 H new ATOM 0 HG21 VAL A 54 3.592 13.483 6.872 1.00 0.00 H new ATOM 0 HG22 VAL A 54 2.080 14.394 7.098 1.00 0.00 H new ATOM 0 HG23 VAL A 54 3.579 14.950 7.879 1.00 0.00 H new ATOM 858 N ALA A 55 -0.404 13.154 9.834 1.00 0.00 N ATOM 859 CA ALA A 55 -1.820 13.106 9.501 1.00 0.00 C ATOM 860 C ALA A 55 -2.574 14.245 10.187 1.00 0.00 C ATOM 861 O ALA A 55 -3.547 14.770 9.646 1.00 0.00 O ATOM 862 CB ALA A 55 -2.409 11.759 9.941 1.00 0.00 C ATOM 0 H ALA A 55 -0.086 12.397 10.439 1.00 0.00 H new ATOM 0 HA ALA A 55 -1.927 13.217 8.422 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -3.469 11.726 9.690 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -1.890 10.950 9.428 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -2.287 11.643 11.018 1.00 0.00 H new ATOM 868 N GLN A 56 -2.121 14.620 11.381 1.00 0.00 N ATOM 869 CA GLN A 56 -2.770 15.694 12.128 1.00 0.00 C ATOM 870 C GLN A 56 -2.592 17.035 11.426 1.00 0.00 C ATOM 871 O GLN A 56 -3.564 17.756 11.202 1.00 0.00 O ATOM 872 CB GLN A 56 -2.193 15.779 13.540 1.00 0.00 C ATOM 873 CG GLN A 56 -2.651 14.567 14.354 1.00 0.00 C ATOM 874 CD GLN A 56 -4.127 14.705 14.710 1.00 0.00 C ATOM 875 OE1 GLN A 56 -4.541 15.726 15.260 1.00 0.00 O ATOM 876 NE2 GLN A 56 -4.950 13.733 14.428 1.00 0.00 N ATOM 0 H GLN A 56 -1.316 14.202 11.848 1.00 0.00 H new ATOM 0 HA GLN A 56 -3.835 15.467 12.182 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -1.104 15.811 13.498 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -2.521 16.699 14.023 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -2.490 13.653 13.782 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -2.056 14.483 15.263 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -4.605 12.888 13.972 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.939 13.818 14.663 1.00 0.00 H new ATOM 885 N ARG A 57 -1.352 17.374 11.080 1.00 0.00 N ATOM 886 CA ARG A 57 -1.098 18.643 10.406 1.00 0.00 C ATOM 887 C ARG A 57 -1.692 18.622 9.004 1.00 0.00 C ATOM 888 O ARG A 57 -2.299 19.599 8.561 1.00 0.00 O ATOM 889 CB ARG A 57 0.404 18.929 10.341 1.00 0.00 C ATOM 890 CG ARG A 57 1.145 17.748 9.701 1.00 0.00 C ATOM 891 CD ARG A 57 2.610 17.785 10.130 1.00 0.00 C ATOM 892 NE ARG A 57 3.143 19.140 9.979 1.00 0.00 N ATOM 893 CZ ARG A 57 4.108 19.602 10.775 1.00 0.00 C ATOM 894 NH1 ARG A 57 4.602 18.843 11.715 1.00 0.00 N ATOM 895 NH2 ARG A 57 4.560 20.816 10.614 1.00 0.00 N ATOM 0 H ARG A 57 -0.525 16.802 11.251 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.575 19.439 10.979 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.584 19.836 9.763 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.790 19.109 11.344 1.00 0.00 H new ATOM 0 HG2 ARG A 57 0.687 16.807 10.007 1.00 0.00 H new ATOM 0 HG3 ARG A 57 1.070 17.801 8.615 1.00 0.00 H new ATOM 0 HD2 ARG A 57 2.702 17.463 11.167 1.00 0.00 H new ATOM 0 HD3 ARG A 57 3.192 17.088 9.527 1.00 0.00 H new ATOM 0 HE ARG A 57 2.768 19.745 9.248 1.00 0.00 H new ATOM 0 HH11 ARG A 57 4.250 17.894 11.842 1.00 0.00 H new ATOM 0 HH12 ARG A 57 5.340 19.199 12.323 1.00 0.00 H new ATOM 0 HH21 ARG A 57 4.175 21.410 9.880 1.00 0.00 H new ATOM 0 HH22 ARG A 57 5.298 21.170 11.222 1.00 0.00 H new ATOM 909 N LEU A 58 -1.529 17.498 8.313 1.00 0.00 N ATOM 910 CA LEU A 58 -2.075 17.360 6.965 1.00 0.00 C ATOM 911 C LEU A 58 -3.601 17.321 7.024 1.00 0.00 C ATOM 912 O LEU A 58 -4.275 17.393 5.997 1.00 0.00 O ATOM 913 CB LEU A 58 -1.560 16.071 6.305 1.00 0.00 C ATOM 914 CG LEU A 58 -0.070 16.202 5.947 1.00 0.00 C ATOM 915 CD1 LEU A 58 0.424 14.863 5.387 1.00 0.00 C ATOM 916 CD2 LEU A 58 0.133 17.308 4.884 1.00 0.00 C ATOM 0 H LEU A 58 -1.030 16.678 8.658 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.752 18.216 6.373 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.704 15.228 6.981 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -2.138 15.861 5.405 1.00 0.00 H new ATOM 0 HG LEU A 58 0.493 16.468 6.842 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.480 14.944 5.129 1.00 0.00 H new ATOM 0 HD12 LEU A 58 0.292 14.084 6.138 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -0.149 14.608 4.495 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.192 17.389 4.641 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.428 17.055 3.984 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.223 18.260 5.277 1.00 0.00 H new ATOM 928 N ASN A 59 -4.133 17.199 8.236 1.00 0.00 N ATOM 929 CA ASN A 59 -5.581 17.141 8.434 1.00 0.00 C ATOM 930 C ASN A 59 -6.163 15.931 7.714 1.00 0.00 C ATOM 931 O ASN A 59 -7.017 16.060 6.837 1.00 0.00 O ATOM 932 CB ASN A 59 -6.239 18.418 7.923 1.00 0.00 C ATOM 933 CG ASN A 59 -7.647 18.548 8.497 1.00 0.00 C ATOM 934 OD1 ASN A 59 -7.981 17.887 9.480 1.00 0.00 O ATOM 935 ND2 ASN A 59 -8.496 19.365 7.937 1.00 0.00 N ATOM 0 H ASN A 59 -3.587 17.138 9.095 1.00 0.00 H new ATOM 0 HA ASN A 59 -5.781 17.047 9.501 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -5.641 19.284 8.207 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -6.282 18.404 6.834 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.439 19.457 8.314 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.216 19.912 7.122 1.00 0.00 H new ATOM 942 N MET A 60 -5.686 14.761 8.101 1.00 0.00 N ATOM 943 CA MET A 60 -6.142 13.504 7.507 1.00 0.00 C ATOM 944 C MET A 60 -6.212 12.415 8.575 1.00 0.00 C ATOM 945 O MET A 60 -5.452 12.441 9.539 1.00 0.00 O ATOM 946 CB MET A 60 -5.165 13.074 6.404 1.00 0.00 C ATOM 947 CG MET A 60 -4.717 14.303 5.620 1.00 0.00 C ATOM 948 SD MET A 60 -3.873 13.782 4.106 1.00 0.00 S ATOM 949 CE MET A 60 -4.169 15.289 3.151 1.00 0.00 C ATOM 0 H MET A 60 -4.979 14.649 8.828 1.00 0.00 H new ATOM 0 HA MET A 60 -7.135 13.652 7.081 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.302 12.573 6.842 1.00 0.00 H new ATOM 0 HB3 MET A 60 -5.644 12.358 5.737 1.00 0.00 H new ATOM 0 HG2 MET A 60 -5.579 14.923 5.373 1.00 0.00 H new ATOM 0 HG3 MET A 60 -4.050 14.912 6.229 1.00 0.00 H new ATOM 0 HE1 MET A 60 -3.724 15.186 2.161 1.00 0.00 H new ATOM 0 HE2 MET A 60 -5.242 15.452 3.052 1.00 0.00 H new ATOM 0 HE3 MET A 60 -3.719 16.139 3.664 1.00 0.00 H new ATOM 959 N PRO A 61 -7.094 11.452 8.426 1.00 0.00 N ATOM 960 CA PRO A 61 -7.218 10.343 9.404 1.00 0.00 C ATOM 961 C PRO A 61 -6.081 9.327 9.239 1.00 0.00 C ATOM 962 O PRO A 61 -5.789 8.879 8.130 1.00 0.00 O ATOM 963 CB PRO A 61 -8.577 9.731 9.075 1.00 0.00 C ATOM 964 CG PRO A 61 -8.769 9.984 7.621 1.00 0.00 C ATOM 965 CD PRO A 61 -8.069 11.314 7.323 1.00 0.00 C ATOM 0 HA PRO A 61 -7.149 10.676 10.440 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -8.594 8.664 9.296 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -9.370 10.191 9.664 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -8.342 9.177 7.026 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -9.829 10.037 7.372 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -7.575 11.298 6.352 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -8.776 12.144 7.307 1.00 0.00 H new ATOM 973 N ILE A 62 -5.438 8.994 10.346 1.00 0.00 N ATOM 974 CA ILE A 62 -4.317 8.056 10.333 1.00 0.00 C ATOM 975 C ILE A 62 -4.582 6.846 9.425 1.00 0.00 C ATOM 976 O ILE A 62 -3.668 6.352 8.772 1.00 0.00 O ATOM 977 CB ILE A 62 -4.039 7.577 11.758 1.00 0.00 C ATOM 978 CG1 ILE A 62 -2.729 6.790 11.785 1.00 0.00 C ATOM 979 CG2 ILE A 62 -5.181 6.679 12.232 1.00 0.00 C ATOM 980 CD1 ILE A 62 -2.387 6.407 13.229 1.00 0.00 C ATOM 0 H ILE A 62 -5.671 9.358 11.270 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.450 8.582 9.933 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.960 8.440 12.419 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.820 5.893 11.172 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -1.925 7.389 11.357 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.979 6.340 13.248 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -6.116 7.240 12.216 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -5.264 5.816 11.571 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -1.453 5.846 13.245 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.278 7.310 13.829 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.187 5.792 13.641 1.00 0.00 H new ATOM 992 N GLN A 63 -5.823 6.364 9.402 1.00 0.00 N ATOM 993 CA GLN A 63 -6.167 5.193 8.576 1.00 0.00 C ATOM 994 C GLN A 63 -5.988 5.479 7.084 1.00 0.00 C ATOM 995 O GLN A 63 -5.658 4.578 6.313 1.00 0.00 O ATOM 996 CB GLN A 63 -7.612 4.767 8.843 1.00 0.00 C ATOM 997 CG GLN A 63 -8.501 6.000 8.946 1.00 0.00 C ATOM 998 CD GLN A 63 -9.969 5.593 8.854 1.00 0.00 C ATOM 999 OE1 GLN A 63 -10.536 5.088 9.822 1.00 0.00 O ATOM 1000 NE2 GLN A 63 -10.620 5.786 7.740 1.00 0.00 N ATOM 0 H GLN A 63 -6.601 6.754 9.934 1.00 0.00 H new ATOM 0 HA GLN A 63 -5.486 4.387 8.851 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -7.964 4.119 8.040 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -7.666 4.190 9.766 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -8.316 6.514 9.889 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -8.259 6.701 8.147 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -10.147 6.205 6.939 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -11.602 5.518 7.670 1.00 0.00 H new ATOM 1009 N ASP A 64 -6.202 6.721 6.680 1.00 0.00 N ATOM 1010 CA ASP A 64 -6.049 7.083 5.266 1.00 0.00 C ATOM 1011 C ASP A 64 -4.592 7.375 4.941 1.00 0.00 C ATOM 1012 O ASP A 64 -4.112 7.055 3.856 1.00 0.00 O ATOM 1013 CB ASP A 64 -6.887 8.307 4.943 1.00 0.00 C ATOM 1014 CG ASP A 64 -6.690 8.704 3.484 1.00 0.00 C ATOM 1015 OD1 ASP A 64 -7.341 8.113 2.638 1.00 0.00 O ATOM 1016 OD2 ASP A 64 -5.891 9.591 3.234 1.00 0.00 O ATOM 0 H ASP A 64 -6.478 7.488 7.293 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.387 6.240 4.664 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -7.940 8.097 5.132 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -6.604 9.134 5.595 1.00 0.00 H new ATOM 1021 N VAL A 65 -3.896 7.989 5.887 1.00 0.00 N ATOM 1022 CA VAL A 65 -2.492 8.326 5.691 1.00 0.00 C ATOM 1023 C VAL A 65 -1.647 7.063 5.548 1.00 0.00 C ATOM 1024 O VAL A 65 -0.817 6.965 4.645 1.00 0.00 O ATOM 1025 CB VAL A 65 -1.991 9.166 6.872 1.00 0.00 C ATOM 1026 CG1 VAL A 65 -0.503 9.486 6.692 1.00 0.00 C ATOM 1027 CG2 VAL A 65 -2.789 10.478 6.937 1.00 0.00 C ATOM 0 H VAL A 65 -4.277 8.263 6.793 1.00 0.00 H new ATOM 0 HA VAL A 65 -2.398 8.905 4.772 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.128 8.604 7.796 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.155 10.083 7.535 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.066 8.557 6.645 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -0.360 10.046 5.768 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -2.435 11.078 7.776 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -2.651 11.034 6.010 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -3.847 10.254 7.072 1.00 0.00 H new ATOM 1037 N VAL A 66 -1.862 6.100 6.434 1.00 0.00 N ATOM 1038 CA VAL A 66 -1.108 4.852 6.376 1.00 0.00 C ATOM 1039 C VAL A 66 -1.365 4.151 5.050 1.00 0.00 C ATOM 1040 O VAL A 66 -0.454 3.581 4.449 1.00 0.00 O ATOM 1041 CB VAL A 66 -1.514 3.935 7.532 1.00 0.00 C ATOM 1042 CG1 VAL A 66 -3.022 3.676 7.471 1.00 0.00 C ATOM 1043 CG2 VAL A 66 -0.767 2.599 7.417 1.00 0.00 C ATOM 0 H VAL A 66 -2.542 6.155 7.192 1.00 0.00 H new ATOM 0 HA VAL A 66 -0.046 5.081 6.461 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.261 4.414 8.478 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.313 3.023 8.294 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.557 4.622 7.552 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -3.271 3.198 6.523 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -1.058 1.948 8.241 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.020 2.121 6.470 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.307 2.778 7.458 1.00 0.00 H new ATOM 1053 N LYS A 67 -2.612 4.204 4.596 1.00 0.00 N ATOM 1054 CA LYS A 67 -2.983 3.576 3.335 1.00 0.00 C ATOM 1055 C LYS A 67 -2.234 4.226 2.175 1.00 0.00 C ATOM 1056 O LYS A 67 -1.481 3.564 1.461 1.00 0.00 O ATOM 1057 CB LYS A 67 -4.492 3.706 3.115 1.00 0.00 C ATOM 1058 CG LYS A 67 -4.885 3.001 1.811 1.00 0.00 C ATOM 1059 CD LYS A 67 -6.397 2.699 1.814 1.00 0.00 C ATOM 1060 CE LYS A 67 -6.730 1.615 2.863 1.00 0.00 C ATOM 1061 NZ LYS A 67 -7.873 0.792 2.374 1.00 0.00 N ATOM 0 H LYS A 67 -3.378 4.672 5.079 1.00 0.00 H new ATOM 0 HA LYS A 67 -2.714 2.521 3.378 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -5.031 3.267 3.954 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -4.774 4.758 3.071 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -4.632 3.629 0.957 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -4.320 2.075 1.703 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -6.955 3.609 2.033 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -6.709 2.364 0.825 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -5.860 0.982 3.038 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -6.983 2.080 3.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -7.829 -0.154 2.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -8.769 1.251 2.