USER MOD reduce.3.24.130724 H: found=0, std=0, add=1253, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1248 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 132 SER OG : rot 174:sc= 0.259 USER MOD Set 1.2: A 149 THR OG1 : rot -120:sc= -0.166 USER MOD Set 2.1: A 131 SER OG : rot -176:sc= 0.448 USER MOD Set 2.2: A 148 ASN : amide:sc= -1.46 K(o=-1,f=-4.4!) USER MOD Set 3.1: A 76 CYS SG : rot 78:sc= -0.352 USER MOD Set 3.2: A 120 SER OG : rot -42:sc= 0.478 USER MOD Set 4.1: A 28 GLN : amide:sc= 0.66 K(o=1,f=-2.6) USER MOD Set 4.2: A 88 LYS NZ :NH3+ -156:sc= 0.355 (180deg=0.952) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -152:sc= 0.786 (180deg=0.238) USER MOD Single : A 3 LYS NZ :NH3+ 159:sc= 1.27 (180deg=1.19) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0.824 K(o=0.82,f=0) USER MOD Single : A 12 GLN : amide:sc= -0.0509 K(o=-0.051,f=-1.7) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 GLN : amide:sc= -0.983 X(o=-0.98,f=-0.98) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=0.29) USER MOD Single : A 20 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl 170:sc= 0 (180deg=-0.185) USER MOD Single : A 40 SER OG : rot 15:sc= 0.521 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot -160:sc= 0.0344 USER MOD Single : A 49 CYS SG : rot -28:sc= -0.0587 USER MOD Single : A 51 HIS : no HD1:sc= -0.813 X(o=-0.81,f=-0.4) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -165:sc= -0.0922 (180deg=-0.441) USER MOD Single : A 61 ASN : amide:sc=-0.00823 X(o=-0.0082,f=0) USER MOD Single : A 64 TYR OH : rot 58:sc= 0.678 USER MOD Single : A 68 ASN : amide:sc= -0.0511 K(o=-0.051,f=-2.5!) USER MOD Single : A 71 ASN : amide:sc= -0.102 X(o=-0.1,f=-0.1) USER MOD Single : A 73 CYS SG : rot 68:sc= -1.28! USER MOD Single : A 75 MET CE :methyl -152:sc= -0.107 (180deg=-2.34) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot -5:sc= 0.0229 USER MOD Single : A 86 GLN : amide:sc= -0.266 K(o=-0.27,f=-1.4) USER MOD Single : A 90 LYS NZ :NH3+ -168:sc= 1.61 (180deg=1.44) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 96 TYR OH : rot 89:sc=0.000285 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 98 GLN : amide:sc= 0.951 K(o=0.95,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= -0.0851 USER MOD Single : A 109 HIS : no HD1:sc= -0.86 X(o=-0.86,f=-0.67) USER MOD Single : A 110 SER OG : rot 180:sc= 0.0245 USER MOD Single : A 111 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.15) USER MOD Single : A 112 SER OG : rot 169:sc= 1.2 USER MOD Single : A 115 ASN : amide:sc= -0.0312 X(o=-0.031,f=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 CYS SG : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 130:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 THR OG1 : rot 150:sc= -0.144 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -29.764 7.343 6.919 1.00 0.00 N ATOM 2 CA MET A 1 -28.473 7.626 7.562 1.00 0.00 C ATOM 3 C MET A 1 -27.417 7.275 6.537 1.00 0.00 C ATOM 4 O MET A 1 -27.552 6.281 5.821 1.00 0.00 O ATOM 5 CB MET A 1 -28.276 6.968 8.941 1.00 0.00 C ATOM 6 CG MET A 1 -27.969 5.466 8.922 1.00 0.00 C ATOM 7 SD MET A 1 -29.201 4.422 8.107 1.00 0.00 S ATOM 8 CE MET A 1 -28.251 2.877 8.096 1.00 0.00 C ATOM 0 H1 MET A 1 -30.496 7.963 7.322 1.00 0.00 H new ATOM 0 H2 MET A 1 -29.688 7.516 5.896 1.00 0.00 H new ATOM 0 H3 MET A 1 -30.023 6.349 7.083 1.00 0.00 H new ATOM 0 HA MET A 1 -28.408 8.680 7.834 1.00 0.00 H new ATOM 0 HB2 MET A 1 -27.462 7.480 9.455 1.00 0.00 H new ATOM 0 HB3 MET A 1 -29.178 7.129 9.532 1.00 0.00 H new ATOM 0 HG2 MET A 1 -27.009 5.317 8.428 1.00 0.00 H new ATOM 0 HG3 MET A 1 -27.854 5.125 9.951 1.00 0.00 H new ATOM 0 HE1 MET A 1 -28.842 2.090 7.627 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.328 3.021 7.534 1.00 0.00 H new ATOM 0 HE3 MET A 1 -28.011 2.590 9.120 1.00 0.00 H new