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -7.820 0.704 1.339 1.00 0.00 H new ATOM 1075 N ALA A 68 -2.449 5.524 1.990 1.00 0.00 N ATOM 1076 CA ALA A 68 -1.792 6.254 0.909 1.00 0.00 C ATOM 1077 C ALA A 68 -0.282 6.034 0.944 1.00 0.00 C ATOM 1078 O ALA A 68 0.364 5.916 -0.097 1.00 0.00 O ATOM 1079 CB ALA A 68 -2.090 7.749 1.039 1.00 0.00 C ATOM 0 H ALA A 68 -3.069 6.090 2.570 1.00 0.00 H new ATOM 0 HA ALA A 68 -2.178 5.881 -0.040 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.598 8.290 0.231 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.166 7.912 0.982 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -1.718 8.112 1.997 1.00 0.00 H new ATOM 1085 N PHE A 69 0.273 5.990 2.149 1.00 0.00 N ATOM 1086 CA PHE A 69 1.712 5.796 2.317 1.00 0.00 C ATOM 1087 C PHE A 69 2.171 4.516 1.610 1.00 0.00 C ATOM 1088 O PHE A 69 3.227 4.493 0.979 1.00 0.00 O ATOM 1089 CB PHE A 69 2.053 5.718 3.822 1.00 0.00 C ATOM 1090 CG PHE A 69 2.272 7.118 4.389 1.00 0.00 C ATOM 1091 CD1 PHE A 69 1.567 8.221 3.869 1.00 0.00 C ATOM 1092 CD2 PHE A 69 3.185 7.308 5.438 1.00 0.00 C ATOM 1093 CE1 PHE A 69 1.781 9.497 4.397 1.00 0.00 C ATOM 1094 CE2 PHE A 69 3.392 8.589 5.962 1.00 0.00 C ATOM 1095 CZ PHE A 69 2.690 9.682 5.441 1.00 0.00 C ATOM 0 H PHE A 69 -0.246 6.085 3.022 1.00 0.00 H new ATOM 0 HA PHE A 69 2.234 6.642 1.870 1.00 0.00 H new ATOM 0 HB2 PHE A 69 1.244 5.223 4.360 1.00 0.00 H new ATOM 0 HB3 PHE A 69 2.949 5.115 3.968 1.00 0.00 H new ATOM 0 HD1 PHE A 69 0.862 8.081 3.063 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.728 6.466 5.841 1.00 0.00 H new ATOM 0 HE1 PHE A 69 1.242 10.343 3.996 1.00 0.00 H new ATOM 0 HE2 PHE A 69 4.094 8.734 6.769 1.00 0.00 H new ATOM 0 HZ PHE A 69 2.851 10.670 5.847 1.00 0.00 H new ATOM 1105 N GLY A 70 1.377 3.460 1.725 1.00 0.00 N ATOM 1106 CA GLY A 70 1.720 2.186 1.097 1.00 0.00 C ATOM 1107 C GLY A 70 1.725 2.296 -0.429 1.00 0.00 C ATOM 1108 O GLY A 70 2.564 1.698 -1.097 1.00 0.00 O ATOM 0 H GLY A 70 0.498 3.457 2.242 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.702 1.862 1.443 1.00 0.00 H new ATOM 0 HA3 GLY A 70 1.005 1.423 1.405 1.00 0.00 H new ATOM 1112 N GLN A 71 0.783 3.058 -0.971 1.00 0.00 N ATOM 1113 CA GLN A 71 0.694 3.225 -2.421 1.00 0.00 C ATOM 1114 C GLN A 71 1.999 3.794 -2.987 1.00 0.00 C ATOM 1115 O GLN A 71 2.549 3.266 -3.953 1.00 0.00 O ATOM 1116 CB GLN A 71 -0.481 4.162 -2.768 1.00 0.00 C ATOM 1117 CG GLN A 71 -1.776 3.351 -2.885 1.00 0.00 C ATOM 1118 CD GLN A 71 -2.984 4.281 -2.816 1.00 0.00 C ATOM 1119 OE1 GLN A 71 -2.870 5.413 -2.348 1.00 0.00 O ATOM 1120 NE2 GLN A 71 -4.140 3.867 -3.259 1.00 0.00 N ATOM 0 H GLN A 71 0.077 3.566 -0.438 1.00 0.00 H new ATOM 0 HA GLN A 71 0.523 2.247 -2.870 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -0.588 4.926 -1.998 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -0.280 4.680 -3.706 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -1.785 2.799 -3.825 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -1.827 2.615 -2.083 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -4.231 2.928 -3.646 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -4.952 4.483 -3.218 1.00 0.00 H new ATOM 1129 N PHE A 72 2.482 4.874 -2.386 1.00 0.00 N ATOM 1130 CA PHE A 72 3.719 5.505 -2.846 1.00 0.00 C ATOM 1131 C PHE A 72 4.930 4.621 -2.539 1.00 0.00 C ATOM 1132 O PHE A 72 5.831 4.483 -3.363 1.00 0.00 O ATOM 1133 CB PHE A 72 3.892 6.877 -2.158 1.00 0.00 C ATOM 1134 CG PHE A 72 3.296 7.970 -3.022 1.00 0.00 C ATOM 1135 CD1 PHE A 72 3.834 8.225 -4.289 1.00 0.00 C ATOM 1136 CD2 PHE A 72 2.212 8.725 -2.557 1.00 0.00 C ATOM 1137 CE1 PHE A 72 3.290 9.232 -5.090 1.00 0.00 C ATOM 1138 CE2 PHE A 72 1.668 9.733 -3.360 1.00 0.00 C ATOM 1139 CZ PHE A 72 2.206 9.985 -4.627 1.00 0.00 C ATOM 0 H PHE A 72 2.043 5.330 -1.586 1.00 0.00 H new ATOM 0 HA PHE A 72 3.654 5.641 -3.926 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.406 6.868 -1.183 1.00 0.00 H new ATOM 0 HB3 PHE A 72 4.950 7.075 -1.985 1.00 0.00 H new ATOM 0 HD1 PHE A 72 4.670 7.643 -4.647 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.797 8.529 -1.580 1.00 0.00 H new ATOM 0 HE1 PHE A 72 3.706 9.429 -6.067 1.00 0.00 H new ATOM 0 HE2 PHE A 72 0.833 10.317 -3.002 1.00 0.00 H new ATOM 0 HZ PHE A 72 1.784 10.761 -5.248 1.00 0.00 H new ATOM 1149 N LEU A 73 4.957 4.039 -1.348 1.00 0.00 N ATOM 1150 CA LEU A 73 6.079 3.193 -0.962 1.00 0.00 C ATOM 1151 C LEU A 73 6.436 2.220 -2.084 1.00 0.00 C ATOM 1152 O LEU A 73 7.607 2.032 -2.402 1.00 0.00 O ATOM 1153 CB LEU A 73 5.751 2.417 0.330 1.00 0.00 C ATOM 1154 CG LEU A 73 7.044 2.236 1.164 1.00 0.00 C ATOM 1155 CD1 LEU A 73 7.265 3.468 2.051 1.00 0.00 C ATOM 1156 CD2 LEU A 73 6.921 0.993 2.044 1.00 0.00 C ATOM 0 H LEU A 73 4.227 4.134 -0.642 1.00 0.00 H new ATOM 0 HA LEU A 73 6.939 3.836 -0.776 1.00 0.00 H new ATOM 0 HB2 LEU A 73 5.003 2.956 0.911 1.00 0.00 H new ATOM 0 HB3 LEU A 73 5.324 1.444 0.085 1.00 0.00 H new ATOM 0 HG LEU A 73 7.891 2.119 0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 73 8.175 3.337 2.636 1.00 0.00 H new ATOM 0 HD12 LEU A 73 7.361 4.355 1.425 1.00 0.00 H new ATOM 0 HD13 LEU A 73 6.416 3.589 2.724 1.00 0.00 H new ATOM 0 HD21 LEU A 73 7.833 0.870 2.629 1.00 0.00 H new ATOM 0 HD22 LEU A 73 6.071 1.106 2.717 1.00 0.00 H new ATOM 0 HD23 LEU A 73 6.772 0.115 1.415 1.00 0.00 H new ATOM 1168 N PHE A 74 5.423 1.607 -2.678 1.00 0.00 N ATOM 1169 CA PHE A 74 5.648 0.659 -3.762 1.00 0.00 C ATOM 1170 C PHE A 74 6.330 1.341 -4.948 1.00 0.00 C ATOM 1171 O PHE A 74 7.242 0.783 -5.557 1.00 0.00 O ATOM 1172 CB PHE A 74 4.316 0.068 -4.223 1.00 0.00 C ATOM 1173 CG PHE A 74 4.577 -1.127 -5.103 1.00 0.00 C ATOM 1174 CD1 PHE A 74 4.876 -0.945 -6.456 1.00 0.00 C ATOM 1175 CD2 PHE A 74 4.522 -2.416 -4.563 1.00 0.00 C ATOM 1176 CE1 PHE A 74 5.121 -2.056 -7.273 1.00 0.00 C ATOM 1177 CE2 PHE A 74 4.768 -3.526 -5.376 1.00 0.00 C ATOM 1178 CZ PHE A 74 5.067 -3.347 -6.732 1.00 0.00 C ATOM 0 H PHE A 74 4.443 1.747 -2.431 1.00 0.00 H new ATOM 0 HA PHE A 74 6.296 -0.134 -3.389 1.00 0.00 H new ATOM 0 HB2 PHE A 74 3.718 -0.225 -3.360 1.00 0.00 H new ATOM 0 HB3 PHE A 74 3.742 0.817 -4.769 1.00 0.00 H new ATOM 0 HD1 PHE A 74 4.918 0.051 -6.871 1.00 0.00 H new ATOM 0 HD2 PHE A 74 4.289 -2.554 -3.517 1.00 0.00 H new ATOM 0 HE1 PHE A 74 5.351 -1.917 -8.319 1.00 0.00 H new ATOM 0 HE2 PHE A 74 4.727 -4.521 -4.958 1.00 0.00 H new ATOM 0 HZ PHE A 74 5.256 -4.204 -7.361 1.00 0.00 H new ATOM 1188 N ASN A 75 5.865 2.540 -5.278 1.00 0.00 N ATOM 1189 CA ASN A 75 6.418 3.285 -6.404 1.00 0.00 C ATOM 1190 C ASN A 75 7.919 3.527 -6.240 1.00 0.00 C ATOM 1191 O ASN A 75 8.711 3.162 -7.108 1.00 0.00 O ATOM 1192 CB ASN A 75 5.699 4.631 -6.533 1.00 0.00 C ATOM 1193 CG ASN A 75 4.288 4.421 -7.063 1.00 0.00 C ATOM 1194 OD1 ASN A 75 3.981 4.821 -8.186 1.00 0.00 O ATOM 1195 ND2 ASN A 75 3.405 3.814 -6.318 1.00 0.00 N ATOM 0 H ASN A 75 5.110 3.016 -4.785 1.00 0.00 H new ATOM 0 HA ASN A 75 6.267 2.689 -7.304 1.00 0.00 H new ATOM 0 HB2 ASN A 75 5.662 5.127 -5.563 1.00 0.00 H new ATOM 0 HB3 ASN A 75 6.254 5.286 -7.204 1.00 0.00 H new ATOM 0 HD21 ASN A 75 2.457 3.670 -6.666 1.00 0.00 H new ATOM 0 HD22 ASN A 75 3.663 3.484 -5.388 1.00 0.00 H new ATOM 1202 N GLY A 76 8.302 4.156 -5.137 1.00 0.00 N ATOM 1203 CA GLY A 76 9.708 4.454 -4.891 1.00 0.00 C ATOM 1204 C GLY A 76 10.539 3.185 -4.748 1.00 0.00 C ATOM 1205 O GLY A 76 11.629 3.084 -5.309 1.00 0.00 O ATOM 0 H GLY A 76 7.666 4.468 -4.403 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.101 5.055 -5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 76 9.799 5.052 -3.985 1.00 0.00 H new ATOM 1209 N LEU A 77 10.028 2.223 -3.993 1.00 0.00 N ATOM 1210 CA LEU A 77 10.751 0.974 -3.791 1.00 0.00 C ATOM 1211 C LEU A 77 11.108 0.347 -5.131 1.00 0.00 C ATOM 1212 O LEU A 77 12.270 0.044 -5.395 1.00 0.00 O ATOM 1213 CB LEU A 77 9.900 0.000 -2.969 1.00 0.00 C ATOM 1214 CG LEU A 77 9.901 0.422 -1.488 1.00 0.00 C ATOM 1215 CD1 LEU A 77 8.833 -0.377 -0.734 1.00 0.00 C ATOM 1216 CD2 LEU A 77 11.290 0.157 -0.857 1.00 0.00 C ATOM 0 H LEU A 77 9.128 2.280 -3.516 1.00 0.00 H new ATOM 0 HA LEU A 77 11.671 1.188 -3.247 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.879 -0.016 -3.351 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.293 -1.012 -3.068 1.00 0.00 H new ATOM 0 HG LEU A 77 9.681 1.487 -1.420 1.00 0.00 H new ATOM 0 HD11 LEU A 77 8.830 -0.081 0.315 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.854 -0.177 -1.170 1.00 0.00 H new ATOM 0 HD13 LEU A 77 9.054 -1.442 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 77 11.278 0.460 0.190 1.00 0.00 H new ATOM 0 HD22 LEU A 77 11.524 -0.905 -0.925 1.00 0.00 H new ATOM 0 HD23 LEU A 77 12.048 0.730 -1.391 1.00 0.00 H new ATOM 1228 N ALA A 78 10.103 0.152 -5.970 1.00 0.00 N ATOM 1229 CA ALA A 78 10.325 -0.445 -7.280 1.00 0.00 C ATOM 1230 C ALA A 78 11.531 0.191 -7.965 1.00 0.00 C ATOM 1231 O ALA A 78 12.281 -0.481 -8.670 1.00 0.00 O ATOM 1232 CB ALA A 78 9.087 -0.262 -8.152 1.00 0.00 C ATOM 0 H ALA A 78 9.133 0.396 -5.771 1.00 0.00 H new ATOM 0 HA ALA A 78 10.520 -1.509 -7.144 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.261 -0.711 -9.130 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.233 -0.745 -7.677 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.881 0.802 -8.273 1.00 0.00 H new ATOM 1238 N SER A 79 11.705 1.491 -7.758 1.00 0.00 N ATOM 1239 CA SER A 79 12.821 2.208 -8.367 1.00 0.00 C ATOM 1240 C SER A 79 14.148 1.797 -7.734 1.00 0.00 C ATOM 1241 O SER A 79 15.204 1.924 -8.353 1.00 0.00 O ATOM 1242 CB SER A 79 12.623 3.716 -8.205 1.00 0.00 C ATOM 1243 OG SER A 79 13.041 4.107 -6.902 1.00 0.00 O ATOM 0 H SER A 79 11.094 2.067 -7.179 1.00 0.00 H new ATOM 0 HA SER A 79 12.849 1.953 -9.426 1.00 0.00 H new ATOM 0 HB2 SER A 79 13.197 4.253 -8.960 1.00 0.00 H new ATOM 0 HB3 SER A 79 11.575 3.975 -8.357 1.00 0.00 H new ATOM 0 HG SER A 79 12.280 4.059 -6.286 1.00 0.00 H new ATOM 1249 N ARG A 80 14.092 1.307 -6.494 1.00 0.00 N ATOM 1250 CA ARG A 80 15.305 0.884 -5.787 1.00 0.00 C ATOM 1251 C ARG A 80 15.507 -0.624 -5.915 1.00 0.00 C ATOM 1252 O ARG A 80 16.637 -1.099 -6.030 1.00 0.00 O ATOM 1253 CB ARG A 80 15.199 1.257 -4.302 1.00 0.00 C ATOM 1254 CG ARG A 80 14.970 2.774 -4.152 1.00 0.00 C ATOM 1255 CD ARG A 80 16.311 3.517 -4.215 1.00 0.00 C ATOM 1256 NE ARG A 80 16.109 4.940 -3.965 1.00 0.00 N ATOM 1257 CZ ARG A 80 17.140 5.775 -3.884 1.00 0.00 C ATOM 1258 NH1 ARG A 80 18.357 5.327 -4.030 1.00 0.00 N ATOM 1259 NH2 ARG A 80 16.934 7.044 -3.661 1.00 0.00 N ATOM 0 H ARG A 80 13.229 1.193 -5.962 1.00 0.00 H new ATOM 0 HA ARG A 80 16.158 1.393 -6.235 1.00 0.00 H new ATOM 0 HB2 ARG A 80 14.378 0.710 -3.839 1.00 0.00 H new ATOM 0 HB3 ARG A 80 16.110 0.966 -3.780 1.00 0.00 H new ATOM 0 HG2 ARG A 80 14.310 3.130 -4.943 1.00 0.00 H new ATOM 0 HG3 ARG A 80 14.473 2.983 -3.204 1.00 0.00 H new ATOM 0 HD2 ARG A 80 16.999 3.104 -3.477 1.00 0.00 H new ATOM 0 HD3 ARG A 80 16.769 3.373 -5.193 1.00 0.00 H new ATOM 0 HE ARG A 80 15.161 5.300 -3.851 1.00 0.00 H new ATOM 0 HH11 ARG A 80 18.518 4.335 -4.206 1.00 0.00 H new ATOM 0 HH12 ARG A 80 19.148 5.969 -3.968 1.00 0.00 H new ATOM 0 HH21 ARG A 80 15.983 7.394 -3.549 1.00 0.00 H new ATOM 0 HH22 ARG A 80 17.724 7.686 -3.599 1.00 0.00 H new ATOM 1273 N HIS A 81 14.403 -1.371 -5.892 1.00 0.00 N ATOM 1274 CA HIS A 81 14.461 -2.834 -6.004 1.00 0.00 C ATOM 1275 C HIS A 81 13.814 -3.290 -7.316 1.00 0.00 C ATOM 1276 O HIS A 81 13.199 -4.354 -7.383 1.00 0.00 O ATOM 1277 CB HIS A 81 13.729 -3.476 -4.810 1.00 0.00 C ATOM 1278 CG HIS A 81 14.648 -3.542 -3.616 1.00 0.00 C ATOM 1279 ND1 HIS A 81 14.411 -4.398 -2.550 1.00 0.00 N ATOM 1280 CD2 HIS A 81 15.803 -2.868 -3.307 1.00 0.00 C ATOM 1281 CE1 HIS A 81 15.405 -4.216 -1.658 1.00 0.00 C ATOM 1282 NE2 HIS A 81 16.280 -3.295 -2.072 1.00 0.00 N ATOM 0 H HIS A 81 13.461 -0.992 -5.797 1.00 0.00 H new ATOM 0 HA HIS A 81 15.505 -3.148 -5.998 1.00 0.00 H new ATOM 0 HB2 HIS A 81 12.840 -2.896 -4.563 1.00 0.00 H new ATOM 0 HB3 HIS A 81 13.392 -4.478 -5.076 1.00 0.00 H new ATOM 0 HD2 HIS A 81 16.271 -2.119 -3.929 1.00 0.00 H new ATOM 0 HE1 HIS A 81 15.485 -4.750 -0.722 1.00 0.00 H new ATOM 0 HE2 HIS A 81 17.118 -2.974 -1.587 1.00 0.00 H new ATOM 1291 N THR A 82 13.960 -2.473 -8.350 1.00 0.00 N ATOM 1292 CA THR A 82 13.392 -2.789 -9.651 1.00 0.00 C ATOM 1293 C THR A 82 13.733 -4.224 -10.065 1.00 0.00 C ATOM 1294 O THR A 82 12.949 -4.885 -10.743 1.00 0.00 O ATOM 1295 CB THR A 82 13.935 -1.806 -10.703 1.00 0.00 C ATOM 1296 OG1 THR A 82 14.152 -0.539 -10.097 1.00 0.00 O ATOM 1297 CG2 THR A 82 12.930 -1.659 -11.845 1.00 0.00 C ATOM 0 H THR A 82 14.466 -1.588 -8.312 1.00 0.00 H new ATOM 0 HA THR A 82 12.308 -2.699 -9.584 1.00 0.00 H new ATOM 0 HB THR A 82 14.875 -2.188 -11.101 1.00 0.00 H new ATOM 0 HG1 THR A 82 13.300 -0.183 -9.769 1.00 0.00 H new ATOM 0 HG21 THR A 82 13.321 -0.962 -12.586 1.00 0.00 H new ATOM 0 HG22 THR A 82 12.765 -2.630 -12.312 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.986 -1.280 -11.453 1.00 0.00 H new ATOM 1305 N ASP A 83 14.911 -4.690 -9.663 1.00 0.00 N ATOM 1306 CA ASP A 83 15.348 -6.041 -10.013 1.00 0.00 C ATOM 1307 C ASP A 83 14.436 -7.096 -9.392 1.00 0.00 C ATOM 1308 O ASP A 83 13.998 -8.024 -10.070 1.00 0.00 O ATOM 1309 CB ASP A 83 16.785 -6.264 -9.540 1.00 0.00 C ATOM 1310 CG ASP A 83 17.315 -7.584 -10.087 1.00 0.00 C ATOM 1311 OD1 ASP A 83 16.619 -8.196 -10.881 1.00 0.00 O ATOM 1312 OD2 ASP A 83 18.410 -7.964 -9.706 1.00 0.00 O ATOM 0 H ASP A 83 15.576 -4.160 -9.100 1.00 0.00 H new ATOM 0 HA ASP A 83 15.299 -6.140 -11.097 1.00 0.00 H new ATOM 0 HB2 ASP A 83 17.418 -5.442 -9.874 1.00 0.00 H new ATOM 0 HB3 ASP A 83 16.821 -6.272 -8.451 1.00 0.00 H new ATOM 1317 N VAL A 84 14.155 -6.950 -8.104 1.00 0.00 N ATOM 1318 CA VAL A 84 13.293 -7.901 -7.412 1.00 0.00 C ATOM 1319 C VAL A 84 11.855 -7.756 -7.881 1.00 0.00 C ATOM 1320 O VAL A 84 11.185 -8.741 -8.191 1.00 0.00 O ATOM 1321 CB VAL A 84 13.357 -7.663 -5.903 1.00 0.00 C ATOM 1322 CG1 VAL A 84 12.418 -8.641 -5.193 1.00 0.00 C ATOM 1323 CG2 VAL A 84 14.790 -7.884 -5.413 1.00 0.00 C ATOM 0 H VAL A 84 14.507 -6.190 -7.521 1.00 0.00 H new ATOM 0 HA VAL A 84 13.642 -8.908 -7.639 1.00 0.00 H new ATOM 0 HB VAL A 84 13.051 -6.640 -5.682 1.00 0.00 H new ATOM 0 HG11 VAL A 84 12.463 -8.472 -4.117 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.398 -8.484 -5.543 1.00 0.00 H new ATOM 0 HG13 VAL A 84 12.724 -9.664 -5.413 1.00 0.00 H new ATOM 0 HG21 VAL A 84 14.837 -7.715 -4.337 1.00 0.00 H new ATOM 0 HG22 VAL A 84 15.096 -8.907 -5.633 1.00 0.00 H new ATOM 0 HG23 VAL A 84 15.459 -7.188 -5.919 1.00 0.00 H new ATOM 1333 N VAL A 85 11.382 -6.517 -7.915 1.00 0.00 N ATOM 1334 CA VAL A 85 10.017 -6.236 -8.328 1.00 0.00 C ATOM 1335 C VAL A 85 9.765 -6.698 -9.758 1.00 0.00 C ATOM 1336 O VAL A 85 8.810 -7.417 -10.010 1.00 0.00 O ATOM 1337 CB VAL A 85 9.747 -4.726 -8.196 1.00 0.00 C ATOM 1338 CG1 VAL A 85 8.378 -4.375 -8.802 1.00 0.00 C ATOM 1339 CG2 VAL A 85 9.764 -4.338 -6.707 1.00 0.00 C ATOM 0 H VAL A 85 11.925 -5.692 -7.661 1.00 0.00 H new ATOM 0 HA VAL A 85 9.335 -6.788 -7.680 1.00 0.00 H new ATOM 0 HB VAL A 85 10.521 -4.176 -8.732 1.00 0.00 H new ATOM 0 HG11 VAL A 85 8.200 -3.304 -8.702 1.00 0.00 H new ATOM 0 HG12 VAL A 85 8.366 -4.648 -9.857 1.00 0.00 H new ATOM 0 HG13 VAL A 85 7.596 -4.924 -8.277 1.00 0.00 H new ATOM 0 HG21 VAL A 85 9.573 -3.269 -6.607 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.992 -4.895 -6.177 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.739 -4.574 -6.281 1.00 0.00 H new ATOM 1349 N ASP A 86 10.622 -6.274 -10.685 1.00 0.00 N ATOM 1350 CA ASP A 86 10.467 -6.640 -12.105 1.00 0.00 C ATOM 1351 C ASP A 86 10.015 -8.101 -12.284 1.00 0.00 C ATOM 1352 O ASP A 86 9.590 -8.493 -13.371 1.00 0.00 O ATOM 1353 CB ASP A 86 11.787 -6.418 -12.851 1.00 0.00 C ATOM 1354 CG ASP A 86 11.657 -6.886 -14.297 1.00 0.00 C ATOM 1355 OD1 ASP A 86 10.549 -6.872 -14.806 1.00 0.00 O ATOM 1356 OD2 ASP A 86 12.668 -7.252 -14.873 1.00 0.00 O ATOM 0 H ASP A 86 11.428 -5.681 -10.488 1.00 0.00 H new ATOM 0 HA ASP A 86 9.690 -5.998 -12.521 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.055 -5.362 -12.825 1.00 0.00 H new ATOM 0 HB3 ASP A 86 12.590 -6.963 -12.355 1.00 0.00 H new ATOM 1361 N LYS A 87 10.101 -8.892 -11.222 1.00 0.00 N ATOM 1362 CA LYS A 87 9.687 -10.296 -11.290 1.00 0.00 C ATOM 1363 C LYS A 87 8.165 -10.419 -11.135 1.00 0.00 C ATOM 1364 O LYS A 87 7.607 -11.514 -11.212 1.00 0.00 O ATOM 1365 CB LYS A 87 10.391 -11.100 -10.198 1.00 0.00 C ATOM 1366 CG LYS A 87 11.900 -11.161 -10.499 1.00 0.00 C ATOM 1367 CD LYS A 87 12.681 -11.444 -9.212 1.00 0.00 C ATOM 1368 CE LYS A 87 12.323 -12.833 -8.690 1.00 0.00 C ATOM 1369 NZ LYS A 87 12.612 -13.849 -9.741 1.00 0.00 N ATOM 0 H LYS A 87 10.449 -8.594 -10.311 1.00 0.00 H new ATOM 0 HA LYS A 87 9.968 -10.694 -12.265 1.00 0.00 H new ATOM 0 HB2 LYS A 87 10.222 -10.639 -9.225 1.00 0.00 H new ATOM 0 HB3 LYS A 87 9.978 -12.107 -10.149 1.00 0.00 H new ATOM 0 HG2 LYS A 87 12.101 -11.940 -11.235 1.00 0.00 H new ATOM 0 HG3 LYS A 87 12.231 -10.218 -10.935 1.00 0.00 H new ATOM 0 HD2 LYS A 87 13.752 -11.382 -9.404 1.00 0.00 H new ATOM 0 HD3 LYS A 87 12.447 -10.691 -8.460 1.00 0.00 H new ATOM 0 HE2 LYS A 87 12.896 -13.053 -7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 87 11.269 -12.869 -8.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 12.994 -14.708 -9.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 11.735 -14.082 -10.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 13.309 -13.466 -10.412 1.00 0.00 H new ATOM 1383 N PHE A 88 7.508 -9.282 -10.910 1.00 0.00 N ATOM 1384 CA PHE A 88 6.055 -9.249 -10.737 1.00 0.00 C ATOM 1385 C PHE A 88 5.348 -9.432 -12.066 1.00 0.00 C ATOM 1386 O PHE A 88 4.139 -9.566 -12.096 1.00 0.00 O ATOM 1387 CB PHE A 88 5.630 -7.904 -10.101 1.00 0.00 C ATOM 1388 CG PHE A 88 5.531 -6.820 -11.165 1.00 0.00 C ATOM 1389 CD1 PHE A 88 4.376 -6.702 -11.950 1.00 0.00 C ATOM 1390 CD2 PHE A 88 6.593 -5.943 -11.362 1.00 0.00 C ATOM 1391 CE1 PHE A 88 4.297 -5.704 -12.928 1.00 0.00 C ATOM 1392 CE2 PHE A 88 6.520 -4.953 -12.331 1.00 0.00 C ATOM 1393 CZ PHE A 88 5.371 -4.827 -13.120 1.00 0.00 C ATOM 0 H PHE A 88 7.959 -8.370 -10.843 1.00 0.00 H new ATOM 0 HA PHE A 88 5.771 -10.069 -10.078 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.669 -8.019 -9.600 1.00 0.00 H new ATOM 0 HB3 PHE A 88 6.353 -7.610 -9.340 1.00 0.00 H new ATOM 0 HD1 PHE A 88 3.549 -7.380 -11.801 1.00 0.00 H new ATOM 0 HD2 PHE A 88 7.482 -6.034 -10.755 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.408 -5.611 -13.534 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.351 -4.279 -12.477 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.313 -4.056 -13.874 1.00 0.00 H new ATOM 1403 N ASP A 89 6.133 -9.439 -13.150 1.00 0.00 N ATOM 1404 CA ASP A 89 5.619 -9.607 -14.525 1.00 0.00 C ATOM 1405 C ASP A 89 4.134 -9.259 -14.637 1.00 0.00 C ATOM 1406 O ASP A 89 3.742 -8.354 -15.375 1.00 0.00 O ATOM 1407 CB ASP A 89 5.837 -11.049 -14.984 1.00 0.00 C ATOM 1408 CG ASP A 89 7.329 -11.347 -15.074 1.00 0.00 C ATOM 1409 OD1 ASP A 89 8.094 -10.408 -15.220 1.00 0.00 O ATOM 1410 OD2 ASP A 89 7.686 -12.510 -14.996 1.00 0.00 O ATOM 0 H ASP A 89 7.146 -9.328 -13.104 1.00 0.00 H new ATOM 0 HA ASP A 89 6.170 -8.917 -15.164 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.362 -11.738 -14.285 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.367 -11.205 -15.955 1.00 0.00 H new ATOM 1415 N ASP A 90 3.329 -9.978 -13.878 1.00 0.00 N ATOM 1416 CA ASP A 90 1.881 -9.761 -13.848 1.00 0.00 C ATOM 1417 C ASP A 90 1.390 -9.712 -12.398 1.00 0.00 C ATOM 1418 O ASP A 90 1.942 -10.379 -11.523 1.00 0.00 O ATOM 1419 CB ASP A 90 1.160 -10.878 -14.604 1.00 0.00 C ATOM 1420 CG ASP A 90 1.487 -10.797 -16.090 1.00 0.00 C ATOM 1421 OD1 ASP A 90 2.090 -9.816 -16.491 1.00 0.00 O ATOM 1422 OD2 ASP A 90 1.131 -11.719 -16.806 1.00 0.00 O ATOM 0 H ASP A 90 3.651 -10.727 -13.265 1.00 0.00 H new ATOM 0 HA ASP A 90 1.660 -8.810 -14.333 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.461 -11.848 -14.209 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.084 -10.793 -14.455 1.00 0.00 H new ATOM 1427 N PHE A 91 0.363 -8.906 -12.154 1.00 0.00 N ATOM 1428 CA PHE A 91 -0.192 -8.754 -10.808 1.00 0.00 C ATOM 1429 C PHE A 91 -0.517 -10.105 -10.175 1.00 0.00 C ATOM 1430 O PHE A 91 -0.259 -10.318 -8.991 1.00 0.00 O ATOM 1431 CB PHE A 91 -1.463 -7.903 -10.869 1.00 0.00 C ATOM 1432 CG PHE A 91 -1.822 -7.429 -9.482 1.00 0.00 C ATOM 1433 CD1 PHE A 91 -1.206 -6.289 -8.956 1.00 0.00 C ATOM 1434 CD2 PHE A 91 -2.770 -8.126 -8.725 1.00 0.00 C ATOM 1435 CE1 PHE A 91 -1.537 -5.845 -7.670 1.00 0.00 C ATOM 1436 CE2 PHE A 91 -3.101 -7.683 -7.439 1.00 0.00 C ATOM 1437 CZ PHE A 91 -2.485 -6.542 -6.912 1.00 0.00 C ATOM 0 H PHE A 91 -0.104 -8.347 -12.868 1.00 0.00 H new ATOM 0 HA PHE A 91 0.561 -8.264 -10.191 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -1.309 -7.048 -11.528 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.283 -8.486 -11.289 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -0.475 -5.751 -9.542 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -3.246 -9.005 -9.133 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -1.061 -4.965 -7.263 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -3.832 -8.222 -6.854 1.00 0.00 H new ATOM 0 HZ PHE A 91 -2.741 -6.199 -5.920 1.00 0.00 H new ATOM 1447 N THR A 92 -1.083 -11.014 -10.959 1.00 0.00 N ATOM 1448 CA THR A 92 -1.431 -12.331 -10.442 1.00 0.00 C ATOM 1449 C THR A 92 -0.181 -13.077 -9.993 1.00 0.00 C ATOM 1450 O THR A 92 -0.199 -13.794 -8.991 1.00 0.00 O ATOM 1451 CB THR A 92 -2.153 -13.148 -11.518 1.00 0.00 C ATOM 1452 OG1 THR A 92 -3.161 -12.346 -12.120 1.00 0.00 O ATOM 1453 CG2 THR A 92 -2.793 -14.385 -10.882 1.00 0.00 C ATOM 0 H THR A 92 -1.308 -10.867 -11.943 1.00 0.00 H new ATOM 0 HA THR A 92 -2.092 -12.197 -9.585 1.00 0.00 H new ATOM 0 HB THR A 92 -1.437 -13.464 -12.276 1.00 0.00 H new ATOM 0 HG1 THR A 92 -3.624 -12.866 -12.810 1.00 0.00 H new ATOM 0 HG21 THR A 92 -3.306 -14.965 -11.649 1.00 0.00 H new ATOM 0 HG22 THR A 92 -2.019 -14.999 -10.421 1.00 0.00 H new ATOM 0 HG23 THR A 92 -3.510 -14.074 -10.122 1.00 0.00 H new ATOM 1461 N SER A 93 0.902 -12.909 -10.742 1.00 0.00 N ATOM 1462 CA SER A 93 2.154 -13.576 -10.411 1.00 0.00 C ATOM 1463 C SER A 93 2.761 -12.984 -9.141 1.00 0.00 C ATOM 1464 O SER A 93 3.487 -13.658 -8.411 1.00 0.00 O ATOM 1465 CB SER A 93 3.144 -13.427 -11.565 1.00 0.00 C ATOM 1466 OG SER A 93 3.593 -12.077 -11.627 1.00 0.00 O ATOM 0 H SER A 93 0.939 -12.322 -11.575 1.00 0.00 H new ATOM 0 HA SER A 93 1.946 -14.632 -10.242 1.00 0.00 H new ATOM 0 HB2 SER A 93 3.991 -14.098 -11.422 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.670 -13.708 -12.505 1.00 0.00 H new ATOM 0 HG SER A 93 2.853 -11.475 -11.401 1.00 0.00 H new ATOM 1472 N LEU A 94 2.463 -11.709 -8.897 1.00 0.00 N ATOM 1473 CA LEU A 94 2.985 -11.012 -7.724 1.00 0.00 C ATOM 1474 C LEU A 94 2.314 -11.499 -6.444 1.00 0.00 C ATOM 1475 O LEU A 94 2.940 -12.160 -5.626 1.00 0.00 O ATOM 1476 CB LEU A 94 2.755 -9.495 -7.882 1.00 0.00 C ATOM 1477 CG LEU A 94 3.783 -8.704 -7.055 1.00 0.00 C ATOM 1478 CD1 LEU A 94 3.478 -7.203 -7.161 1.00 0.00 C ATOM 1479 CD2 LEU A 94 3.705 -9.132 -5.581 1.00 0.00 C ATOM 0 H LEU A 94 1.864 -11.139 -9.495 1.00 0.00 H new ATOM 0 HA LEU A 94 4.052 -11.223 -7.650 1.00 0.00 H new ATOM 0 HB2 LEU A 94 2.834 -9.217 -8.933 1.00 0.00 H new ATOM 0 HB3 LEU A 94 1.746 -9.239 -7.559 1.00 0.00 H new ATOM 0 HG LEU A 94 4.783 -8.906 -7.439 1.00 0.00 H new ATOM 0 HD11 LEU A 94 4.206 -6.642 -6.575 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.535 -6.893 -8.204 1.00 0.00 H new ATOM 0 HD13 LEU A 94 2.476 -7.007 -6.779 1.00 0.00 H new ATOM 0 HD21 LEU A 94 4.435 -8.569 -5.000 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.704 -8.934 -5.197 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.920 -10.197 -5.500 1.00 0.00 H new ATOM 1491 N VAL A 95 1.053 -11.144 -6.268 1.00 0.00 N ATOM 1492 CA VAL A 95 0.312 -11.525 -5.064 1.00 0.00 C ATOM 1493 C VAL A 95 0.682 -12.934 -4.581 1.00 0.00 C ATOM 1494 O VAL A 95 0.833 -13.164 -3.384 1.00 0.00 O ATOM 1495 CB VAL A 95 -1.183 -11.456 -5.341 1.00 0.00 C ATOM 1496 CG1 VAL A 95 -1.959 -11.748 -4.056 1.00 0.00 C ATOM 1497 CG2 VAL A 95 -1.540 -10.052 -5.841 1.00 0.00 C ATOM 0 H VAL A 95 0.516 -10.594 -6.938 1.00 0.00 H new ATOM 0 HA VAL A 95 0.581 -10.824 -4.274 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.446 -12.195 -6.098 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -3.029 -11.698 -4.258 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.704 -12.745 -3.695 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.698 -11.010 -3.298 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.610 -9.998 -6.041 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.275 -9.317 -5.081 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.989 -9.841 -6.757 1.00 0.00 H new ATOM 1507 N MET A 96 0.806 -13.870 -5.507 1.00 0.00 N ATOM 1508 CA MET A 96 1.136 -15.247 -5.141 1.00 0.00 C ATOM 1509 C MET A 96 2.640 -15.420 -4.892 1.00 0.00 C ATOM 1510 O MET A 96 3.062 -16.387 -4.260 1.00 0.00 O ATOM 1511 CB MET A 96 0.685 -16.193 -6.259 1.00 0.00 C ATOM 1512 CG MET A 96 0.953 -17.650 -5.854 1.00 0.00 C ATOM 1513 SD MET A 96 2.650 -18.098 -6.298 1.00 0.00 S ATOM 1514 CE MET A 96 2.889 -19.369 -5.033 1.00 0.00 C ATOM 0 H MET A 96 0.686 -13.710 -6.507 1.00 0.00 H new ATOM 0 HA MET A 96 0.614 -15.487 -4.214 1.00 0.00 H new ATOM 0 HB2 MET A 96 -0.377 -16.052 -6.460 1.00 0.00 H new ATOM 0 HB3 MET A 96 1.217 -15.959 -7.181 1.00 0.00 H new ATOM 0 HG2 MET A 96 0.802 -17.774 -4.782 1.00 0.00 H new ATOM 0 HG3 MET A 96 0.248 -18.313 -6.355 1.00 0.00 H new ATOM 0 HE1 MET A 96 3.891 -19.789 -5.124 1.00 0.00 H new ATOM 0 HE2 MET A 96 2.770 -18.925 -4.044 1.00 0.00 H new ATOM 0 HE3 MET A 96 2.151 -20.159 -5.167 1.00 0.00 H new ATOM 1524 N GLY A 97 3.443 -14.491 -5.411 1.00 0.00 N ATOM 1525 CA GLY A 97 4.910 -14.577 -5.255 1.00 0.00 C ATOM 1526 C GLY A 97 5.442 -13.581 -4.226 1.00 0.00 C ATOM 1527 O GLY A 97 6.651 -13.377 -4.127 1.00 0.00 O ATOM 0 H GLY A 97 3.117 -13.680 -5.936 1.00 0.00 H new ATOM 0 HA2 GLY A 97 5.183 -15.588 -4.953 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.387 -14.392 -6.217 1.00 0.00 H new ATOM 1531 N ILE A 98 4.549 -12.964 -3.465 1.00 0.00 N ATOM 1532 CA ILE