ATOM 18 N GLU A 2 -26.407 8.124 6.410 1.00 0.00 N ATOM 19 CA GLU A 2 -25.354 7.920 5.435 1.00 0.00 C ATOM 20 C GLU A 2 -24.499 6.708 5.789 1.00 0.00 C ATOM 21 O GLU A 2 -24.444 6.283 6.949 1.00 0.00 O ATOM 22 CB GLU A 2 -24.489 9.178 5.344 1.00 0.00 C ATOM 23 CG GLU A 2 -25.242 10.452 4.918 1.00 0.00 C ATOM 24 CD GLU A 2 -25.808 10.425 3.490 1.00 0.00 C ATOM 25 OE1 GLU A 2 -26.697 9.605 3.161 1.00 0.00 O ATOM 26 OE2 GLU A 2 -25.410 11.294 2.681 1.00 0.00 O ATOM 0 H GLU A 2 -26.298 8.965 6.976 1.00 0.00 H new ATOM 0 HA GLU A 2 -25.813 7.727 4.465 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -24.026 9.354 6.315 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -23.682 8.996 4.635 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -26.063 10.621 5.615 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -24.567 11.303 5.009 1.00 0.00 H new ATOM 33 N LYS A 3 -23.797 6.179 4.787 1.00 0.00 N ATOM 34 CA LYS A 3 -22.928 5.025 4.941 1.00 0.00 C ATOM 35 C LYS A 3 -21.562 5.537 5.428 1.00 0.00 C ATOM 36 O LYS A 3 -21.395 5.736 6.633 1.00 0.00 O ATOM 37 CB LYS A 3 -22.976 4.186 3.638 1.00 0.00 C ATOM 38 CG LYS A 3 -23.233 2.684 3.859 1.00 0.00 C ATOM 39 CD LYS A 3 -23.786 1.975 2.611 1.00 0.00 C ATOM 40 CE LYS A 3 -25.289 2.230 2.425 1.00 0.00 C ATOM 41 NZ LYS A 3 -25.791 1.712 1.136 1.00 0.00 N ATOM 0 H LYS A 3 -23.820 6.548 3.836 1.00 0.00 H new ATOM 0 HA LYS A 3 -23.242 4.314 5.705 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -23.758 4.585 2.992 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -22.032 4.307 3.107 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -22.302 2.203 4.160 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -23.937 2.559 4.682 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -23.247 2.321 1.729 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -23.607 0.903 2.694 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -25.838 1.761 3.241 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -25.483 3.301 2.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -26.821 1.578 1.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -25.572 2.392 0.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -25.334 0.802 0.926 1.00 0.00 H new ATOM 55 N ALA A 4 -20.620 5.844 4.529 1.00 0.00 N ATOM 56 CA ALA A 4 -19.292 6.351 4.854 1.00 0.00 C ATOM 57 C ALA A 4 -18.847 7.380 3.817 1.00 0.00 C ATOM 58 O ALA A 4 -18.310 7.030 2.763 1.00 0.00 O ATOM 59 CB ALA A 4 -18.273 5.217 4.954 1.00 0.00 C ATOM 0 H ALA A 4 -20.771 5.741 3.525 1.00 0.00 H new ATOM 0 HA ALA A 4 -19.347 6.836 5.829 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -17.293 5.628 5.197 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -18.579 4.521 5.735 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -18.219 4.691 4.001 1.00 0.00 H new ATOM 65 N LEU A 5 -19.141 8.642 4.101 1.00 0.00 N ATOM 66 CA LEU A 5 -18.814 9.822 3.303 1.00 0.00 C ATOM 67 C LEU A 5 -18.737 11.024 4.241 1.00 0.00 C ATOM 68 O LEU A 5 -19.212 10.922 5.370 1.00 0.00 O ATOM 69 CB LEU A 5 -19.829 10.032 2.175 1.00 0.00 C ATOM 70 CG LEU A 5 -21.264 10.253 2.691 1.00 0.00 C ATOM 71 CD1 LEU A 5 -21.787 11.608 2.246 1.00 0.00 C ATOM 72 CD2 LEU A 5 -22.193 9.128 2.228 1.00 0.00 C ATOM 0 H LEU A 5 -19.648 8.887 4.951 1.00 0.00 H new ATOM 0 HA LEU A 5 -17.849 9.687 2.814 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -19.527 10.892 1.577 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -19.815 9.165 1.515 1.00 0.00 H new ATOM 0 HG LEU A 5 -21.241 10.237 3.781 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -22.802 11.747 2.619 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -21.144 12.394 2.642 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -21.791 11.657 1.157 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -23.199 9.308 2.606 