A 98 4.974 -11.995 -2.460 1.00 0.00 C ATOM 1533 C ILE A 98 6.007 -12.604 -1.522 1.00 0.00 C ATOM 1534 O ILE A 98 7.209 -12.501 -1.765 1.00 0.00 O ATOM 1535 CB ILE A 98 3.773 -11.505 -1.658 1.00 0.00 C ATOM 1536 CG1 ILE A 98 2.804 -10.787 -2.599 1.00 0.00 C ATOM 1537 CG2 ILE A 98 4.248 -10.536 -0.577 1.00 0.00 C ATOM 1538 CD1 ILE A 98 1.486 -10.495 -1.872 1.00 0.00 C ATOM 0 H ILE A 98 3.541 -13.112 -3.521 1.00 0.00 H new ATOM 0 HA ILE A 98 5.429 -11.150 -2.976 1.00 0.00 H new ATOM 0 HB ILE A 98 3.270 -12.351 -1.189 1.00 0.00 H new ATOM 0 HG12 ILE A 98 3.249 -9.856 -2.951 1.00 0.00 H new ATOM 0 HG13 ILE A 98 2.615 -11.403 -3.479 1.00 0.00 H new ATOM 0 HG21 ILE A 98 3.391 -10.184 -0.002 1.00 0.00 H new ATOM 0 HG22 ILE A 98 4.946 -11.046 0.087 1.00 0.00 H new ATOM 0 HG23 ILE A 98 4.746 -9.686 -1.044 1.00 0.00 H new ATOM 0 HD11 ILE A 98 0.802 -9.984 -2.550 1.00 0.00 H new ATOM 0 HD12 ILE A 98 1.037 -11.432 -1.542 1.00 0.00 H new ATOM 0 HD13 ILE A 98 1.680 -9.861 -1.007 1.00 0.00 H new ATOM 1550 N HIS A 99 5.544 -13.243 -0.456 1.00 0.00 N ATOM 1551 CA HIS A 99 6.451 -13.860 0.502 1.00 0.00 C ATOM 1552 C HIS A 99 7.596 -14.565 -0.224 1.00 0.00 C ATOM 1553 O HIS A 99 8.767 -14.413 0.126 1.00 0.00 O ATOM 1554 CB HIS A 99 5.688 -14.880 1.356 1.00 0.00 C ATOM 1555 CG HIS A 99 4.743 -15.658 0.482 1.00 0.00 C ATOM 1556 ND1 HIS A 99 5.034 -16.938 0.035 1.00 0.00 N ATOM 1557 CD2 HIS A 99 3.508 -15.352 -0.035 1.00 0.00 C ATOM 1558 CE1 HIS A 99 3.995 -17.350 -0.717 1.00 0.00 C ATOM 1559 NE2 HIS A 99 3.038 -16.420 -0.791 1.00 0.00 N ATOM 0 H HIS A 99 4.554 -13.347 -0.234 1.00 0.00 H new ATOM 0 HA HIS A 99 6.863 -13.080 1.142 1.00 0.00 H new ATOM 0 HB2 HIS A 99 6.388 -15.557 1.846 1.00 0.00 H new ATOM 0 HB3 HIS A 99 5.135 -14.369 2.144 1.00 0.00 H new ATOM 0 HD1 HIS A 99 5.880 -17.470 0.238 1.00 0.00 H new ATOM 0 HD2 HIS A 99 2.981 -14.422 0.122 1.00 0.00 H new ATOM 0 HE1 HIS A 99 3.942 -18.314 -1.201 1.00 0.00 H new ATOM 1568 N ASP A 100 7.225 -15.345 -1.221 1.00 0.00 N ATOM 1569 CA ASP A 100 8.177 -16.113 -2.010 1.00 0.00 C ATOM 1570 C ASP A 100 9.482 -15.357 -2.309 1.00 0.00 C ATOM 1571 O ASP A 100 10.392 -15.327 -1.494 1.00 0.00 O ATOM 1572 CB ASP A 100 7.526 -16.520 -3.330 1.00 0.00 C ATOM 1573 CG ASP A 100 6.321 -17.415 -3.062 1.00 0.00 C ATOM 1574 OD1 ASP A 100 6.514 -18.613 -2.934 1.00 0.00 O ATOM 1575 OD2 ASP A 100 5.223 -16.889 -2.989 1.00 0.00 O ATOM 0 H ASP A 100 6.254 -15.466 -1.510 1.00 0.00 H new ATOM 0 HA ASP A 100 8.445 -16.984 -1.412 1.00 0.00 H new ATOM 0 HB2 ASP A 100 7.215 -15.632 -3.881 1.00 0.00 H new ATOM 0 HB3 ASP A 100 8.248 -17.046 -3.955 1.00 0.00 H new ATOM 1580 N VAL A 101 9.570 -14.818 -3.524 1.00 0.00 N ATOM 1581 CA VAL A 101 10.782 -14.135 -3.999 1.00 0.00 C ATOM 1582 C VAL A 101 10.999 -12.736 -3.402 1.00 0.00 C ATOM 1583 O VAL A 101 12.102 -12.407 -2.967 1.00 0.00 O ATOM 1584 CB VAL A 101 10.712 -14.024 -5.533 1.00 0.00 C ATOM 1585 CG1 VAL A 101 10.245 -15.363 -6.118 1.00 0.00 C ATOM 1586 CG2 VAL A 101 9.715 -12.928 -5.939 1.00 0.00 C ATOM 0 H VAL A 101 8.812 -14.839 -4.206 1.00 0.00 H new ATOM 0 HA VAL A 101 11.629 -14.737 -3.668 1.00 0.00 H new ATOM 0 HB VAL A 101 11.701 -13.772 -5.915 1.00 0.00 H new ATOM 0 HG11 VAL A 101 10.194 -15.288 -7.204 1.00 0.00 H new ATOM 0 HG12 VAL A 101 10.950 -16.147 -5.841 1.00 0.00 H new ATOM 0 HG13 VAL A 101 9.258 -15.607 -5.725 1.00 0.00 H new ATOM 0 HG21 VAL A 101 9.674 -12.858 -7.026 1.00 0.00 H new ATOM 0 HG22 VAL A 101 8.726 -13.175 -5.553 1.00 0.00 H new ATOM 0 HG23 VAL A 101 10.037 -11.972 -5.526 1.00 0.00 H new ATOM 1596 N ILE A 102 9.977 -11.914 -3.441 1.00 0.00 N ATOM 1597 CA ILE A 102 10.089 -10.540 -2.963 1.00 0.00 C ATOM 1598 C ILE A 102 10.632 -10.441 -1.527 1.00 0.00 C ATOM 1599 O ILE A 102 11.585 -9.701 -1.279 1.00 0.00 O ATOM 1600 CB ILE A 102 8.714 -9.858 -3.069 1.00 0.00 C ATOM 1601 CG1 ILE A 102 8.406 -9.519 -4.572 1.00 0.00 C ATOM 1602 CG2 ILE A 102 8.705 -8.565 -2.232 1.00 0.00 C ATOM 1603 CD1 ILE A 102 7.062 -10.128 -4.984 1.00 0.00 C ATOM 0 H ILE A 102 9.055 -12.165 -3.797 1.00 0.00 H new ATOM 0 HA ILE A 102 10.816 -10.029 -3.595 1.00 0.00 H new ATOM 0 HB ILE A 102 7.949 -10.535 -2.688 1.00 0.00 H new ATOM 0 HG12 ILE A 102 8.383 -8.438 -4.712 1.00 0.00 H new ATOM 0 HG13 ILE A 102 9.200 -9.906 -5.210 1.00 0.00 H new ATOM 0 HG21 ILE A 102 7.729 -8.087 -2.311 1.00 0.00 H new ATOM 0 HG22 ILE A 102 8.907 -8.806 -1.188 1.00 0.00 H new ATOM 0 HG23 ILE A 102 9.473 -7.886 -2.603 1.00 0.00 H new ATOM 0 HD11 ILE A 102 6.858 -9.887 -6.027 1.00 0.00 H new ATOM 0 HD12 ILE A 102 7.100 -11.210 -4.862 1.00 0.00 H new ATOM 0 HD13 ILE A 102 6.270 -9.720 -4.356 1.00 0.00 H new ATOM 1615 N HIS A 103 10.019 -11.141 -0.581 1.00 0.00 N ATOM 1616 CA HIS A 103 10.469 -11.052 0.813 1.00 0.00 C ATOM 1617 C HIS A 103 11.656 -11.977 1.096 1.00 0.00 C ATOM 1618 O HIS A 103 12.277 -11.883 2.156 1.00 0.00 O ATOM 1619 CB HIS A 103 9.307 -11.381 1.757 1.00 0.00 C ATOM 1620 CG HIS A 103 8.417 -10.166 1.902 1.00 0.00 C ATOM 1621 ND1 HIS A 103 7.040 -10.237 1.777 1.00 0.00 N ATOM 1622 CD2 HIS A 103 8.704 -8.844 2.145 1.00 0.00 C ATOM 1623 CE1 HIS A 103 6.553 -8.989 1.943 1.00 0.00 C ATOM 1624 NE2 HIS A 103 7.528 -8.099 2.169 1.00 0.00 N ATOM 0 H HIS A 103 9.227 -11.764 -0.741 1.00 0.00 H new ATOM 0 HA HIS A 103 10.806 -10.030 0.986 1.00 0.00 H new ATOM 0 HB2 HIS A 103 8.733 -12.221 1.366 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.690 -11.683 2.732 1.00 0.00 H new ATOM 0 HD2 HIS A 103 9.695 -8.442 2.295 1.00 0.00 H new ATOM 0 HE1 HIS A 103 5.503 -8.738 1.899 1.00 0.00 H new ATOM 0 HE2 HIS A 103 7.430 -7.096 2.325 1.00 0.00 H new ATOM 1632 N LEU A 104 11.979 -12.860 0.158 1.00 0.00 N ATOM 1633 CA LEU A 104 13.107 -13.773 0.354 1.00 0.00 C ATOM 1634 C LEU A 104 14.423 -13.071 0.020 1.00 0.00 C ATOM 1635 O LEU A 104 15.448 -13.314 0.659 1.00 0.00 O ATOM 1636 CB LEU A 104 12.933 -15.032 -0.523 1.00 0.00 C ATOM 1637 CG LEU A 104 14.263 -15.843 -0.585 1.00 0.00 C ATOM 1638 CD1 LEU A 104 13.955 -17.349 -0.568 1.00 0.00 C ATOM 1639 CD2 LEU A 104 15.030 -15.502 -1.881 1.00 0.00 C ATOM 0 H LEU A 104 11.489 -12.966 -0.730 1.00 0.00 H new ATOM 0 HA LEU A 104 13.132 -14.077 1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 104 12.138 -15.657 -0.118 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.630 -14.742 -1.529 1.00 0.00 H new ATOM 0 HG LEU A 104 14.873 -15.581 0.279 1.00 0.00 H new ATOM 0 HD11 LEU A 104 14.888 -17.912 -0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 104 13.422 -17.601 0.349 1.00 0.00 H new ATOM 0 HD13 LEU A 104 13.337 -17.604 -1.429 1.00 0.00 H new ATOM 0 HD21 LEU A 104 15.958 -16.073 -1.916 1.00 0.00 H new ATOM 0 HD22 LEU A 104 14.415 -15.755 -2.745 1.00 0.00 H new ATOM 0 HD23 LEU A 104 15.259 -14.436 -1.899 1.00 0.00 H new ATOM 1651 N GLU A 105 14.388 -12.202 -0.985 1.00 0.00 N ATOM 1652 CA GLU A 105 15.588 -11.479 -1.393 1.00 0.00 C ATOM 1653 C GLU A 105 15.918 -10.369 -0.398 1.00 0.00 C ATOM 1654 O GLU A 105 16.997 -10.359 0.192 1.00 0.00 O ATOM 1655 CB GLU A 105 15.390 -10.884 -2.791 1.00 0.00 C ATOM 1656 CG GLU A 105 16.719 -10.330 -3.312 1.00 0.00 C ATOM 1657 CD GLU A 105 17.684 -11.475 -3.597 1.00 0.00 C ATOM 1658 OE1 GLU A 105 17.214 -12.578 -3.827 1.00 0.00 O ATOM 1659 OE2 GLU A 105 18.880 -11.234 -3.581 1.00 0.00 O ATOM 0 H GLU A 105 13.552 -11.983 -1.527 1.00 0.00 H new ATOM 0 HA GLU A 105 16.421 -12.181 -1.414 1.00 0.00 H new ATOM 0 HB2 GLU A 105 15.012 -11.648 -3.471 1.00 0.00 H new ATOM 0 HB3 GLU A 105 14.643 -10.091 -2.756 1.00 0.00 H new ATOM 0 HG2 GLU A 105 16.550 -9.751 -4.220 1.00 0.00 H new ATOM 0 HG3 GLU A 105 17.153 -9.652 -2.577 1.00 0.00 H new ATOM 1666 N VAL A 106 14.988 -9.438 -0.214 1.00 0.00 N ATOM 1667 CA VAL A 106 15.207 -8.330 0.715 1.00 0.00 C ATOM 1668 C VAL A 106 15.823 -8.840 2.016 1.00 0.00 C ATOM 1669 O VAL A 106 16.664 -8.175 2.622 1.00 0.00 O ATOM 1670 CB VAL A 106 13.882 -7.626 1.031 1.00 0.00 C ATOM 1671 CG1 VAL A 106 13.179 -7.218 -0.270 1.00 0.00 C ATOM 1672 CG2 VAL A 106 12.980 -8.575 1.825 1.00 0.00 C ATOM 0 H VAL A 106 14.085 -9.425 -0.688 1.00 0.00 H new ATOM 0 HA VAL A 106 15.889 -7.623 0.243 1.00 0.00 H new ATOM 0 HB VAL A 106 14.084 -6.732 1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 106 12.239 -6.719 -0.035 1.00 0.00 H new ATOM 0 HG12 VAL A 106 13.820 -6.539 -0.832 1.00 0.00 H new ATOM 0 HG13 VAL A 106 12.978 -8.106 -0.869 1.00 0.00 H new ATOM 0 HG21 VAL A 106 12.037 -8.077 2.051 1.00 0.00 H new ATOM 0 HG22 VAL A 106 12.785 -9.470 1.235 1.00 0.00 H new ATOM 0 HG23 VAL A 106 13.475 -8.854 2.755 1.00 0.00 H new ATOM 1682 N ASN A 107 15.389 -10.022 2.440 1.00 0.00 N ATOM 1683 CA ASN A 107 15.894 -10.615 3.671 1.00 0.00 C ATOM 1684 C ASN A 107 17.414 -10.734 3.633 1.00 0.00 C ATOM 1685 O ASN A 107 18.096 -10.383 4.595 1.00 0.00 O ATOM 1686 CB ASN A 107 15.279 -12.002 3.870 1.00 0.00 C ATOM 1687 CG ASN A 107 15.493 -12.466 5.307 1.00 0.00 C ATOM 1688 OD1 ASN A 107 14.935 -11.885 6.237 1.00 0.00 O ATOM 1689 ND2 ASN A 107 16.271 -13.486 5.544 1.00 0.00 N ATOM 0 H ASN A 107 14.692 -10.585 1.952 1.00 0.00 H new ATOM 0 HA ASN A 107 15.615 -9.967 4.502 1.00 0.00 H new ATOM 0 HB2 ASN A 107 14.213 -11.972 3.644 1.00 0.00 H new ATOM 0 HB3 ASN A 107 15.732 -12.712 3.178 1.00 0.00 H new ATOM 0 HD21 ASN A 107 16.418 -13.804 6.502 1.00 0.00 H new ATOM 0 HD22 ASN A 107 16.732 -13.966 4.771 1.00 0.00 H new ATOM 1696 N LYS A 108 17.942 -11.230 2.518 1.00 0.00 N ATOM 1697 CA LYS A 108 19.382 -11.388 2.378 1.00 0.00 C ATOM 1698 C LYS A 108 20.068 -10.029 2.365 1.00 0.00 C ATOM 1699 O LYS A 108 21.240 -9.910 2.721 1.00 0.00 O ATOM 1700 CB LYS A 108 19.702 -12.139 1.086 1.00 0.00 C ATOM 1701 CG LYS A 108 18.755 -13.333 0.945 1.00 0.00 C ATOM 1702 CD LYS A 108 19.290 -14.287 -0.122 1.00 0.00 C ATOM 1703 CE LYS A 108 19.484 -13.533 -1.440 1.00 0.00 C ATOM 1704 NZ LYS A 108 19.586 -14.509 -2.561 1.00 0.00 N ATOM 0 H LYS A 108 17.399 -11.526 1.707 1.00 0.00 H new ATOM 0 HA LYS A 108 19.752 -11.960 3.229 1.00 0.00 H new ATOM 0 HB2 LYS A 108 19.596 -11.473 0.229 1.00 0.00 H new ATOM 0 HB3 LYS A 108 20.737 -12.481 1.098 1.00 0.00 H new ATOM 0 HG2 LYS A 108 18.664 -13.852 1.899 1.00 0.00 H new ATOM 0 HG3 LYS A 108 17.757 -12.989 0.672 1.00 0.00 H new ATOM 0 HD2 LYS A 108 20.237 -14.718 0.204 1.00 0.00 H new ATOM 0 HD3 LYS A 108 18.595 -15.115 -0.265 1.00 0.00 H new ATOM 0 HE2 LYS A 108 18.648 -12.855 -1.610 1.00 0.00 H new ATOM 0 HE3 LYS A 108 20.386 -12.922 -1.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 19.718 -13.997 -3.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 20.398 -15.139 -2.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 18.714 -15.073 -2.610 1.00 0.00 H new ATOM 1835 N PRO A 116 7.455 -9.959 8.234 1.00 0.00 N ATOM 1836 CA PRO A 116 6.002 -10.181 8.520 1.00 0.00 C ATOM 1837 C PRO A 116 5.471 -11.457 7.857 1.00 0.00 C ATOM 1838 O PRO A 116 6.068 -11.971 6.911 1.00 0.00 O ATOM 1839 CB PRO A 116 5.304 -8.919 7.946 1.00 0.00 C ATOM 1840 CG PRO A 116 6.342 -8.221 7.114 1.00 0.00 C ATOM 1841 CD PRO A 116 7.695 -8.613 7.693 1.00 0.00 C ATOM 0 HA PRO A 116 5.815 -10.319 9.585 1.00 0.00 H new ATOM 0 HB2 PRO A 116 4.438 -9.191 7.343 1.00 0.00 H new ATOM 0 HB3 PRO A 116 4.945 -8.272 8.747 1.00 0.00 H new ATOM 0 HG2 PRO A 116 6.266 -8.520 6.068 1.00 0.00 H new ATOM 0 HG3 PRO A 116 6.204 -7.140 7.148 1.00 0.00 H new ATOM 0 HD2 PRO A 116 8.473 -8.619 6.929 1.00 0.00 H new ATOM 0 HD3 PRO A 116 8.016 -7.919 8.470 1.00 0.00 H new ATOM 1849 N HIS A 117 4.345 -11.959 8.365 1.00 0.00 N ATOM 1850 CA HIS A 117 3.737 -13.173 7.817 1.00 0.00 C ATOM 1851 C HIS A 117 2.712 -12.820 6.743 1.00 0.00 C ATOM 1852 O HIS A 117 1.787 -12.043 6.985 1.00 0.00 O ATOM 1853 CB HIS A 117 3.053 -13.963 8.934 1.00 0.00 C ATOM 1854 CG HIS A 117 2.700 -15.338 8.436 1.00 0.00 C ATOM 1855 ND1 HIS A 117 1.445 -15.641 7.929 1.00 0.00 N ATOM 1856 CD2 HIS A 117 3.426 -16.500 8.361 1.00 0.00 C ATOM 1857 CE1 HIS A 117 1.455 -16.940 7.575 1.00 0.00 C ATOM 1858 NE2 HIS A 117 2.639 -17.510 7.819 1.00 0.00 N ATOM 0 H HIS A 117 3.838 -11.548 9.149 1.00 0.00 H new ATOM 0 HA HIS A 117 4.523 -13.781 7.369 1.00 0.00 H new ATOM 0 HB2 HIS A 117 3.713 -14.037 9.798 1.00 0.00 H new ATOM 0 HB3 HIS A 117 2.154 -13.442 9.263 1.00 0.00 H new ATOM 0 HD2 HIS A 117 4.453 -16.613 8.675 1.00 0.00 H new ATOM 0 HE1 HIS A 117 0.610 -17.458 7.146 1.00 0.00 H new ATOM 0 HE2 HIS A 117 2.908 -18.478 7.645 1.00 0.00 H new ATOM 1867 N ILE A 118 2.884 -13.394 5.558 1.00 0.00 N ATOM 1868 CA ILE A 118 1.969 -13.137 4.447 1.00 0.00 C ATOM 1869 C ILE A 118 1.955 -14.330 3.492 1.00 0.00 C ATOM 1870 O ILE A 118 3.006 -14.788 3.045 1.00 0.00 O ATOM 1871 CB ILE A 118 2.408 -11.869 3.701 1.00 0.00 C ATOM 1872 CG1 ILE A 118 1.320 -11.451 2.704 1.00 0.00 C ATOM 1873 CG2 ILE A 118 3.712 -12.135 2.947 1.00 0.00 C ATOM 1874 CD1 ILE A 118 1.580 -10.014 2.241 1.00 0.00 C ATOM 0 H ILE A 118 3.644 -14.038 5.340 1.00 0.00 H new ATOM 0 HA ILE A 118 0.962 -12.991 4.838 1.00 0.00 H new ATOM 0 HB ILE A 118 2.565 -11.069 4.424 1.00 0.00 H new ATOM 0 HG12 ILE A 118 1.317 -12.126 1.848 1.00 0.00 H new ATOM 0 HG13 ILE A 118 0.337 -11.523 3.170 1.00 0.00 H new ATOM 0 HG21 ILE A 118 4.018 -11.232 2.420 1.00 0.00 H new ATOM 0 HG22 ILE A 118 4.489 -12.423 3.655 1.00 0.00 H new ATOM 0 HG23 ILE A 118 3.559 -12.940 2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 118 0.808 -9.715 1.532 1.00 0.00 H new ATOM 0 HD12 ILE A 118 1.561 -9.345 3.102 1.00 0.00 H new ATOM 0 HD13 ILE A 118 2.556 -9.958 1.759 1.00 0.00 H new ATOM 1886 N ASN A 119 0.756 -14.839 3.190 1.00 0.00 N ATOM 1887 CA ASN A 119 0.624 -15.996 2.293 1.00 0.00 C ATOM 1888 C ASN A 119 -0.471 -15.767 1.256 1.00 0.00 C ATOM 1889 O ASN A 119 -1.638 -15.606 1.599 1.00 0.00 O ATOM 1890 CB ASN A 119 0.293 -17.247 3.109 1.00 0.00 C ATOM 1891 CG ASN A 119 0.140 -18.447 2.181 1.00 0.00 C ATOM 1892 OD1 ASN A 119 -0.934 -19.042 2.107 1.00 0.00 O ATOM 1893 ND2 ASN A 119 1.157 -18.838 1.463 1.00 0.00 N ATOM 0 H ASN A 119 -0.127 -14.475 3.547 1.00 0.00 H new ATOM 0 HA ASN A 119 1.572 -16.130 1.772 1.00 0.00 H new ATOM 0 HB2 ASN A 119 1.083 -17.437 3.836 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -0.628 -17.092 3.672 1.00 0.00 H new ATOM 0 HD21 ASN A 119 1.062 -19.639 0.838 1.00 0.00 H new ATOM 0 HD22 ASN A 119 2.046 -18.343 1.526 1.00 0.00 H new ATOM 1900 N GLY A 120 -0.084 -15.766 -0.016 1.00 0.00 N ATOM 1901 CA GLY A 120 -1.032 -15.567 -1.106 1.00 0.00 C ATOM 1902 C GLY A 120 -1.459 -16.903 -1.696 1.00 0.00 C ATOM 1903 O GLY A 120 -0.623 -17.745 -2.024 1.00 0.00 O ATOM 0 H GLY A 120 0.881 -15.901 -0.317 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -1.907 -15.029 -0.741 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -0.578 -14.949 -1.881 1.00 0.00 H new ATOM 1907 N GLN A 121 -2.766 -17.087 -1.834 1.00 0.00 N ATOM 1908 CA GLN A 121 -3.316 -18.326 -2.394 1.00 0.00 C ATOM 1909 C GLN A 121 -4.249 -17.997 -3.552 1.00 0.00 C ATOM 1910 O GLN A 121 -5.026 -17.056 -3.472 1.00 0.00 O ATOM 1911 CB GLN A 121 -4.078 -19.080 -1.307 1.00 0.00 C ATOM 1912 CG GLN A 121 -4.636 -20.383 -1.879 1.00 0.00 C ATOM 1913 CD GLN A 121 -5.068 -21.307 -0.746 1.00 0.00 C ATOM 1914 OE1 GLN A 121 -6.042 -21.023 -0.048 1.00 0.00 O ATOM 1915 NE2 GLN A 121 -4.396 -22.403 -0.520 1.00 0.00 N ATOM 0 H GLN A 121 -3.469 -16.397 -1.567 1.00 0.00 H new ATOM 0 HA GLN A 121 -2.503 -18.952 -2.762 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -3.417 -19.294 -0.467 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -4.890 -18.462 -0.924 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -5.484 -20.170 -2.529 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -3.880 -20.874 -2.492 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -3.590 -22.636 -1.100 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -4.677 -23.027 0.236 1.00 0.00 H new ATOM 1924 N LEU A 122 -4.161 -18.757 -4.644 1.00 0.00 N ATOM 1925 CA LEU A 122 -5.005 -18.494 -5.810 1.00 0.00 C ATOM 1926 C LEU A 122 -6.366 -19.188 -5.682 1.00 0.00 C ATOM 1927 O LEU A 122 -6.450 -20.372 -5.354 1.00 0.00 O ATOM 1928 CB LEU A 122 -4.279 -18.981 -7.096 1.00 0.00 C ATOM 1929 CG LEU A 122 -3.808 -17.782 -7.940 1.00 0.00 C ATOM 1930 CD1 LEU A 122 -2.707 -17.019 -7.196 1.00 0.00 C ATOM 1931 CD2 LEU A 122 -3.257 -18.293 -9.272 1.00 0.00 C ATOM 0 H LEU A 122 -3.525 -19.548 -4.746 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.182 -17.420 -5.871 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.424 -19.600 -6.825 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.951 -19.606 -7.685 1.00 0.00 H new ATOM 0 HG LEU A 122 -4.650 -17.113 -8.117 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.379 -16.173 -7.800 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.095 -16.657 -6.244 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -1.862 -17.684 -7.015 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.922 -17.449 -9.875 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.417 -18.962 -9.086 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.039 -18.832 -9.806 1.00 0.00 H new ATOM 1943 N LEU A 123 -7.421 -18.431 -5.969 1.00 0.00 N ATOM 1944 CA LEU A 123 -8.796 -18.947 -5.921 1.00 0.00 C ATOM 1945 C LEU A 123 -9.393 -18.903 -7.336 1.00 0.00 C ATOM 1946 O LEU A 123 -8.708 -18.518 -8.285 1.00 0.00 O ATOM 1947 CB LEU A 123 -9.669 -18.093 -4.951 1.00 0.00 C ATOM 1948 CG LEU A 123 -8.780 -17.292 -3.992 1.00 0.00 C ATOM 1949 CD1 LEU A 123 -9.627 -16.240 -3.243 1.00 0.00 C ATOM 1950 CD2 LEU A 123 -8.122 -18.250 -2.981 1.00 0.00 C ATOM 0 H LEU A 123 -7.354 -17.450 -6.240 1.00 0.00 H new ATOM 0 HA LEU A 123 -8.782 -19.973 -5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -10.301 -17.414 -5.523 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -10.334 -18.743 -4.382 1.00 0.00 H new ATOM 0 HG LEU A 123 -8.005 -16.780 -4.562 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.988 -15.675 -2.564 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -10.082 -15.560 -3.963 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -10.409 -16.741 -2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -7.490 -17.681 -2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.895 -18.767 -2.413 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -7.514 -18.981 -3.515 1.00 0.00 H new ATOM 1962 N PRO A 124 -10.637 -19.280 -7.499 1.00 0.00 N ATOM 1963 CA PRO A 124 -11.300 -19.269 -8.821 1.00 0.00 C ATOM 1964 C PRO A 124 -11.990 -17.930 -9.121 1.00 0.00 C ATOM 1965 O PRO A 124 -12.131 -17.077 -8.244 1.00 0.00 O ATOM 1966 CB PRO A 124 -12.318 -20.411 -8.705 1.00 0.00 C ATOM 1967 CG PRO A 124 -12.653 -20.511 -7.231 1.00 0.00 C ATOM 1968 CD PRO A 124 -11.548 -19.758 -6.453 1.00 0.00 C ATOM 0 HA PRO A 124 -10.595 -19.396 -9.642 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -13.210 -20.203 -9.296 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -11.901 -21.347 -9.076 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.631 -20.073 -7.029 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -12.700 -21.554 -6.918 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -11.960 -18.931 -5.875 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -11.037 -20.415 -5.749 1.00 0.00 H new ATOM 1976 N ASN A 125 -12.415 -17.769 -10.370 1.00 0.00 N ATOM 1977 CA ASN A 125 -13.097 -16.549 -10.808 1.00 0.00 C ATOM 1978 C ASN A 125 -12.152 -15.343 -10.785 1.00 0.00 C ATOM 1979 O ASN A 125 -12.594 -14.200 -10.674 1.00 0.00 O ATOM 1980 CB ASN A 125 -14.310 -16.271 -9.916 1.00 0.00 C ATOM 1981 CG ASN A 125 -15.261 -15.303 -10.613 1.00 0.00 C ATOM 1982 OD1 ASN A 125 -14.885 -14.659 -11.592 1.00 0.00 O ATOM 1983 ND2 ASN A 125 -16.478 -15.163 -10.165 1.00 0.00 N ATOM 0 H ASN A 125 -12.300 -18.470 -11.102 1.00 0.00 H new ATOM 0 HA ASN A 125 -13.429 -16.704 -11.834 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -14.828 -17.204 -9.691 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -13.983 -15.851 -8.965 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -17.120 -14.519 -10.626 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -16.787 -15.698 -9.353 1.00 0.00 H new ATOM 1990 N ASN A 126 -10.856 -15.608 -10.900 1.00 0.00 N ATOM 1991 CA ASN A 126 -9.858 -14.541 -10.903 1.00 0.00 C ATOM 1992 C ASN A 126 -9.803 -13.824 -9.549 1.00 0.00 C ATOM 1993 O ASN A 126 -9.801 -12.595 -9.488 1.00 0.00 O ATOM 1994 CB ASN A 126 -10.173 -13.527 -12.012 1.00 0.00 C ATOM 1995 CG ASN A 126 -10.739 -14.244 -13.233 1.00 0.00 C ATOM 1996 OD1 ASN A 126 -10.528 -15.445 -13.402 1.00 0.00 O ATOM 1997 ND2 ASN A 126 -11.450 -13.574 -14.102 1.00 0.00 N ATOM 0 H ASN A 126 -10.471 -16.548 -10.992 1.00 0.00 H new ATOM 0 HA ASN A 126 -8.885 -14.995 -11.089 1.00 0.00 H new ATOM 0 HB2 ASN A 126 -10.889 -12.790 -11.649 1.00 0.00 H new ATOM 0 HB3 ASN A 126 -9.269 -12.984 -12.286 1.00 0.00 H new ATOM 0 HD21 ASN A 126 -11.831 -14.046 -14.922 1.00 0.00 H new ATOM 0 HD22 ASN A 126 -11.624 -12.579 -13.960 1.00 0.00 H new ATOM 2004 N GLN A 127 -9.741 -14.603 -8.467 1.00 0.00 N ATOM 2005 CA GLN A 127 -9.665 -14.038 -7.112 1.00 0.00 C ATOM 2006 C GLN A 127 -8.446 -14.599 -6.390 1.00 0.00 C ATOM 2007 O GLN A 127 -8.038 -15.728 -6.640 1.00 0.00 O ATOM 2008 CB GLN A 127 -10.938 -14.376 -6.333 1.00 0.00 C ATOM 2009 CG GLN A 127 -12.134 -13.687 -6.989 1.00 0.00 C ATOM 2010 CD GLN A 127 -13.367 -13.823 -6.103 1.00 0.00 C ATOM 2011 OE1 GLN A 127 -13.269 -14.438 -4.956 1.00 0.00 O flip ATOM 2012 NE2 GLN A 127 -14.447 -13.357 -6.464 1.00 0.00 N flip ATOM 0 H GLN A 127 -9.742 -15.623 -8.499 1.00 0.00 H new ATOM 0 HA GLN A 127 -9.572 -12.954 -7.180 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -11.091 -15.455 -6.315 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -10.841 -14.051 -5.297 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -11.910 -12.633 -7.155 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -12.328 -14.130 -7.966 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -14.521 -12.877 -7.361 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -15.268 -13.451 -5.866 1.00 0.00 H new ATOM 2021 N ILE A 128 -7.859 -13.797 -5.503 1.00 0.00 N ATOM 2022 CA ILE A 128 -6.669 -14.225 -4.758 1.00 0.00 C ATOM 2023 C ILE A 128 -6.848 -13.971 -3.265 1.00 0.00 C ATOM 2024 O ILE A 128 -7.142 -12.856 -2.848 1.00 0.00 O ATOM 2025 CB ILE A 128 -5.435 -13.475 -5.268 1.00 0.00 C ATOM 2026 CG1 ILE A 128 -5.325 -13.668 -6.790 1.00 0.00 C ATOM 2027 CG2 ILE A 128 -4.175 -14.030 -4.584 1.00 0.00 C ATOM 2028 CD1 ILE A 128 -4.207 -12.783 -7.348 1.00 0.00 C ATOM 0 H ILE A 128 -8.182 -12.855 -5.282 1.00 0.00 H new ATOM 0 HA ILE A 128 -6.531 -15.295 -4.914 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.528 -12.414 -5.038 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -5.121 -14.714 -7.019 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -6.272 -13.416 -7.267 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -3.298 -13.495 -4.948 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -4.259 -13.898 -3.505 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -4.074 -15.091 -4.813 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -4.135 -12.925 -8.426 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -4.429 -11.738 -7.134 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -3.260 -13.056 -6.882 1.00 0.00 H new ATOM 2040 N ALA A 129 -6.655 -15.016 -2.463 1.00 0.00 N ATOM 2041 CA ALA A 129 -6.785 -14.897 -1.012 1.00 0.00 C ATOM 2042 C ALA A 129 -5.424 -14.639 -0.390 1.00 0.00 C ATOM 2043 O ALA A 129 -4.539 -15.493 -0.425 1.00 0.00 O ATOM 2044 CB ALA A 129 -7.373 -16.183 -0.432 1.00 0.00 C ATOM 0 H ALA A 129 -6.409 -15.950 -2.791 1.00 0.00 H new ATOM 0 HA ALA A 129 -7.450 -14.063 -0.787 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -7.466 -16.085 0.650 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.357 -16.361 -0.866 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -6.716 -17.021 -0.665 1.00 0.00 H new ATOM 2050 N LEU A 130 -5.261 -13.452 0.163 1.00 0.00 N ATOM 2051 CA LEU A 130 -4.010 -13.058 0.781 1.00 0.00 C ATOM 2052 C LEU A 130 -4.153 -12.993 2.296 1.00 0.00 C ATOM 2053 O LEU A 130 -4.776 -12.078 2.835 1.00 0.00 O ATOM 2054 CB LEU A 130 -3.621 -11.692 0.244 1.00 0.00 C ATOM 2055 CG LEU A 130 -2.235 -11.261 0.792 1.00 0.00 C ATOM 2056 CD1 LEU A 130 -1.155 -11.487 -0.275 1.00 0.00 C ATOM 2057 CD2 LEU A 130 -2.285 -9.779 1.155 1.00 0.00 C ATOM 0 H LEU A 130 -5.988 -12.737 0.196 1.00 0.00 H new ATOM 0 HA LEU A 130 -3.241 -13.794 0.545 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -3.595 -11.718 -0.845 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -4.374 -10.957 0.527 1.00 0.00 H new ATOM 0 HG LEU A 130 -1.993 -11.855 1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -0.185 -11.182 0.118 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -1.122 -12.543 -0.541 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -1.389 -10.897 -1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -1.315 -9.466 1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -2.528 -9.195 0.267 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -3.048 -9.616 1.916 1.00 0.00 H new ATOM 2069 N ARG A 131 -3.559 -13.963 2.979 1.00 0.00 N ATOM 2070 CA ARG A 131 -3.608 -14.008 4.438 1.00 0.00 C ATOM 2071 C ARG A 131 -2.422 -13.243 5.021 1.00 0.00 C ATOM 2072 O ARG A 131 -1.330 -13.250 4.454 1.00 0.00 O ATOM 2073 CB ARG A 131 -3.567 -15.460 4.912 1.00 0.00 C ATOM 2074 CG ARG A 131 -3.856 -15.522 6.411 1.00 0.00 C ATOM 2075 CD ARG A 131 -3.516 -16.915 6.938 1.00 0.00 C ATOM 2076 NE ARG A 131 -4.453 -17.899 6.408 1.00 0.00 N ATOM 2077 CZ ARG A 131 -5.704 -17.965 6.850 1.00 0.00 C ATOM 2078 NH1 ARG A 131 -6.113 -17.140 7.775 1.00 0.00 N ATOM 2079 NH2 ARG A 131 -6.523 -18.856 6.362 1.00 0.00 N ATOM 0 H ARG A 131 -3.039 -14.728 2.549 1.00 0.00 H new ATOM 0 HA ARG A 131 -4.534 -13.545 4.778 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -4.302 -16.052 4.366 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -2.589 -15.893 4.702 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -3.269 -14.769 6.937 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -4.906 -15.296 6.599 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -2.498 -17.181 6.652 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -3.552 -16.918 8.027 1.00 0.00 H new ATOM 0 HE ARG A 131 -4.142 -18.548 5.685 