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -22.214 9.099 1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -21.828 8.174 2.609 1.00 0.00 H new ATOM 84 N LYS A 6 -18.191 12.155 3.778 1.00 0.00 N ATOM 85 CA LYS A 6 -17.985 13.429 4.467 1.00 0.00 C ATOM 86 C LYS A 6 -17.393 13.316 5.877 1.00 0.00 C ATOM 87 O LYS A 6 -17.596 14.202 6.709 1.00 0.00 O ATOM 88 CB LYS A 6 -19.271 14.259 4.417 1.00 0.00 C ATOM 89 CG LYS A 6 -20.374 13.622 5.262 1.00 0.00 C ATOM 90 CD LYS A 6 -21.574 14.541 5.349 1.00 0.00 C ATOM 91 CE LYS A 6 -22.618 13.860 6.240 1.00 0.00 C ATOM 92 NZ LYS A 6 -23.338 14.812 7.103 1.00 0.00 N ATOM 0 H LYS A 6 -17.850 12.202 2.818 1.00 0.00 H new ATOM 0 HA LYS A 6 -17.204 13.958 3.921 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -19.070 15.268 4.778 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -19.608 14.351 3.384 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -20.670 12.668 4.825 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -19.997 13.411 6.263 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -21.287 15.507 5.765 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -21.983 14.731 4.357 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -23.335 13.331 5.613 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -22.126 13.112 6.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -24.031 14.298 7.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -22.660 15.300 7.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -23.832 15.511 6.512 1.00 0.00 H new ATOM 106 N ILE A 7 -16.680 12.227 6.141 1.00 0.00 N ATOM 107 CA ILE A 7 -16.072 11.930 7.427 1.00 0.00 C ATOM 108 C ILE A 7 -14.672 11.340 7.251 1.00 0.00 C ATOM 109 O ILE A 7 -13.748 11.723 7.959 1.00 0.00 O ATOM 110 CB ILE A 7 -17.017 11.018 8.260 1.00 0.00 C ATOM 111 CG1 ILE A 7 -17.553 9.759 7.518 1.00 0.00 C ATOM 112 CG2 ILE A 7 -18.218 11.814 8.807 1.00 0.00 C ATOM 113 CD1 ILE A 7 -16.949 8.444 8.042 1.00 0.00 C ATOM 0 H ILE A 7 -16.505 11.505 5.442 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.939 12.856 7.987 1.00 0.00 H new ATOM 0 HB ILE A 7 -16.382 10.656 9.069 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -18.637 9.719 7.620 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -17.336 9.852 6.454 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -18.861 11.151 9.385 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -17.859 12.620 9.447 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.784 12.235 7.976 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -17.364 7.605 7.483 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -15.867 8.465 7.915 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -17.188 8.330 9.099 1.00 0.00 H new ATOM 125 N ASP A 8 -14.503 10.420 6.303 1.00 0.00 N ATOM 126 CA ASP A 8 -13.233 9.773 5.993 1.00 0.00 C ATOM 127 C ASP A 8 -12.512 10.664 4.978 1.00 0.00 C ATOM 128 O ASP A 8 -13.046 10.919 3.891 1.00 0.00 O ATOM 129 CB ASP A 8 -13.479 8.374 5.396 1.00 0.00 C ATOM 130 CG ASP A 8 -13.885 7.334 6.439 1.00 0.00 C ATOM 131 OD1 ASP A 8 -14.895 6.624 6.240 1.00 0.00 O ATOM 132 OD2 ASP A 8 -13.194 7.226 7.477 1.00 0.00 O ATOM 0 H ASP A 8 -15.269 10.096 5.713 1.00 0.00 H new ATOM 0 HA ASP A 8 -12.632 9.647 6.893 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -14.260 8.442 4.638 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -12.573 8.038 4.891 1.00 0.00 H new ATOM 137 N THR A 9 -11.320 11.153 5.305 1.00 0.00 N ATOM 138 CA THR A 9 -10.495 12.016 4.455 1.00 0.00 C ATOM 139 C THR A 9 -9.206 11.279 4.085 1.00 0.00 C ATOM 140 O THR A 9 -8.877 10.262 4.712 1.00 0.00 O ATOM 141 CB THR A 9 -10.176 13.353 5.174 1.00 0.00 C ATOM 142 OG1 THR A 9 -10.467 13.267 6.555 1.00 0.00 O ATOM 143 CG2 THR A 9 -11.071 14.477 4.642 1.00 0.00 C ATOM 0 H THR A 9 -10.882 10.953 6.204 1.00 0.00 H new ATOM 0 HA THR A 9 -11.046 12.253 3.545 1.00 0.00 H new ATOM 0 HB THR A 9 -9.119 13.554 4.998 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.256 14.121 6.987 1.00 0.00 H new ATOM 0 HG21 THR A 9 -10.833 15.407 5.158 1.00 0.00 H new ATOM 0 HG22 THR A 9 -10.901 14.602 3.573 1.00 0.00 H new ATOM 0 HG23 THR A 9 -12.117 14.223 4.816 1.00 0.00 H new ATOM 151 N PRO A 10 -8.495 11.731 3.043 1.00 0.00 N ATOM 152 CA PRO A 10 -7.245 11.128 2.629 1.00 0.00 C ATOM 153 C PRO A 10 -6.131 11.650 3.545 1.00 0.00 C ATOM 154 O PRO A 10 -6.237 12.749 4.107 1.00 0.00 O ATOM 155 CB PRO A 10 -7.059 11.612 1.187 1.00 0.00 C ATOM 156 CG PRO A 10 -7.644 13.022 1.210 1.00 0.00 C ATOM 157 CD PRO A 10 -8.787 12.899 2.218 1.00 0.00 C ATOM 0 HA PRO A 10 -7.229 10.040 2.688 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -6.008 11.617 0.897 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -7.582 10.971 0.477 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -6.906 13.761 1.523 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -8.003 13.327 0.227 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -8.861 13.797 2.831 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -9.743 12.783 1.707 1.00 0.00 H new ATOM 165 N GLN A 11 -5.080 10.848 3.714 1.00 0.00 N ATOM 166 CA GLN A 11 -3.926 11.206 4.516 1.00 0.00 C ATOM 167 C GLN A 11 -2.702 10.863 3.693 1.00 0.00 C ATOM 168 O GLN A 11 -2.570 9.730 3.238 1.00 0.00 O ATOM 169 CB GLN A 11 -3.897 10.583 5.924 1.00 0.00 C ATOM 170 CG GLN A 11 -4.317 9.113 6.072 1.00 0.00 C ATOM 171 CD GLN A 11 -5.797 9.012 6.392 1.00 0.00 C ATOM 172 OE1 GLN A 11 -6.212 9.197 7.533 1.00 0.00 O ATOM 173 NE2 GLN A 11 -6.622 8.761 5.400 1.00 0.00 N ATOM 0 H GLN A 11 -5.012 9.923 3.290 1.00 0.00 H new ATOM 0 HA GLN A 11 -3.964 12.273 4.737 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -2.883 10.681 6.311 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -4.543 11.181 6.567 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -4.101 8.572 5.151 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -3.735 8.640 6.863 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -6.258 8.610 4.459 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -7.627 8.717 5.571 1.00 0.00 H new ATOM 182 N GLN A 12 -1.823 11.835 3.468 1.00 0.00 N ATOM 183 CA GLN A 12 -0.611 11.672 2.692 1.00 0.00 C ATOM 184 C GLN A 12 0.577 12.016 3.594 1.00 0.00 C ATOM 185 O GLN A 12 0.549 13.034 4.290 1.00 0.00 O ATOM 186 CB GLN A 12 -0.625 12.543 1.414 1.00 0.00 C ATOM 187 CG GLN A 12 -1.897 12.399 0.558 1.00 0.00 C ATOM 188 CD GLN A 12 -3.015 13.360 0.955 1.00 0.00 C ATOM 189 OE1 GLN A 12 -3.917 12.993 1.692 1.00 0.00 O ATOM 190 NE2 GLN A 12 -2.987 14.596 0.490 1.00 0.00 N ATOM 0 H GLN A 12 -1.943 12.780 3.832 1.00 0.00 H new ATOM 0 HA GLN A 12 -0.531 10.640 2.350 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -0.511 13.588 1.701 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.240 12.284 0.803 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -1.641 12.566 -0.488 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -2.264 11.376 0.637 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -2.229 14.893 -0.125 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -3.723 15.254 0.746 1.00 0.00 H new ATOM 199 N GLY A 13 1.628 11.202 3.606 1.00 0.00 N ATOM 200 CA GLY A 13 2.813 11.445 4.419 1.00 0.00 C ATOM 201 C GLY A 13 3.918 10.468 4.045 1.00 0.00 C ATOM 202 O GLY A 13 4.148 10.324 2.849 1.00 0.00 O ATOM 0 H GLY A 13 1.681 10.350 3.048 1.00 0.00 H new ATOM 0 HA2 GLY A 13 3.158 12.469 4.274 1.00 0.00 H new ATOM 0 HA3 GLY A 13 2.566 11.339 5.475 1.00 0.00 H new ATOM 206 N SER A 14 4.597 9.765 4.957 1.00 0.00 N ATOM 207 CA SER A 14 5.666 8.862 4.544 1.00 0.00 C ATOM 208 C SER A 14 5.946 7.722 5.513 1.00 0.00 C ATOM 209 O SER A 14 5.202 7.514 6.458 1.00 0.00 O ATOM 210 CB SER A 