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -5.472 -16.445 8.158 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -7.073 -17.190 8.115 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -6.203 -19.502 5.641 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -7.483 -18.906 6.702 1.00 0.00 H new ATOM 2093 N TYR A 132 -2.641 -12.579 6.157 1.00 0.00 N ATOM 2094 CA TYR A 132 -1.576 -11.808 6.806 1.00 0.00 C ATOM 2095 C TYR A 132 -1.660 -11.946 8.323 1.00 0.00 C ATOM 2096 O TYR A 132 -2.713 -12.268 8.867 1.00 0.00 O ATOM 2097 CB TYR A 132 -1.696 -10.332 6.421 1.00 0.00 C ATOM 2098 CG TYR A 132 -0.553 -9.556 7.029 1.00 0.00 C ATOM 2099 CD1 TYR A 132 -0.645 -9.096 8.349 1.00 0.00 C ATOM 2100 CD2 TYR A 132 0.596 -9.297 6.276 1.00 0.00 C ATOM 2101 CE1 TYR A 132 0.415 -8.376 8.913 1.00 0.00 C ATOM 2102 CE2 TYR A 132 1.655 -8.577 6.840 1.00 0.00 C ATOM 2103 CZ TYR A 132 1.565 -8.117 8.158 1.00 0.00 C ATOM 2104 OH TYR A 132 2.610 -7.407 8.715 1.00 0.00 O ATOM 0 H TYR A 132 -3.537 -12.558 6.644 1.00 0.00 H new ATOM 0 HA TYR A 132 -0.615 -12.197 6.470 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.684 -10.227 5.336 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -2.648 -9.931 6.770 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -1.532 -9.297 8.931 1.00 0.00 H new ATOM 0 HD2 TYR A 132 0.666 -9.653 5.259 1.00 0.00 H new ATOM 0 HE1 TYR A 132 0.345 -8.020 9.930 1.00 0.00 H new ATOM 0 HE2 TYR A 132 2.542 -8.376 6.258 1.00 0.00 H new ATOM 0 HH TYR A 132 2.384 -7.162 9.637 1.00 0.00 H new ATOM 2114 N SER A 133 -0.543 -11.696 9.002 1.00 0.00 N ATOM 2115 CA SER A 133 -0.511 -11.793 10.453 1.00 0.00 C ATOM 2116 C SER A 133 0.802 -11.240 11.001 1.00 0.00 C ATOM 2117 O SER A 133 1.863 -11.442 10.413 1.00 0.00 O ATOM 2118 CB SER A 133 -0.669 -13.251 10.877 1.00 0.00 C ATOM 2119 OG SER A 133 0.614 -13.857 10.971 1.00 0.00 O ATOM 0 H SER A 133 0.342 -11.427 8.573 1.00 0.00 H new ATOM 0 HA SER A 133 -1.334 -11.204 10.857 1.00 0.00 H new ATOM 0 HB2 SER A 133 -1.182 -13.309 11.837 1.00 0.00 H new ATOM 0 HB3 SER A 133 -1.284 -13.787 10.154 1.00 0.00 H new ATOM 0 HG SER A 133 0.515 -14.793 11.245 1.00 0.00 H new ATOM 2125 N SER A 134 0.723 -10.546 12.136 1.00 0.00 N ATOM 2126 CA SER A 134 1.913 -9.971 12.764 1.00 0.00 C ATOM 2127 C SER A 134 1.506 -8.873 13.772 1.00 0.00 C ATOM 2128 O SER A 134 0.697 -8.007 13.445 1.00 0.00 O ATOM 2129 CB SER A 134 2.835 -9.367 11.688 1.00 0.00 C ATOM 2130 OG SER A 134 3.767 -10.355 11.259 1.00 0.00 O ATOM 0 H SER A 134 -0.147 -10.369 12.637 1.00 0.00 H new ATOM 0 HA SER A 134 2.445 -10.761 13.293 1.00 0.00 H new ATOM 0 HB2 SER A 134 2.244 -9.016 10.842 1.00 0.00 H new ATOM 0 HB3 SER A 134 3.363 -8.502 12.089 1.00 0.00 H new ATOM 0 HG SER A 134 3.290 -11.186 11.050 1.00 0.00 H new ATOM 2217 N CYS A 139 -1.244 -4.172 8.624 1.00 0.00 N ATOM 2218 CA CYS A 139 -1.806 -4.713 7.391 1.00 0.00 C ATOM 2219 C CYS A 139 -2.322 -3.594 6.487 1.00 0.00 C ATOM 2220 O CYS A 139 -2.256 -3.697 5.263 1.00 0.00 O ATOM 2221 CB CYS A 139 -2.951 -5.672 7.719 1.00 0.00 C ATOM 2222 SG CYS A 139 -2.451 -6.769 9.069 1.00 0.00 S ATOM 0 HA CYS A 139 -1.016 -5.249 6.864 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -3.840 -5.110 8.003 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -3.213 -6.258 6.838 1.00 0.00 H new ATOM 0 HG CYS A 139 -1.554 -7.606 8.638 1.00 0.00 H new ATOM 2228 N PHE A 140 -2.839 -2.532 7.095 1.00 0.00 N ATOM 2229 CA PHE A 140 -3.367 -1.409 6.326 1.00 0.00 C ATOM 2230 C PHE A 140 -2.319 -0.903 5.337 1.00 0.00 C ATOM 2231 O PHE A 140 -2.653 -0.486 4.228 1.00 0.00 O ATOM 2232 CB PHE A 140 -3.801 -0.269 7.282 1.00 0.00 C ATOM 2233 CG PHE A 140 -5.314 -0.260 7.419 1.00 0.00 C ATOM 2234 CD1 PHE A 140 -6.004 -1.463 7.604 1.00 0.00 C ATOM 2235 CD2 PHE A 140 -6.018 0.948 7.357 1.00 0.00 C ATOM 2236 CE1 PHE A 140 -7.398 -1.460 7.728 1.00 0.00 C ATOM 2237 CE2 PHE A 140 -7.414 0.951 7.481 1.00 0.00 C ATOM 2238 CZ PHE A 140 -8.103 -0.252 7.667 1.00 0.00 C ATOM 0 H PHE A 140 -2.904 -2.424 8.107 1.00 0.00 H new ATOM 0 HA PHE A 140 -4.238 -1.746 5.764 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -3.339 -0.406 8.260 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -3.456 0.691 6.898 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -5.460 -2.395 7.651 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -5.486 1.877 7.214 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -7.930 -2.389 7.871 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -7.958 1.883 7.433 1.00 0.00 H new ATOM 0 HZ PHE A 140 -9.179 -0.249 7.764 1.00 0.00 H new ATOM 2248 N CYS A 141 -1.056 -0.954 5.735 1.00 0.00 N ATOM 2249 CA CYS A 141 0.016 -0.511 4.861 1.00 0.00 C ATOM 2250 C CYS A 141 0.111 -1.440 3.659 1.00 0.00 C ATOM 2251 O CYS A 141 0.398 -1.006 2.543 1.00 0.00 O ATOM 2252 CB CYS A 141 1.345 -0.505 5.618 1.00 0.00 C ATOM 2253 SG CYS A 141 2.710 -0.294 4.448 1.00 0.00 S ATOM 0 H CYS A 141 -0.752 -1.294 6.647 1.00 0.00 H new ATOM 0 HA CYS A 141 -0.199 0.502 4.520 1.00 0.00 H new ATOM 0 HB2 CYS A 141 1.354 0.301 6.351 1.00 0.00 H new ATOM 0 HB3 CYS A 141 1.466 -1.438 6.169 1.00 0.00 H new ATOM 0 HG CYS A 141 2.248 -0.317 3.233 1.00 0.00 H new ATOM 2259 N ALA A 142 -0.134 -2.725 3.901 1.00 0.00 N ATOM 2260 CA ALA A 142 -0.076 -3.720 2.839 1.00 0.00 C ATOM 2261 C ALA A 142 -1.141 -3.452 1.784 1.00 0.00 C ATOM 2262 O ALA A 142 -0.923 -3.707 0.600 1.00 0.00 O ATOM 2263 CB ALA A 142 -0.274 -5.116 3.422 1.00 0.00 C ATOM 0 H ALA A 142 -0.373 -3.099 4.819 1.00 0.00 H new ATOM 0 HA ALA A 142 0.904 -3.657 2.367 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -0.229 -5.854 2.621 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.511 -5.321 4.149 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -1.246 -5.171 3.912 1.00 0.00 H new ATOM 2269 N GLU A 143 -2.291 -2.933 2.209 1.00 0.00 N ATOM 2270 CA GLU A 143 -3.363 -2.639 1.266 1.00 0.00 C ATOM 2271 C GLU A 143 -2.885 -1.630 0.229 1.00 0.00 C ATOM 2272 O GLU A 143 -2.985 -1.867 -0.975 1.00 0.00 O ATOM 2273 CB GLU A 143 -4.581 -2.078 2.007 1.00 0.00 C ATOM 2274 CG GLU A 143 -5.296 -3.208 2.750 1.00 0.00 C ATOM 2275 CD GLU A 143 -6.449 -2.644 3.571 1.00 0.00 C ATOM 2276 OE1 GLU A 143 -6.430 -1.456 3.847 1.00 0.00 O ATOM 2277 OE2 GLU A 143 -7.339 -3.408 3.911 1.00 0.00 O ATOM 0 H GLU A 143 -2.501 -2.711 3.182 1.00 0.00 H new ATOM 0 HA GLU A 143 -3.647 -3.563 0.763 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -4.267 -1.308 2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -5.263 -1.605 1.300 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -5.671 -3.943 2.037 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -4.594 -3.727 3.402 1.00 0.00 H new ATOM 2284 N GLY A 144 -2.362 -0.505 0.706 1.00 0.00 N ATOM 2285 CA GLY A 144 -1.869 0.538 -0.185 1.00 0.00 C ATOM 2286 C GLY A 144 -0.822 -0.012 -1.149 1.00 0.00 C ATOM 2287 O GLY A 144 -0.810 0.337 -2.329 1.00 0.00 O ATOM 0 H GLY A 144 -2.269 -0.293 1.699 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -2.700 0.961 -0.749 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -1.437 1.348 0.403 1.00 0.00 H new ATOM 2291 N LEU A 145 0.057 -0.870 -0.640 1.00 0.00 N ATOM 2292 CA LEU A 145 1.104 -1.456 -1.471 1.00 0.00 C ATOM 2293 C LEU A 145 0.495 -2.218 -2.650 1.00 0.00 C ATOM 2294 O LEU A 145 0.960 -2.102 -3.784 1.00 0.00 O ATOM 2295 CB LEU A 145 1.969 -2.416 -0.636 1.00 0.00 C ATOM 2296 CG LEU A 145 2.910 -1.614 0.294 1.00 0.00 C ATOM 2297 CD1 LEU A 145 3.393 -2.511 1.458 1.00 0.00 C ATOM 2298 CD2 LEU A 145 4.132 -1.106 -0.505 1.00 0.00 C ATOM 0 H LEU A 145 0.066 -1.173 0.334 1.00 0.00 H new ATOM 0 HA LEU A 145 1.725 -0.647 -1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.330 -3.070 -0.043 1.00 0.00 H new ATOM 0 HB3 LEU A 145 2.556 -3.056 -1.295 1.00 0.00 H new ATOM 0 HG LEU A 145 2.363 -0.762 0.698 1.00 0.00 H new ATOM 0 HD11 LEU A 145 4.055 -1.939 2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 145 2.533 -2.858 2.031 1.00 0.00 H new ATOM 0 HD13 LEU A 145 3.932 -3.369 1.057 1.00 0.00 H new ATOM 0 HD21 LEU A 145 4.790 -0.542 0.156 1.00 0.00 H new ATOM 0 HD22 LEU A 145 4.675 -1.956 -0.919 1.00 0.00 H new ATOM 0 HD23 LEU A 145 3.794 -0.461 -1.316 1.00 0.00 H new ATOM 2310 N LEU A 146 -0.541 -3.004 -2.371 1.00 0.00 N ATOM 2311 CA LEU A 146 -1.199 -3.792 -3.412 1.00 0.00 C ATOM 2312 C LEU A 146 -1.800 -2.897 -4.497 1.00 0.00 C ATOM 2313 O LEU A 146 -1.736 -3.224 -5.682 1.00 0.00 O ATOM 2314 CB LEU A 146 -2.309 -4.652 -2.798 1.00 0.00 C ATOM 2315 CG LEU A 146 -1.699 -5.705 -1.860 1.00 0.00 C ATOM 2316 CD1 LEU A 146 -2.819 -6.358 -1.043 1.00 0.00 C ATOM 2317 CD2 LEU A 146 -0.960 -6.789 -2.680 1.00 0.00 C ATOM 0 H LEU A 146 -0.942 -3.113 -1.439 1.00 0.00 H new ATOM 0 HA LEU A 146 -0.443 -4.430 -3.869 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -3.006 -4.021 -2.246 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -2.879 -5.142 -3.587 1.00 0.00 H new ATOM 0 HG LEU A 146 -0.985 -5.221 -1.193 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -2.393 -7.107 -0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -3.332 -5.597 -0.455 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -3.530 -6.836 -1.717 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.533 -7.529 -2.003 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -1.663 -7.278 -3.354 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.163 -6.325 -3.261 1.00 0.00 H new ATOM 2329 N PHE A 147 -2.388 -1.772 -4.093 1.00 0.00 N ATOM 2330 CA PHE A 147 -2.999 -0.856 -5.055 1.00 0.00 C ATOM 2331 C PHE A 147 -1.936 -0.111 -5.855 1.00 0.00 C ATOM 2332 O PHE A 147 -2.133 0.196 -7.030 1.00 0.00 O ATOM 2333 CB PHE A 147 -3.883 0.154 -4.318 1.00 0.00 C ATOM 2334 CG PHE A 147 -5.081 -0.561 -3.729 1.00 0.00 C ATOM 2335 CD1 PHE A 147 -6.043 -1.126 -4.575 1.00 0.00 C ATOM 2336 CD2 PHE A 147 -5.229 -0.659 -2.339 1.00 0.00 C ATOM 2337 CE1 PHE A 147 -7.150 -1.789 -4.032 1.00 0.00 C ATOM 2338 CE2 PHE A 147 -6.336 -1.322 -1.796 1.00 0.00 C ATOM 2339 CZ PHE A 147 -7.297 -1.886 -2.643 1.00 0.00 C ATOM 0 H PHE A 147 -2.454 -1.475 -3.119 1.00 0.00 H new ATOM 0 HA PHE A 147 -3.604 -1.443 -5.746 1.00 0.00 H new ATOM 0 HB2 PHE A 147 -3.314 0.644 -3.528 1.00 0.00 H new ATOM 0 HB3 PHE A 147 -4.213 0.934 -5.004 1.00 0.00 H new ATOM 0 HD1 PHE A 147 -5.931 -1.050 -5.647 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -4.488 -0.222 -1.686 1.00 0.00 H new ATOM 0 HE1 PHE A 147 -7.891 -2.226 -4.685 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -6.448 -1.398 -0.725 1.00 0.00 H new ATOM 0 HZ PHE A 147 -8.152 -2.396 -2.225 1.00 0.00 H new ATOM 2349 N GLY A 148 -0.813 0.181 -5.212 1.00 0.00 N ATOM 2350 CA GLY A 148 0.269 0.896 -5.875 1.00 0.00 C ATOM 2351 C GLY A 148 0.775 0.124 -7.089 1.00 0.00 C ATOM 2352 O GLY A 148 1.047 0.707 -8.137 1.00 0.00 O ATOM 0 H GLY A 148 -0.628 -0.064 -4.239 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -0.079 1.881 -6.186 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.088 1.054 -5.173 1.00 0.00 H new ATOM 2356 N ALA A 149 0.904 -1.189 -6.939 1.00 0.00 N ATOM 2357 CA ALA A 149 1.386 -2.029 -8.032 1.00 0.00 C ATOM 2358 C ALA A 149 0.275 -2.300 -9.047 1.00 0.00 C ATOM 2359 O ALA A 149 0.543 -2.501 -10.231 1.00 0.00 O ATOM 2360 CB ALA A 149 1.906 -3.357 -7.474 1.00 0.00 C ATOM 0 H ALA A 149 0.684 -1.693 -6.080 1.00 0.00 H new ATOM 0 HA ALA A 149 2.194 -1.500 -8.538 1.00 0.00 H new ATOM 0 HB1 ALA A 149 2.265 -3.980 -8.293 1.00 0.00 H new ATOM 0 HB2 ALA A 149 2.724 -3.165 -6.780 1.00 0.00 H new ATOM 0 HB3 ALA A 149 1.100 -3.873 -6.952 1.00 0.00 H new ATOM 2366 N ALA A 150 -0.968 -2.307 -8.580 1.00 0.00 N ATOM 2367 CA ALA A 150 -2.103 -2.560 -9.464 1.00 0.00 C ATOM 2368 C ALA A 150 -2.266 -1.432 -10.481 1.00 0.00 C ATOM 2369 O ALA A 150 -2.380 -1.679 -11.681 1.00 0.00 O ATOM 2370 CB ALA A 150 -3.385 -2.699 -8.642 1.00 0.00 C ATOM 0 H ALA A 150 -1.216 -2.142 -7.604 1.00 0.00 H new ATOM 0 HA ALA A 150 -1.913 -3.488 -10.003 1.00 0.00 H new ATOM 0 HB1 ALA A 150 -4.226 -2.887 -9.309 1.00 0.00 H new ATOM 0 HB2 ALA A 150 -3.282 -3.530 -7.944 1.00 0.00 H new ATOM 0 HB3 ALA A 150 -3.562 -1.779 -8.086 1.00 0.00 H new ATOM 2376 N GLN A 151 -2.270 -0.196 -9.995 1.00 0.00 N ATOM 2377 CA GLN A 151 -2.415 0.957 -10.878 1.00 0.00 C ATOM 2378 C GLN A 151 -1.254 1.010 -11.865 1.00 0.00 C ATOM 2379 O GLN A 151 -1.453 1.159 -13.068 1.00 0.00 O ATOM 2380 CB GLN A 151 -2.448 2.246 -10.054 1.00 0.00 C ATOM 2381 CG GLN A 151 -3.653 2.220 -9.114 1.00 0.00 C ATOM 2382 CD GLN A 151 -4.941 2.390 -9.911 1.00 0.00 C ATOM 2383 OE1 GLN A 151 -5.500 1.346 -10.460 1.00 0.00 O flip ATOM 2384 NE2 GLN A 151 -5.452 3.503 -10.039 1.00 0.00 N flip ATOM 0 H GLN A 151 -2.176 0.033 -9.006 1.00 0.00 H new ATOM 0 HA GLN A 151 -3.350 0.860 -11.431 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -1.527 2.346 -9.479 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -2.507 3.111 -10.715 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -3.677 1.278 -8.566 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -3.565 3.017 -8.375 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -5.014 4.318 -9.609 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -6.313 3.610 -10.575 1.00 0.00 H new ATOM 2393 N HIS A 152 -0.045 0.891 -11.339 1.00 0.00 N ATOM 2394 CA HIS A 152 1.157 0.927 -12.166 1.00 0.00 C ATOM 2395 C HIS A 152 0.965 0.120 -13.449 1.00 0.00 C ATOM 2396 O HIS A 152 1.570 0.421 -14.478 1.00 0.00 O ATOM 2397 CB HIS A 152 2.338 0.362 -11.380 1.00 0.00 C ATOM 2398 CG HIS A 152 2.594 1.235 -10.187 1.00 0.00 C ATOM 2399 ND1 HIS A 152 1.816 2.347 -9.909 1.00 0.00 N ATOM 2400 CD2 HIS A 152 3.533 1.175 -9.189 1.00 0.00 C ATOM 2401 CE1 HIS A 152 2.296 2.907 -8.784 1.00 0.00 C ATOM 2402 NE2 HIS A 152 3.344 2.231 -8.304 1.00 0.00 N ATOM 0 H HIS A 152 0.133 0.768 -10.342 1.00 0.00 H new ATOM 0 HA HIS A 152 1.355 1.964 -12.437 1.00 0.00 H new ATOM 0 HB2 HIS A 152 2.124 -0.658 -11.061 1.00 0.00 H new ATOM 0 HB3 HIS A 152 3.225 0.319 -12.012 1.00 0.00 H new ATOM 0 HD1 HIS A 152 1.023 2.680 -10.458 1.00 0.00 H new ATOM 0 HD2 HIS A 152 4.302 0.422 -9.103 1.00 0.00 H new ATOM 0 HE1 HIS A 152 1.885 3.794 -8.325 1.00 0.00 H new ATOM 2411 N PHE A 153 0.120 -0.913 -13.379 1.00 0.00 N ATOM 2412 CA PHE A 153 -0.145 -1.769 -14.547 1.00 0.00 C ATOM 2413 C PHE A 153 -1.584 -1.589 -15.037 1.00 0.00 C ATOM 2414 O PHE A 153 -2.190 -2.523 -15.563 1.00 0.00 O ATOM 2415 CB PHE A 153 0.093 -3.245 -14.180 1.00 0.00 C ATOM 2416 CG PHE A 153 1.227 -3.346 -13.182 1.00 0.00 C ATOM 2417 CD1 PHE A 153 2.378 -2.560 -13.337 1.00 0.00 C ATOM 2418 CD2 PHE A 153 1.126 -4.229 -12.099 1.00 0.00 C ATOM 2419 CE1 PHE A 153 3.421 -2.657 -12.413 1.00 0.00 C ATOM 2420 CE2 PHE A 153 2.171 -4.324 -11.172 1.00 0.00 C ATOM 2421 CZ PHE A 153 3.318 -3.537 -11.329 1.00 0.00 C ATOM 0 H PHE A 153 -0.390 -1.178 -12.536 1.00 0.00 H new ATOM 0 HA PHE A 153 0.535 -1.477 -15.347 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.815 -3.676 -13.758 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.332 -3.819 -15.076 1.00 0.00 H new ATOM 0 HD1 PHE A 153 2.458 -1.879 -14.171 1.00 0.00 H new ATOM 0 HD2 PHE A 153 0.241 -4.837 -11.979 1.00 0.00 H new ATOM 0 HE1 PHE A 153 4.308 -2.053 -12.535 1.00 0.00 H new ATOM 0 HE2 PHE A 153 2.092 -5.004 -10.337 1.00 0.00 H new ATOM 0 HZ PHE A 153 4.124 -3.609 -10.614 1.00 0.00 H new ATOM 2431 N GLN A 154 -2.121 -0.384 -14.862 1.00 0.00 N ATOM 2432 CA GLN A 154 -3.490 -0.088 -15.290 1.00 0.00 C ATOM 2433 C GLN A 154 -4.419 -1.270 -15.005 1.00 0.00 C ATOM 2434 O GLN A 154 -5.261 -1.624 -15.829 1.00 0.00 O ATOM 2435 CB GLN A 154 -3.510 0.237 -16.790 1.00 0.00 C ATOM 2436 CG GLN A 154 -4.780 1.023 -17.135 1.00 0.00 C ATOM 2437 CD GLN A 154 -4.907 1.170 -18.647 1.00 0.00 C ATOM 2438 OE1 GLN A 154 -4.932 0.173 -19.369 1.00 0.00 O ATOM 2439 NE2 GLN A 154 -4.990 2.362 -19.172 1.00 0.00 N ATOM 0 H GLN A 154 -1.634 0.401 -14.429 1.00 0.00 H new ATOM 0 HA GLN A 154 -3.846 0.774 -14.726 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -2.628 0.819 -17.057 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -3.472 -0.684 -17.371 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -5.655 0.510 -16.736 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -4.747 2.007 -16.667 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -4.969 3.186 -18.572 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -5.076 2.469 -20.183 1.00 0.00 H new ATOM 2448 N GLN A 155 -4.254 -1.878 -13.828 1.00 0.00 N ATOM 2449 CA GLN A 155 -5.073 -3.019 -13.431 1.00 0.00 C ATOM 2450 C GLN A 155 -5.890 -2.672 -12.186 1.00 0.00 C ATOM 2451 O GLN A 155 -5.341 -2.515 -11.098 1.00 0.00 O ATOM 2452 CB GLN A 155 -4.159 -4.220 -13.146 1.00 0.00 C ATOM 2453 CG GLN A 155 -4.978 -5.391 -12.600 1.00 0.00 C ATOM 2454 CD GLN A 155 -6.124 -5.725 -13.548 1.00 0.00 C ATOM 2455 OE1 GLN A 155 -5.922 -6.404 -14.553 1.00 0.00 O ATOM 2456 NE2 GLN A 155 -7.324 -5.282 -13.286 1.00 0.00 N ATOM 0 H GLN A 155 -3.560 -1.597 -13.135 1.00 0.00 H new ATOM 0 HA GLN A 155 -5.762 -3.270 -14.237 1.00 0.00 H new ATOM 0 HB2 GLN A 155 -3.646 -4.521 -14.060 1.00 0.00 H new ATOM 0 HB3 GLN A 155 -3.390 -3.938 -12.427 1.00 0.00 H new ATOM 0 HG2 GLN A 155 -4.337 -6.263 -12.472 1.00 0.00 H new ATOM 0 HG3 GLN A 155 -5.373 -5.139 -11.616 1.00 0.00 H new ATOM 0 HE21 GLN A 155 -7.489 -4.719 -12.452 1.00 0.00 H new ATOM 0 HE22 GLN A 155 -8.097 -5.499 -13.916 1.00 0.00 H new ATOM 2465 N LYS A 156 -7.202 -2.547 -12.360 1.00 0.00 N ATOM 2466 CA LYS A 156 -8.088 -2.208 -11.244 1.00 0.00 C ATOM 2467 C LYS A 156 -8.447 -3.453 -10.436 1.00 0.00 C ATOM 2468 O LYS A 156 -8.667 -4.526 -10.997 1.00 0.00 O ATOM 2469 CB LYS A 156 -9.367 -1.560 -11.775 1.00 0.00 C ATOM 2470 CG LYS A 156 -9.016 -0.270 -12.520 1.00 0.00 C ATOM 2471 CD LYS A 156 -10.291 0.546 -12.760 1.00 0.00 C ATOM 2472 CE LYS A 156 -11.224 -0.218 -13.704 1.00 0.00 C ATOM 2473 NZ LYS A 156 -12.248 0.716 -14.251 1.00 0.00 N ATOM 0 H LYS A 156 -7.675 -2.674 -13.255 1.00 0.00 H new ATOM 0 HA LYS A 156 -7.564 -1.509 -10.593 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -9.886 -2.248 -12.443 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -10.046 -1.343 -10.951 1.00 0.00 H new ATOM 0 HG2 LYS A 156 -8.302 0.314 -11.940 1.00 0.00 H new ATOM 0 HG3 LYS A 156 -8.538 -0.505 -13.471 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -10.795 0.738 -11.813 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -10.038 1.516 -13.189 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -10.651 -0.664 -14.517 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -11.709 -1.035 -13.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -12.882 0.199 -14.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -12.801 1.121 -13.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -11.776 1.481 -14.774 1.00 0.00 H new ATOM 2487 N ILE A 157 -8.504 -3.299 -9.112 1.00 0.00 N ATOM 2488 CA ILE A 157 -8.836 -4.417 -8.228 1.00 0.00 C ATOM 2489 C ILE A 157 -9.571 -3.931 -6.985 1.00 0.00 C ATOM 2490 O ILE A 157 -9.608 -2.735 -6.698 1.00 0.00 O ATOM 2491 CB ILE A 157 -7.560 -5.142 -7.792 1.00 0.00 C ATOM 2492 CG1 ILE A 157 -6.574 -4.136 -7.157 1.00 0.00 C ATOM 2493 CG2 ILE A 157 -6.905 -5.801 -9.008 1.00 0.00 C ATOM 2494 CD1 ILE A 157 -5.618 -4.881 -6.224 1.00 0.00 C ATOM 0 H ILE A 157 -8.326 -2.417 -8.631 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.482 -5.098 -8.783 1.00 0.00 H new ATOM 0 HB ILE A 157 -7.816 -5.905 -7.057 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -6.012 -3.620 -7.936 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -7.122 -3.374 -6.602 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -5.997 -6.317 -8.697 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -7.597 -6.518 -9.450 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -6.655 -5.038 -9.745 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -4.922 -4.173 -5.775 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -6.189 -5.376 -5.438 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -5.061 -5.626 -6.793 1.00 0.00 H new ATOM 2506 N GLN A 158 -10.135 -4.876 -6.240 1.00 0.00 N ATOM 2507 CA GLN A 158 -10.851 -4.558 -5.005 1.00 0.00 C ATOM 2508 C GLN A 158 -10.367 -5.469 -3.887 1.00 0.00 C ATOM 2509 O GLN A 158 -10.066 -6.634 -4.120 1.00 0.00 O ATOM 2510 CB GLN A 158 -12.361 -4.738 -5.207 1.00 0.00 C ATOM 2511 CG GLN A 158 -12.917 -3.541 -5.979 1.00 0.00 C ATOM 2512 CD GLN A 158 -14.401 -3.747 -6.262 1.00 0.00 C ATOM 2513 OE1 GLN A 158 -14.895 -4.873 -6.202 1.00 0.00 O ATOM 2514 NE2 GLN A 158 -15.146 -2.719 -6.568 1.00 0.00 N ATOM 0 H GLN A 158 -10.111 -5.870 -6.468 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.655 -3.520 -4.737 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -12.558 -5.660 -5.753 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -12.860 -4.826 -4.242 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.772 -2.627 -5.403 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -12.373 -3.418 -6.916 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -14.734 -1.787 -6.617 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -16.140 -2.848 -6.758 1.00 0.00 H new ATOM 2523 N ILE A 159 -10.289 -4.930 -2.669 1.00 0.00 N ATOM 2524 CA ILE A 159 -9.827 -5.722 -1.518 1.00 0.00 C ATOM 2525 C ILE A 159 -10.852 -5.724 -0.397 1.00 0.00 C ATOM 2526 O ILE A 159 -11.320 -4.674 0.040 1.00 0.00 O ATOM 2527 CB ILE A 159 -8.495 -5.171 -0.995 1.00 0.00 C ATOM 2528 CG1 ILE A 159 -7.436 -5.301 -2.100 1.00 0.00 C ATOM 2529 CG2 ILE A 159 -8.055 -5.978 0.244 1.00 0.00 C ATOM 2530 CD1 ILE A 159 -6.072 -4.863 -1.568 1.00 0.00 C ATOM 0 H ILE A 159 -10.534 -3.964 -2.451 1.00 0.00 H new ATOM 0 HA ILE A 159 -9.689 -6.748 -1.858 1.00 0.00 H new ATOM 0 HB ILE A 159 -8.610 -4.124 -0.716 1.00 0.00 H new ATOM 0 HG12 ILE A 159 -7.386 -6.333 -2.448 1.00 0.00 H new ATOM 0 HG13 ILE A 159 -7.715 -4.689 -2.957 1.00 0.00 H new ATOM 0 HG21 ILE A 159 -7.108 -5.586 0.616 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -8.814 -5.893 1.022 1.00 0.00 H new ATOM 0 HG23 ILE A 159 -7.932 -7.026 -0.029 1.00 0.00 H new ATOM 0 HD11 ILE A 159 -5.326 -4.958 -2.357 1.00 0.00 H new ATOM 0 HD12 ILE A 159 -6.125 -3.824 -1.242 1.00 0.00 H new ATOM 0 HD13 ILE A 159 -5.791 -5.494 -0.725 1.00 0.00 H new ATOM 2542 N SER A 160 -11.183 -6.927 0.075 1.00 0.00 N ATOM 2543 CA SER A 160 -12.142 -7.086 1.166 1.00 0.00 C ATOM 2544 C SER A 160 -11.420 -7.535 2.430 1.00 0.00 C ATOM 2545 O SER A 160 -10.997 -8.685 2.545 1.00 0.00 O ATOM 2546 CB SER A 160 -13.205 -8.114 0.784 1.00 0.00 C ATOM 2547 OG SER A 160 -14.012 -8.400 1.921 1.00 0.00 O ATOM 0 H SER A 160 -10.801 -7.803 -0.281 1.00 0.00 H new ATOM 0 HA SER A 160 -12.627 -6.128 1.352 1.00 0.00 H new ATOM 0 HB2 SER A 160 -13.823 -7.731 -0.028 1.00 0.00 H new ATOM 0 HB3 SER A 160 -12.732 -9.026 0.421 1.00 0.00 H new ATOM 0 HG SER A 160 -14.696 -9.058 1.679 1.00 0.00 H new ATOM 2553 N HIS A 161 -11.281 -6.608 3.375 1.00 0.00 N ATOM 2554 CA HIS A 161 -10.601 -6.893 4.643 1.00 0.00 C ATOM 2555 C HIS A 161 -11.614 -6.985 5.783 1.00 0.00 C ATOM 2556 O HIS A 161 -11.836 -6.015 6.507 1.00 0.00 O ATOM 2557 CB HIS A 161 -9.588 -5.780 4.935 1.00 0.00 C ATOM 2558 CG HIS A 161 -8.976 -5.987 6.290 1.00 0.00 C ATOM 2559 ND1 HIS A 161 -8.496 -4.932 7.051 1.00 0.00 N ATOM 2560 CD2 HIS A 161 -8.750 -7.117 7.031 1.00 0.00 C ATOM 2561 CE1 HIS A 161 -8.011 -5.447 8.195 1.00 0.00 C ATOM 2562 NE2 HIS A 161 -8.141 -6.775 8.233 1.00 0.00 N ATOM 0 H HIS A 161 -11.629 -5.653 3.290 1.00 0.00 H new ATOM 0 HA HIS A 161 -10.083 -7.849 4.563 1.00 0.00 H new ATOM 0 HB2 HIS A 161 -8.810 -5.776 4.172 1.00 0.00 H new ATOM 0 HB3 HIS A 161 -10.080 -4.808 4.894 1.00 0.00 H new ATOM 0 HD1 HIS A 161 -8.508 -3.946 6.791 1.00 0.00 H new ATOM 0 HD2 HIS A 161 -9.006 -8.121 6.727 1.00 0.00 H new ATOM 0 HE1 HIS A 161 -7.570 -4.858 8.986 1.00 0.00 H new ATOM 2571 N ASP A 162 -12.230 -8.160 5.933 1.00 0.00 N ATOM 2572 CA ASP A 162 -13.225 -8.366 6.987 1.00 0.00 C ATOM 2573 C ASP A 162 -12.572 -8.894 8.259 1.00 0.00 C ATOM 2574 O ASP A 162 -13.005 -8.564 9.364 1.00 0.00 O ATOM 2575 CB ASP A 162 -14.300 -9.347 6.511 1.00 0.00 C ATOM 2576 CG ASP A 162 -15.427 -9.421 7.535 1.00 0.00 C ATOM 2577 OD1 ASP A 162 -15.317 -8.765 8.558 1.00 0.00 O ATOM 2578 OD2 ASP A 162 -16.385 -10.133 7.281 1.00 0.00 O ATOM 0 H ASP A 162 -12.060 -8.975 5.344 1.00 0.00 H new ATOM 0 HA ASP A 162 -13.686 -7.404 7.210 1.00 0.00 H new ATOM 0 HB2 ASP A 162 -14.694 -9.028 5.546 1.00 0.00 H new ATOM 0 HB3 ASP A 162 -13.864 -10.335 6.366 1.00 0.00 H new ATOM 2583 N THR A 163 -11.523 -9.706 8.114 1.00 0.00 N ATOM 2584 CA THR A 163 -10.832 -10.244 9.289 1.00 0.00 C ATOM 2585 C THR A 163 -9.642 -9.368 9.642 1.00 0.00 C ATOM 2586 O THR A 163 -8.722 -9.207 8.843 1.00 0.00 O ATOM 2587 CB THR A 163 -10.350 -11.677 9.032 1.00 0.00 C ATOM 2588 OG1 THR A 163 -11.372 -12.408 8.367 1.00 0.00 O ATOM 2589 CG2 THR A 163 -10.021 -12.353 10.372 1.00 0.00 C ATOM 0 H THR A 163 -11.139 -10.001 7.216 1.00 0.00 H new ATOM 0 HA THR A 163 -11.538 -10.254 10.120 1.00 0.00 H new ATOM 0 HB THR A 163 -9.456 -11.655 8.408 1.00 0.00 H new ATOM 0 HG1 THR A 163 -11.064 -13.323 8.201 1.00 0.00 H new ATOM 0 HG21 THR A 163 -9.678 -13.372 10.191 1.00 0.00 H new ATOM 0 HG22 THR A 163 -9.237 -11.791 10.880 1.00 0.00 H new ATOM 0 HG23 THR A 163 -10.914 -12.376 10.997 1.00 0.00 H new ATOM 2597 N CYS A 164 -9.665 -8.802 10.845 1.00 0.00 N ATOM 2598 CA CYS A 164 -8.575 -7.938 11.294 1.00 0.00 C ATOM 2599 C CYS A 164 -8.229 -8.223 12.751 1.00 0.00 C ATOM 2600 O CYS A 164 -9.085 -8.149 13.633 1.00 0.00 O ATOM 2601 CB CYS A 164 -8.974 -6.466 11.131 1.00 0.00 C ATOM 2602 SG CYS A 164 -10.122 -5.988 12.447 1.00 0.00 S ATOM 0 H CYS A 164 -10.418 -8.923 11.522 1.00 0.00 H new ATOM 0 HA CYS A 164 -7.696 -8.143 10.682 1.00 0.00 H new ATOM 0 HB2 CYS A 164 -8.086 -5.834 11.164 1.00 0.00 H new ATOM 0 HB3 CYS A 164 -9.439 -6.312 10.157 1.00 0.00 H new ATOM 0 HG CYS A 164 -10.453 -4.739 12.302 1.00 0.00 H new ATOM 2608 N MET A 165 -6.969 -8.542 12.993 1.00 0.00 N ATOM 2609 CA MET A 165 -6.509 -8.826 14.342 1.00 0.00 C ATOM 2610 C MET A 165 -6.895 -7.695 15.282 1.00 0.00 C ATOM 2611 O MET A 165 -6.944 -7.872 16.499 1.00 0.00 O ATOM 2612 CB MET A 165 -4.992 -8.991 14.342 1.00 0.00 C ATOM 2613 CG MET A 165 -4.617 -10.280 13.610 1.00 0.00 C ATOM 2614 SD MET A 165 -2.823 -10.513 13.672 1.00 0.00 