14 6.898 9.716 4.279 1.00 0.00 C ATOM 211 OG SER A 14 7.203 10.606 5.324 1.00 0.00 O ATOM 0 H SER A 14 4.429 9.804 5.962 1.00 0.00 H new ATOM 0 HA SER A 14 5.350 8.340 3.641 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.753 9.062 4.109 1.00 0.00 H new ATOM 0 HB3 SER A 14 6.745 10.285 3.362 1.00 0.00 H new ATOM 0 HG SER A 14 8.003 11.121 5.092 1.00 0.00 H new ATOM 217 N ILE A 15 7.001 6.946 5.267 1.00 0.00 N ATOM 218 CA ILE A 15 7.409 5.811 6.089 1.00 0.00 C ATOM 219 C ILE A 15 8.943 5.858 6.273 1.00 0.00 C ATOM 220 O ILE A 15 9.523 5.038 6.978 1.00 0.00 O ATOM 221 CB ILE A 15 6.909 4.499 5.428 1.00 0.00 C ATOM 222 CG1 ILE A 15 5.437 4.552 4.961 1.00 0.00 C ATOM 223 CG2 ILE A 15 7.067 3.315 6.390 1.00 0.00 C ATOM 224 CD1 ILE A 15 5.087 3.392 4.022 1.00 0.00 C ATOM 0 H ILE A 15 7.613 7.096 4.465 1.00 0.00 H new ATOM 0 HA ILE A 15 6.963 5.854 7.083 1.00 0.00 H new ATOM 0 HB ILE A 15 7.531 4.372 4.542 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.780 4.525 5.830 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.253 5.498 4.452 1.00 0.00 H new ATOM 0 HG21 ILE A 15 6.711 2.405 5.908 1.00 0.00 H new ATOM 0 HG22 ILE A 15 8.118 3.199 6.654 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.484 3.499 7.293 1.00 0.00 H new ATOM 0 HD11 ILE A 15 4.043 3.471 3.720 1.00 0.00 H new ATOM 0 HD12 ILE A 15 5.724 3.434 3.139 1.00 0.00 H new ATOM 0 HD13 ILE A 15 5.245 2.445 4.539 1.00 0.00 H new ATOM 236 N GLN A 16 9.639 6.821 5.649 1.00 0.00 N ATOM 237 CA GLN A 16 11.089 6.942 5.756 1.00 0.00 C ATOM 238 C GLN A 16 11.550 7.064 7.206 1.00 0.00 C ATOM 239 O GLN A 16 12.504 6.389 7.583 1.00 0.00 O ATOM 240 CB GLN A 16 11.625 8.102 4.900 1.00 0.00 C ATOM 241 CG GLN A 16 10.857 9.424 5.022 1.00 0.00 C ATOM 242 CD GLN A 16 11.595 10.651 4.479 1.00 0.00 C ATOM 243 OE1 GLN A 16 11.225 11.208 3.442 1.00 0.00 O ATOM 244 NE2 GLN A 16 12.668 11.065 5.128 1.00 0.00 N ATOM 0 H GLN A 16 9.208 7.533 5.059 1.00 0.00 H new ATOM 0 HA GLN A 16 11.512 6.018 5.362 1.00 0.00 H new ATOM 0 HB2 GLN A 16 12.665 8.280 5.172 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.617 7.793 3.855 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.908 9.326 4.495 1.00 0.00 H new ATOM 0 HG3 GLN A 16 10.622 9.595 6.072 1.00 0.00 H new ATOM 0 HE21 GLN A 16 12.960 10.593 5.984 1.00 0.00 H new ATOM 0 HE22 GLN A 16 13.205 11.857 4.773 1.00 0.00 H new ATOM 253 N ASP A 17 10.826 7.831 8.018 1.00 0.00 N ATOM 254 CA ASP A 17 11.095 8.109 9.429 1.00 0.00 C ATOM 255 C ASP A 17 11.306 6.881 10.309 1.00 0.00 C ATOM 256 O ASP A 17 11.885 6.981 11.391 1.00 0.00 O ATOM 257 CB ASP A 17 9.934 8.947 9.983 1.00 0.00 C ATOM 258 CG ASP A 17 10.395 10.309 10.474 1.00 0.00 C ATOM 259 OD1 ASP A 17 9.839 10.750 11.506 1.00 0.00 O ATOM 260 OD2 ASP A 17 11.261 10.946 9.832 1.00 0.00 O ATOM 0 H ASP A 17 9.984 8.304 7.689 1.00 0.00 H new ATOM 0 HA ASP A 17 12.046 8.642 9.461 1.00 0.00 H new ATOM 0 HB2 ASP A 17 9.180 9.078 9.207 1.00 0.00 H new ATOM 0 HB3 ASP A 17 9.458 8.409 10.803 1.00 0.00 H new ATOM 265 N ILE A 18 10.845 5.719 9.865 1.00 0.00 N ATOM 266 CA ILE A 18 10.967 4.479 10.596 1.00 0.00 C ATOM 267 C ILE A 18 12.424 4.042 10.760 1.00 0.00 C ATOM 268 O ILE A 18 12.873 3.815 11.883 1.00 0.00 O ATOM 269 CB ILE A 18 10.135 3.412 9.874 1.00 0.00 C ATOM 270 CG1 ILE A 18 8.619 3.731 9.789 1.00 0.00 C ATOM 271 CG2 ILE A 18 10.362 2.063 10.553 1.00 0.00 C ATOM 272 CD1 ILE A 18 7.769 3.476 11.037 1.00 0.00 C ATOM 0 H ILE A 18 10.368 5.617 8.969 1.00 0.00 H new ATOM 0 HA ILE A 18 10.588 4.622 11.608 1.00 0.00 H new ATOM 0 HB ILE A 18 10.479 3.390 8.840 1.00 0.00 H new ATOM 0 HG12 ILE A 18 8.512 4.781 9.518 1.00 0.00 H new ATOM 0 HG13 ILE A 18 8.198 3.146 8.971 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.774 1.297 10.047 1.00 0.00 H new ATOM 0 HG22 ILE A 18 11.419 1.803 10.501 1.00 0.00 H new ATOM 0 HG23 ILE A 18 10.055 2.125 11.597 1.00 0.00 H new ATOM 0 HD11 ILE A 18 6.732 3.743 10.832 1.00 0.00 H new ATOM 0 HD12 ILE A 18 7.825 2.421 11.306 1.00 0.00 H new ATOM 0 HD13 ILE A 18 8.143 4.082 11.862 1.00 0.00 H new ATOM 284 N ASN A 19 13.144 3.846 9.654 1.00 0.00 N ATOM 285 CA ASN A 19 14.545 3.397 9.708 1.00 0.00 C ATOM 286 C ASN A 19 15.392 4.140 8.681 1.00 0.00 C ATOM 287 O ASN A 19 16.425 3.651 8.227 1.00 0.00 O ATOM 288 CB ASN A 19 14.640 1.851 9.591 1.00 0.00 C ATOM 289 CG ASN A 19 15.812 1.302 10.401 1.00 0.00 C ATOM 290 OD1 ASN A 19 16.980 1.436 10.041 1.00 0.00 O ATOM 291 ND2 ASN A 19 15.519 0.658 11.511 1.00 0.00 N ATOM 0 H ASN A 19 12.785 3.989 8.710 1.00 0.00 H new ATOM 0 HA ASN A 19 14.961 3.649 10.684 1.00 0.00 H new ATOM 0 HB2 ASN A 19 13.711 1.400 9.941 1.00 0.00 H new ATOM 0 HB3 ASN A 19 14.756 1.570 8.544 1.00 0.00 H new ATOM 0 HD21 ASN A 19 16.265 0.263 12.084 1.00 0.00 H new ATOM 0 HD22 ASN A 19 14.546 0.554 11.798 1.00 0.00 H new ATOM 298 N HIS A 20 14.950 5.330 8.282 1.00 0.00 N ATOM 299 CA HIS A 20 15.579 6.191 7.282 1.00 0.00 C ATOM 300 C HIS A 20 15.568 5.452 5.927 1.00 0.00 C ATOM 301 O HIS A 20 16.543 5.442 5.171 1.00 0.00 O ATOM 302 CB HIS A 20 16.953 6.700 7.759 1.00 0.00 C ATOM 303 CG HIS A 20 17.282 8.103 7.312 1.00 0.00 C ATOM 304 ND1 HIS A 20 16.991 9.250 8.016 1.00 0.00 N ATOM 305 CD2 HIS A 20 18.019 8.464 6.215 1.00 0.00 C ATOM 306 CE1 HIS A 20 17.570 10.278 7.375 1.00 0.00 C ATOM 307 NE2 HIS A 20 18.215 9.853 6.270 1.00 0.00 N ATOM 0 H HIS A 20 14.100 5.742 8.667 1.00 0.00 H new ATOM 0 HA HIS A 20 15.012 7.111 7.138 1.00 0.00 H new ATOM 0 HB2 HIS A 20 16.984 6.661 8.848 1.00 0.00 H new ATOM 0 HB3 HIS A 20 17.726 6.024 7.393 1.00 0.00 H new ATOM 0 HD2 HIS A 20 18.384 7.799 5.446 1.00 0.00 H new ATOM 0 HE1 HIS A 20 17.525 11.307 7.701 1.00 0.00 H new ATOM 0 HE2 HIS A 20 18.739 10.425 5.608 1.00 0.00 H new ATOM 315 N ARG A 21 14.456 4.760 5.626 1.00 0.00 N ATOM 316 CA ARG A 21 14.275 3.994 4.380 1.00 0.00 C ATOM 317 C ARG A 21 13.254 4.704 3.489 1.00 0.00 C ATOM 318 O ARG A 21 12.058 4.428 3.593 1.00 0.00 O ATOM 319 CB ARG A 21 13.859 2.524 4.642 1.00 0.00 C ATOM 320 CG ARG A 21 14.611 1.782 5.753 1.00 0.00 C ATOM 321 CD ARG A 21 15.785 0.996 5.189 1.00 0.00 C ATOM 322 NE ARG A 21 16.829 0.741 6.212 1.00 0.00 N ATOM 323 CZ ARG A 21 17.887 1.539 6.454 1.00 0.00 C ATOM 324 NH1 ARG A 21 17.969 2.760 5.922 1.00 0.00 N ATOM 325 NH2 ARG A 21 18.894 1.123 7.212 1.00 0.00 N ATOM 0 H ARG A 21 13.648 4.716 6.248 1.00 0.00 H new ATOM 0 HA ARG A 21 15.237 3.952 3.869 1.00 0.00 H new ATOM 0 HB2 ARG A 21 12.796 2.509 4.882 1.00 0.00 H new ATOM 0 HB3 ARG A 21 13.984 1.965 3.715 1.00 0.00 H new ATOM 0 HG2 ARG A 21 14.970 2.497 6.493 1.00 0.00 H new ATOM 0 HG3 ARG A 21 13.930 1.105 6.268 1.00 0.00 H new ATOM 0 HD2 ARG A 21 15.427 0.046 4.792 1.00 0.00 H new ATOM 0 HD3 ARG A 21 16.222 1.546 4.355 1.00 0.00 H new ATOM 0 HE ARG A 21 16.739 -0.104 6.776 1.00 0.00 H new ATOM 0 HH11 ARG A 21 17.222 3.105 5.319 1.00 0.00 H new ATOM 0 HH12 ARG A 21 18.779 3.348 6.118 1.00 0.00 H new ATOM 0 HH21 ARG A 21 18.873 0.188 7.620 1.00 0.00 H new ATOM 0 HH22 ARG A 21 19.689 1.738 7.387 1.00 0.00 H new ATOM 339 N VAL A 22 13.676 5.675 2.680 1.00 0.00 N ATOM 340 CA VAL A 22 12.750 6.373 1.787 1.00 0.00 C ATOM 341 C VAL A 22 12.504 5.445 0.601 1.00 0.00 C ATOM 342 O VAL A 22 13.333 4.582 0.327 1.00 0.00 O ATOM 343 CB VAL A 22 13.339 7.729 1.348 1.00 0.00 C ATOM 344 CG1 VAL A 22 12.423 8.468 0.373 1.00 0.00 C ATOM 345 CG2 VAL A 22 13.709 8.703 2.466 1.00 0.00 C ATOM 0 H VAL A 22 14.643 5.994 2.624 1.00 0.00 H new ATOM 0 HA VAL A 22 11.808 6.600 2.286 1.00 0.00 H new ATOM 0 HB VAL A 22 14.271 7.424 0.871 1.00 0.00 H new ATOM 0 HG11 VAL A 22 12.880 9.417 0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 22 12.274 7.859 -0.519 1.00 0.00 