S ATOM 2615 CE MET A 165 -2.366 -9.041 12.724 1.00 0.00 C ATOM 0 H MET A 165 -6.248 -8.611 12.275 1.00 0.00 H new ATOM 0 HA MET A 165 -6.979 -9.748 14.686 1.00 0.00 H new ATOM 0 HB2 MET A 165 -4.523 -8.135 13.856 1.00 0.00 H new ATOM 0 HB3 MET A 165 -4.619 -9.020 15.366 1.00 0.00 H new ATOM 0 HG2 MET A 165 -5.120 -11.131 14.069 1.00 0.00 H new ATOM 0 HG3 MET A 165 -4.952 -10.233 12.574 1.00 0.00 H new ATOM 0 HE1 MET A 165 -1.601 -9.302 11.993 1.00 0.00 H new ATOM 0 HE2 MET A 165 -3.244 -8.654 12.207 1.00 0.00 H new ATOM 0 HE3 MET A 165 -1.977 -8.279 13.400 1.00 0.00 H new ATOM 2625 N HIS A 166 -7.164 -6.529 14.709 1.00 0.00 N ATOM 2626 CA HIS A 166 -7.537 -5.369 15.503 1.00 0.00 C ATOM 2627 C HIS A 166 -8.804 -5.644 16.307 1.00 0.00 C ATOM 2628 O HIS A 166 -9.092 -4.943 17.277 1.00 0.00 O ATOM 2629 CB HIS A 166 -7.759 -4.161 14.592 1.00 0.00 C ATOM 2630 CG HIS A 166 -7.895 -2.923 15.431 1.00 0.00 C ATOM 2631 ND1 HIS A 166 -6.975 -2.594 16.414 1.00 0.00 N ATOM 2632 CD2 HIS A 166 -8.836 -1.924 15.449 1.00 0.00 C ATOM 2633 CE1 HIS A 166 -7.378 -1.439 16.977 1.00 0.00 C ATOM 2634 NE2 HIS A 166 -8.509 -0.989 16.424 1.00 0.00 N ATOM 0 H HIS A 166 -7.131 -6.363 13.703 1.00 0.00 H new ATOM 0 HA HIS A 166 -6.724 -5.157 16.198 1.00 0.00 H new ATOM 0 HB2 HIS A 166 -6.924 -4.055 13.900 1.00 0.00 H new ATOM 0 HB3 HIS A 166 -8.656 -4.306 13.989 1.00 0.00 H new ATOM 0 HD2 HIS A 166 -9.700 -1.872 14.803 1.00 0.00 H new ATOM 0 HE1 HIS A 166 -6.852 -0.938 17.777 1.00 0.00 H new ATOM 0 HE2 HIS A 166 -9.022 -0.141 16.666 1.00 0.00 H new ATOM 2643 N THR A 167 -9.565 -6.670 15.906 1.00 0.00 N ATOM 2644 CA THR A 167 -10.804 -7.018 16.613 1.00 0.00 C ATOM 2645 C THR A 167 -10.596 -8.262 17.477 1.00 0.00 C ATOM 2646 O THR A 167 -11.546 -8.977 17.793 1.00 0.00 O ATOM 2647 CB THR A 167 -11.932 -7.270 15.597 1.00 0.00 C ATOM 2648 OG1 THR A 167 -11.803 -6.359 14.516 1.00 0.00 O ATOM 2649 CG2 THR A 167 -13.294 -7.071 16.270 1.00 0.00 C ATOM 0 H THR A 167 -9.349 -7.266 15.107 1.00 0.00 H new ATOM 0 HA THR A 167 -11.081 -6.186 17.261 1.00 0.00 H new ATOM 0 HB THR A 167 -11.861 -8.293 15.227 1.00 0.00 H new ATOM 0 HG1 THR A 167 -11.166 -6.716 13.862 1.00 0.00 H new ATOM 0 HG21 THR A 167 -14.088 -7.251 15.545 1.00 0.00 H new ATOM 0 HG22 THR A 167 -13.395 -7.770 17.100 1.00 0.00 H new ATOM 0 HG23 THR A 167 -13.369 -6.050 16.644 1.00 0.00 H new ATOM 2657 N GLY A 168 -9.346 -8.510 17.859 1.00 0.00 N ATOM 2658 CA GLY A 168 -9.021 -9.668 18.694 1.00 0.00 C ATOM 2659 C GLY A 168 -8.622 -10.870 17.845 1.00 0.00 C ATOM 2660 O GLY A 168 -8.120 -11.867 18.365 1.00 0.00 O ATOM 0 H GLY A 168 -8.545 -7.931 17.607 1.00 0.00 H new ATOM 0 HA2 GLY A 168 -8.207 -9.413 19.372 1.00 0.00 H new ATOM 0 HA3 GLY A 168 -9.881 -9.926 19.312 1.00 0.00 H new ATOM 2664 N ALA A 169 -8.846 -10.775 16.537 1.00 0.00 N ATOM 2665 CA ALA A 169 -8.500 -11.870 15.637 1.00 0.00 C ATOM 2666 C ALA A 169 -7.012 -12.211 15.770 1.00 0.00 C ATOM 2667 O ALA A 169 -6.204 -11.365 16.154 1.00 0.00 O ATOM 2668 CB ALA A 169 -8.835 -11.479 14.173 1.00 0.00 C ATOM 0 H ALA A 169 -9.260 -9.962 16.082 1.00 0.00 H new ATOM 0 HA ALA A 169 -9.084 -12.750 15.907 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -8.574 -12.302 13.508 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -9.901 -11.268 14.088 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -8.266 -10.592 13.894 1.00 0.00 H new ATOM 2674 N ASP A 170 -6.658 -13.455 15.454 1.00 0.00 N ATOM 2675 CA ASP A 170 -5.265 -13.891 15.543 1.00 0.00 C ATOM 2676 C ASP A 170 -4.572 -13.703 14.200 1.00 0.00 C ATOM 2677 O ASP A 170 -3.360 -13.882 14.082 1.00 0.00 O ATOM 2678 CB ASP A 170 -5.203 -15.365 15.949 1.00 0.00 C ATOM 2679 CG ASP A 170 -3.756 -15.780 16.185 1.00 0.00 C ATOM 2680 OD1 ASP A 170 -2.902 -14.909 16.183 1.00 0.00 O ATOM 2681 OD2 ASP A 170 -3.522 -16.964 16.363 1.00 0.00 O ATOM 0 H ASP A 170 -7.309 -14.173 15.137 1.00 0.00 H new ATOM 0 HA ASP A 170 -4.757 -13.289 16.296 1.00 0.00 H new ATOM 0 HB2 ASP A 170 -5.788 -15.526 16.854 1.00 0.00 H new ATOM 0 HB3 ASP A 170 -5.645 -15.985 15.169 1.00 0.00 H new ATOM 2686 N HIS A 171 -5.355 -13.338 13.191 1.00 0.00 N ATOM 2687 CA HIS A 171 -4.820 -13.122 11.852 1.00 0.00 C ATOM 2688 C HIS A 171 -5.727 -12.184 11.064 1.00 0.00 C ATOM 2689 O HIS A 171 -6.698 -11.652 11.596 1.00 0.00 O ATOM 2690 CB HIS A 171 -4.703 -14.458 11.117 1.00 0.00 C ATOM 2691 CG HIS A 171 -6.038 -15.151 11.122 1.00 0.00 C ATOM 2692 ND1 HIS A 171 -7.173 -14.564 11.660 1.00 0.00 N ATOM 2693 CD2 HIS A 171 -6.434 -16.380 10.660 1.00 0.00 C ATOM 2694 CE1 HIS A 171 -8.190 -15.435 11.508 1.00 0.00 C ATOM 2695 NE2 HIS A 171 -7.791 -16.558 10.905 1.00 0.00 N ATOM 0 H HIS A 171 -6.360 -13.186 13.274 1.00 0.00 H new ATOM 0 HA HIS A 171 -3.833 -12.669 11.940 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -4.370 -14.294 10.092 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -3.953 -15.086 11.599 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -5.789 -17.101 10.179 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -9.203 -15.248 11.834 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -8.360 -17.372 10.674 1.00 0.00 H new ATOM 2704 N CYS A 172 -5.405 -11.990 9.790 1.00 0.00 N ATOM 2705 CA CYS A 172 -6.200 -11.115 8.924 1.00 0.00 C ATOM 2706 C CYS A 172 -6.505 -11.817 7.609 1.00 0.00 C ATOM 2707 O CYS A 172 -5.813 -12.761 7.227 1.00 0.00 O ATOM 2708 CB CYS A 172 -5.440 -9.820 8.648 1.00 0.00 C ATOM 2709 SG CYS A 172 -6.405 -8.787 7.534 1.00 0.00 S ATOM 0 H CYS A 172 -4.603 -12.423 9.332 1.00 0.00 H new ATOM 0 HA CYS A 172 -7.136 -10.881 9.430 1.00 0.00 H new ATOM 0 HB2 CYS A 172 -5.251 -9.290 9.582 1.00 0.00 H new ATOM 0 HB3 CYS A 172 -4.469 -10.042 8.206 1.00 0.00 H new ATOM 0 HG CYS A 172 -7.358 -8.204 8.199 1.00 0.00 H new ATOM 2715 N MET A 173 -7.548 -11.356 6.917 1.00 0.00 N ATOM 2716 CA MET A 173 -7.937 -11.958 5.639 1.00 0.00 C ATOM 2717 C MET A 173 -8.213 -10.878 4.598 1.00 0.00 C ATOM 2718 O MET A 173 -9.188 -10.134 4.707 1.00 0.00 O ATOM 2719 CB MET A 173 -9.190 -12.812 5.832 1.00 0.00 C ATOM 2720 CG MET A 173 -9.623 -13.390 4.489 1.00 0.00 C ATOM 2721 SD MET A 173 -10.874 -14.670 4.756 1.00 0.00 S ATOM 2722 CE MET A 173 -9.737 -16.057 4.991 1.00 0.00 C ATOM 0 H MET A 173 -8.134 -10.576 7.215 1.00 0.00 H new ATOM 0 HA MET A 173 -7.117 -12.583 5.286 1.00 0.00 H new ATOM 0 HB2 MET A 173 -8.989 -13.617 6.539 1.00 0.00 H new ATOM 0 HB3 MET A 173 -9.993 -12.209 6.256 1.00 0.00 H new ATOM 0 HG2 MET A 173 -10.025 -12.600 3.854 1.00 0.00 H new ATOM 0 HG3 MET A 173 -8.763 -13.811 3.968 1.00 0.00 H new ATOM 0 HE1 MET A 173 -10.307 -16.968 5.174 1.00 0.00 H new ATOM 0 HE2 MET A 173 -9.128 -16.184 4.096 1.00 0.00 H new ATOM 0 HE3 MET A 173 -9.090 -15.856 5.845 1.00 0.00 H new ATOM 2732 N LEU A 174 -7.353 -10.802 3.580 1.00 0.00 N ATOM 2733 CA LEU A 174 -7.516 -9.811 2.505 1.00 0.00 C ATOM 2734 C LEU A 174 -7.749 -10.522 1.175 1.00 0.00 C ATOM 2735 O LEU A 174 -6.857 -11.174 0.650 1.00 0.00 O ATOM 2736 CB LEU A 174 -6.252 -8.920 2.406 1.00 0.00 C ATOM 2737 CG LEU A 174 -6.432 -7.645 3.243 1.00 0.00 C ATOM 2738 CD1 LEU A 174 -6.473 -8.003 4.730 1.00 0.00 C ATOM 2739 CD2 LEU A 174 -5.259 -6.698 2.983 1.00 0.00 C ATOM 0 H LEU A 174 -6.540 -11.409 3.474 1.00 0.00 H new ATOM 0 HA LEU A 174 -8.377 -9.183 2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -5.381 -9.473 2.756 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -6.065 -8.656 1.365 1.00 0.00 H new ATOM 0 HG LEU A 174 -7.367 -7.160 2.963 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -6.601 -7.095 5.319 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -7.307 -8.679 4.919 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -5.540 -8.491 5.013 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -5.384 -5.792 3.576 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -4.327 -7.188 3.262 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -5.229 -6.438 1.925 1.00 0.00 H new ATOM 2751 N ILE A 175 -8.953 -10.385 0.638 1.00 0.00 N ATOM 2752 CA ILE A 175 -9.296 -11.021 -0.641 1.00 0.00 C ATOM 2753 C ILE A 175 -9.228 -9.998 -1.767 1.00 0.00 C ATOM 2754 O ILE A 175 -9.947 -9.006 -1.751 1.00 0.00 O ATOM 2755 CB ILE A 175 -10.709 -11.605 -0.566 1.00 0.00 C ATOM 2756 CG1 ILE A 175 -10.891 -12.357 0.762 1.00 0.00 C ATOM 2757 CG2 ILE A 175 -10.934 -12.563 -1.734 1.00 0.00 C ATOM 2758 CD1 ILE A 175 -9.769 -13.385 0.943 1.00 0.00 C ATOM 0 H ILE A 175 -9.709 -9.845 1.059 1.00 0.00 H new ATOM 0 HA ILE A 175 -8.583 -11.821 -0.840 1.00 0.00 H new ATOM 0 HB ILE A 175 -11.435 -10.794 -0.622 1.00 0.00 H new ATOM 0 HG12 ILE A 175 -10.885 -11.651 1.592 1.00 0.00 H new ATOM 0 HG13 ILE A 175 -11.859 -12.858 0.776 1.00 0.00 H new ATOM 0 HG21 ILE A 175 -11.941 -12.976 -1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 175 -10.816 -12.024 -2.674 1.00 0.00 H new ATOM 0 HG23 ILE A 175 -10.206 -13.373 -1.686 1.00 0.00 H new ATOM 0 HD11 ILE A 175 -9.907 -13.912 1.887 1.00 0.00 H new ATOM 0 HD12 ILE A 175 -9.795 -14.100 0.121 1.00 0.00 H new ATOM 0 HD13 ILE A 175 -8.806 -12.875 0.950 1.00 0.00 H new ATOM 2770 N ILE A 176 -8.352 -10.243 -2.746 1.00 0.00 N ATOM 2771 CA ILE A 176 -8.197 -9.321 -3.871 1.00 0.00 C ATOM 2772 C ILE A 176 -8.929 -9.839 -5.103 1.00 0.00 C ATOM 2773 O ILE A 176 -8.500 -10.804 -5.735 1.00 0.00 O ATOM 2774 CB ILE A 176 -6.705 -9.141 -4.197 1.00 0.00 C ATOM 2775 CG1 ILE A 176 -5.917 -8.765 -2.898 1.00 0.00 C ATOM 2776 CG2 ILE A 176 -6.551 -8.023 -5.241 1.00 0.00 C ATOM 2777 CD1 ILE A 176 -5.077 -9.956 -2.433 1.00 0.00 C ATOM 0 H ILE A 176 -7.746 -11.063 -2.782 1.00 0.00 H new ATOM 0 HA ILE A 176 -8.629 -8.361 -3.588 1.00 0.00 H new ATOM 0 HB ILE A 176 -6.303 -10.073 -4.595 1.00 0.00 H new ATOM 0 HG12 ILE A 176 -5.272 -7.907 -3.089 1.00 0.00 H new ATOM 0 HG13 ILE A 176 -6.613 -8.472 -2.112 1.00 0.00 H new ATOM 0 HG21 ILE A 176 -5.495 -7.889 -5.478 1.00 0.00 H new ATOM 0 HG22 ILE A 176 -7.094 -8.293 -6.146 1.00 0.00 H new ATOM 0 HG23 ILE A 176 -6.954 -7.093 -4.840 1.00 0.00 H new ATOM 0 HD11 ILE A 176 -4.532 -9.686 -1.529 1.00 0.00 H new ATOM 0 HD12 ILE A 176 -5.731 -10.803 -2.223 1.00 0.00 H new ATOM 0 HD13 ILE A 176 -4.369 -10.229 -3.215 1.00 0.00 H new ATOM 2789 N GLU A 177 -10.035 -9.185 -5.441 1.00 0.00 N ATOM 2790 CA GLU A 177 -10.825 -9.575 -6.604 1.00 0.00 C ATOM 2791 C GLU A 177 -10.298 -8.876 -7.853 1.00 0.00 C ATOM 2792 O GLU A 177 -10.079 -7.665 -7.850 1.00 0.00 O ATOM 2793 CB GLU A 177 -12.296 -9.199 -6.383 1.00 0.00 C ATOM 2794 CG GLU A 177 -13.132 -9.636 -7.590 1.00 0.00 C ATOM 2795 CD GLU A 177 -14.605 -9.335 -7.338 1.00 0.00 C ATOM 2796 OE1 GLU A 177 -14.919 -8.873 -6.254 1.00 0.00 O ATOM 2797 OE2 GLU A 177 -15.400 -9.572 -8.234 1.00 0.00 O ATOM 0 H GLU A 177 -10.404 -8.384 -4.928 1.00 0.00 H new ATOM 0 HA GLU A 177 -10.745 -10.654 -6.740 1.00 0.00 H new ATOM 0 HB2 GLU A 177 -12.671 -9.677 -5.478 1.00 0.00 H new ATOM 0 HB3 GLU A 177 -12.387 -8.123 -6.237 1.00 0.00 H new ATOM 0 HG2 GLU A 177 -12.794 -9.115 -8.486 1.00 0.00 H new ATOM 0 HG3 GLU A 177 -12.996 -10.702 -7.771 1.00 0.00 H new ATOM 2804 N LEU A 178 -10.099 -9.645 -8.921 1.00 0.00 N ATOM 2805 CA LEU A 178 -9.596 -9.086 -10.176 1.00 0.00 C ATOM 2806 C LEU A 178 -10.756 -8.743 -11.104 1.00 0.00 C ATOM 2807 O LEU A 178 -11.591 -9.595 -11.408 1.00 0.00 O ATOM 2808 CB LEU A 178 -8.677 -10.094 -10.869 1.00 0.00 C ATOM 2809 CG LEU A 178 -7.561 -10.532 -9.910 1.00 0.00 C ATOM 2810 CD1 LEU A 178 -6.881 -11.783 -10.465 1.00 0.00 C ATOM 2811 CD2 LEU A 178 -6.521 -9.410 -9.764 1.00 0.00 C ATOM 0 H LEU A 178 -10.276 -10.649 -8.944 1.00 0.00 H new ATOM 0 HA LEU A 178 -9.036 -8.179 -9.949 1.00 0.00 H new ATOM 0 HB2 LEU A 178 -9.253 -10.962 -11.191 1.00 0.00 H new ATOM 0 HB3 LEU A 178 -8.244 -9.648 -11.765 1.00 0.00 H new ATOM 0 HG LEU A 178 -7.993 -10.747 -8.933 1.00 0.00 H new ATOM 0 HD11 LEU A 178 -6.088 -12.097 -9.787 1.00 0.00 H new ATOM 0 HD12 LEU A 178 -7.614 -12.584 -10.561 1.00 0.00 H new ATOM 0 HD13 LEU A 178 -6.455 -11.562 -11.444 1.00 0.00 H new ATOM 0 HD21 LEU A 178 -5.734 -9.730 -9.082 1.00 0.00 H new ATOM 0 HD22 LEU A 178 -6.088 -9.186 -10.739 1.00 0.00 H new ATOM 0 HD23 LEU A 178 -7.003 -8.516 -9.368 1.00 0.00 H new ATOM 2823 N GLN A 179 -10.805 -7.493 -11.551 1.00 0.00 N ATOM 2824 CA GLN A 179 -11.872 -7.055 -12.445 1.00 0.00 C ATOM 2825 C GLN A 179 -11.546 -7.415 -13.890 1.00 0.00 C ATOM 2826 O GLN A 179 -10.386 -7.399 -14.299 1.00 0.00 O ATOM 2827 CB GLN A 179 -12.063 -5.543 -12.325 1.00 0.00 C ATOM 2828 CG GLN A 179 -12.538 -5.199 -10.912 1.00 0.00 C ATOM 2829 CD GLN A 179 -12.711 -3.692 -10.772 1.00 0.00 C ATOM 2830 OE1 GLN A 179 -11.865 -3.022 -10.179 1.00 0.00 O ATOM 2831 NE2 GLN A 179 -13.761 -3.114 -11.286 1.00 0.00 N ATOM 0 H GLN A 179 -10.126 -6.771 -11.312 1.00 0.00 H new ATOM 0 HA GLN A 179 -12.792 -7.563 -12.157 1.00 0.00 H new ATOM 0 HB2 GLN A 179 -11.126 -5.029 -12.540 1.00 0.00 H new ATOM 0 HB3 GLN A 179 -12.791 -5.198 -13.059 1.00 0.00 H new ATOM 0 HG2 GLN A 179 -13.482 -5.702 -10.704 1.00 0.00 H new ATOM 0 HG3 GLN A 179 -11.816 -5.560 -10.179 1.00 0.00 H new ATOM 0 HE21 GLN A 179 -14.461 -3.671 -11.777 1.00 0.00 H new ATOM 0 HE22 GLN A 179 -13.883 -2.105 -11.197 1.00 0.00 H new