H new ATOM 0 HG13 VAL A 22 11.461 8.656 0.849 1.00 0.00 H new ATOM 0 HG21 VAL A 22 14.112 9.618 2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 22 12.821 8.939 3.052 1.00 0.00 H new ATOM 0 HG23 VAL A 22 14.459 8.247 3.112 1.00 0.00 H new ATOM 355 N TRP A 23 11.368 5.570 -0.079 1.00 0.00 N ATOM 356 CA TRP A 23 11.035 4.759 -1.239 1.00 0.00 C ATOM 357 C TRP A 23 11.188 5.627 -2.488 1.00 0.00 C ATOM 358 O TRP A 23 10.856 6.807 -2.448 1.00 0.00 O ATOM 359 CB TRP A 23 9.598 4.258 -1.128 1.00 0.00 C ATOM 360 CG TRP A 23 9.261 3.303 -0.026 1.00 0.00 C ATOM 361 CD1 TRP A 23 10.116 2.629 0.779 1.00 0.00 C ATOM 362 CD2 TRP A 23 7.929 2.843 0.334 1.00 0.00 C ATOM 363 NE1 TRP A 23 9.397 1.784 1.607 1.00 0.00 N ATOM 364 CE2 TRP A 23 8.043 1.869 1.364 1.00 0.00 C ATOM 365 CE3 TRP A 23 6.641 3.105 -0.173 1.00 0.00 C ATOM 366 CZ2 TRP A 23 6.921 1.201 1.872 1.00 0.00 C ATOM 367 CZ3 TRP A 23 5.507 2.480 0.371 1.00 0.00 C ATOM 368 CH2 TRP A 23 5.649 1.533 1.396 1.00 0.00 C ATOM 0 H TRP A 23 10.645 6.247 0.166 1.00 0.00 H new ATOM 0 HA TRP A 23 11.698 3.896 -1.297 1.00 0.00 H new ATOM 0 HB2 TRP A 23 8.950 5.128 -1.023 1.00 0.00 H new ATOM 0 HB3 TRP A 23 9.339 3.780 -2.073 1.00 0.00 H new ATOM 0 HD1 TRP A 23 11.191 2.734 0.776 1.00 0.00 H new ATOM 0 HE1 TRP A 23 9.817 1.175 2.309 1.00 0.00 H new ATOM 0 HE3 TRP A 23 6.524 3.798 -0.993 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.038 0.436 2.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 4.524 2.729 -0.001 1.00 0.00 H new ATOM 0 HH2 TRP A 23 4.775 1.060 1.818 1.00 0.00 H new ATOM 379 N VAL A 24 11.635 5.053 -3.603 1.00 0.00 N ATOM 380 CA VAL A 24 11.820 5.755 -4.874 1.00 0.00 C ATOM 381 C VAL A 24 11.388 4.810 -5.981 1.00 0.00 C ATOM 382 O VAL A 24 11.728 3.623 -5.920 1.00 0.00 O ATOM 383 CB VAL A 24 13.308 6.109 -5.092 1.00 0.00 C ATOM 384 CG1 VAL A 24 13.523 6.959 -6.352 1.00 0.00 C ATOM 385 CG2 VAL A 24 13.889 6.879 -3.905 1.00 0.00 C ATOM 0 H VAL A 24 11.885 4.065 -3.650 1.00 0.00 H new ATOM 0 HA VAL A 24 11.237 6.676 -4.872 1.00 0.00 H new ATOM 0 HB VAL A 24 13.820 5.153 -5.203 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.584 7.183 -6.463 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.175 6.409 -7.226 1.00 0.00 H new ATOM 0 HG13 VAL A 24 12.963 7.890 -6.263 1.00 0.00 H new ATOM 0 HG21 VAL A 24 14.937 7.109 -4.098 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.334 7.807 -3.766 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.811 6.271 -3.004 1.00 0.00 H new ATOM 395 N LEU A 25 10.589 5.287 -6.941 1.00 0.00 N ATOM 396 CA LEU A 25 10.184 4.430 -8.047 1.00 0.00 C ATOM 397 C LEU A 25 11.439 4.330 -8.928 1.00 0.00 C ATOM 398 O LEU A 25 11.926 5.384 -9.360 1.00 0.00 O ATOM 399 CB LEU A 25 9.011 5.002 -8.861 1.00 0.00 C ATOM 400 CG LEU A 25 8.786 4.154 -10.145 1.00 0.00 C ATOM 401 CD1 LEU A 25 7.321 3.932 -10.482 1.00 0.00 C ATOM 402 CD2 LEU A 25 9.400 4.772 -11.408 1.00 0.00 C ATOM 0 H LEU A 25 10.221 6.238 -6.972 1.00 0.00 H new ATOM 0 HA LEU A 25 9.827 3.468 -7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.105 5.005 -8.255 1.00 0.00 H new ATOM 0 HB3 LEU A 25 9.217 6.038 -9.132 1.00 0.00 H new ATOM 0 HG LEU A 25 9.277 3.215 -9.888 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.243 3.333 -11.389 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.833 3.409 -9.659 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.834 4.894 -10.640 1.00 0.00 H new ATOM 0 HD21 LEU A 25 9.203 4.125 -12.263 1.00 0.00 H new ATOM 0 HD22 LEU A 25 8.958 5.752 -11.585 1.00 0.00 H new ATOM 0 HD23 LEU A 25 10.477 4.879 -11.275 1.00 0.00 H new ATOM 414 N GLN A 26 11.968 3.138 -9.209 1.00 0.00 N ATOM 415 CA GLN A 26 13.146 2.946 -10.051 1.00 0.00 C ATOM 416 C GLN A 26 12.791 1.857 -11.065 1.00 0.00 C ATOM 417 O GLN A 26 12.451 0.757 -10.653 1.00 0.00 O ATOM 418 CB GLN A 26 14.346 2.539 -9.200 1.00 0.00 C ATOM 419 CG GLN A 26 15.666 2.469 -9.983 1.00 0.00 C ATOM 420 CD GLN A 26 16.402 1.164 -9.688 1.00 0.00 C ATOM 421 OE1 GLN A 26 16.163 0.144 -10.322 1.00 0.00 O ATOM 422 NE2 GLN A 26 17.336 1.155 -8.747 1.00 0.00 N ATOM 0 H GLN A 26 11.582 2.265 -8.851 1.00 0.00 H new ATOM 0 HA GLN A 26 13.421 3.868 -10.564 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.457 3.250 -8.382 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.148 1.565 -8.752 1.00 0.00 H new ATOM 0 HG2 GLN A 26 15.465 2.545 -11.052 1.00 0.00 H new ATOM 0 HG3 GLN A 26 16.298 3.316 -9.717 1.00 0.00 H new ATOM 0 HE21 GLN A 26 17.536 2.004 -8.218 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.855 0.299 -8.552 1.00 0.00 H new ATOM 431 N ASP A 27 12.820 2.154 -12.367 1.00 0.00 N ATOM 432 CA ASP A 27 12.499 1.235 -13.473 1.00 0.00 C ATOM 433 C ASP A 27 11.427 0.203 -13.128 1.00 0.00 C ATOM 434 O ASP A 27 11.673 -0.999 -13.009 1.00 0.00 O ATOM 435 CB ASP A 27 13.747 0.577 -14.063 1.00 0.00 C ATOM 436 CG ASP A 27 13.445 -0.206 -15.351 1.00 0.00 C ATOM 437 OD1 ASP A 27 12.401 0.030 -16.007 1.00 0.00 O ATOM 438 OD2 ASP A 27 14.329 -0.981 -15.782 1.00 0.00 O ATOM 0 H ASP A 27 13.079 3.083 -12.699 1.00 0.00 H new ATOM 0 HA ASP A 27 12.064 1.867 -14.247 1.00 0.00 H new ATOM 0 HB2 ASP A 27 14.493 1.343 -14.274 1.00 0.00 H new ATOM 0 HB3 ASP A 27 14.182 -0.097 -13.325 1.00 0.00 H new ATOM 443 N GLN A 28 10.219 0.729 -12.928 1.00 0.00 N ATOM 444 CA GLN A 28 9.011 -0.023 -12.610 1.00 0.00 C ATOM 445 C GLN A 28 9.042 -0.847 -11.307 1.00 0.00 C ATOM 446 O GLN A 28 8.165 -1.692 -11.117 1.00 0.00 O ATOM 447 CB GLN A 28 8.596 -0.855 -13.841 1.00 0.00 C ATOM 448 CG GLN A 28 8.455 0.028 -15.094 1.00 0.00 C ATOM 449 CD GLN A 28 7.425 -0.460 -16.107 1.00 0.00 C ATOM 450 OE1 GLN A 28 6.946 -1.587 -16.078 1.00 0.00 O ATOM 451 NE2 GLN A 28 6.945 0.431 -16.951 1.00 0.00 N ATOM 0 H GLN A 28 10.051 1.733 -12.986 1.00 0.00 H new ATOM 0 HA GLN A 28 8.243 0.716 -12.383 1.00 0.00 H new ATOM 0 HB2 GLN A 28 9.338 -1.632 -14.024 1.00 0.00 H new ATOM 0 HB3 GLN A 28 7.650 -1.358 -13.640 1.00 0.00 H new ATOM 0 HG2 GLN A 28 8.187 1.037 -14.782 1.00 0.00 H new ATOM 0 HG3 GLN A 28 9.425 0.094 -15.586 1.00 0.00 H new ATOM 0 HE21 GLN A 28 7.340 1.371 -16.980 1.00 0.00 H new ATOM 0 HE22 GLN A 28 6.179 0.181 -17.576 1.00 0.00 H new ATOM 460 N THR A 29 9.957 -0.588 -10.370 1.00 0.00 N ATOM 461 CA THR A 29 10.080 -1.288 -9.090 1.00 0.00 C ATOM 462 C THR A 29 10.362 -0.279 -7.971 1.00 0.00 C ATOM 463 O THR A 29 11.273 0.542 -8.105 1.00 0.00 O ATOM 464 CB THR A 29 11.228 -2.299 -9.223 1.00 0.00 C ATOM 465 OG1 THR A 29 10.833 -3.331 -10.108 1.00 0.00 O ATOM 466 CG2 THR A 29 11.640 -2.900 -7.878 1.00 0.00 C ATOM 0 H THR A 29 10.659 0.143 -10.487 1.00 0.00 H new ATOM 0 HA THR A 29 9.156 -1.809 -8.838 1.00 0.00 H new ATOM 0 HB THR A 29 12.096 -1.768 -9.614 1.00 0.00 H new ATOM 0 HG1 THR A 29 11.562 -3.980 -10.200 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.455 -3.608 -8.030 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.970 -2.105 -7.210 1.00 0.00 H new ATOM 0 HG23 THR A 29 10.789 -3.417 -7.434 1.00 0.00 H new ATOM 474 N LEU A 30 9.572 -0.272 -6.887 1.00 0.00 N ATOM 475 CA LEU A 30 9.873 0.678 -5.816 1.00 0.00 C ATOM 476 C LEU A 30 11.049 0.115 -5.035 1.00 0.00 C ATOM 477 O LEU A 30 11.045 -1.062 -4.665 1.00 0.00 O ATOM 478 CB LEU A 30 8.715 0.890 -4.838 1.00 0.00 C ATOM 479 CG LEU A 30 7.742 2.020 -5.203 1.00 0.00 C ATOM 480 CD1 LEU A 30 6.535 1.890 -4.274 1.00 0.00 C ATOM 481 CD2 LEU A 30 8.359 3.417 -5.050 1.00 0.00 C ATOM 0 H LEU A 30 8.765 -0.877 -6.735 1.00 0.00 H new ATOM 0 HA LEU A 30 10.080 1.644 -6.277 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.152 -0.040 -4.761 1.00 0.00 H new ATOM 0 HB3 LEU A 30 9.129 1.095 -3.851 1.00 0.00 H new ATOM 0 HG LEU A 30 7.468 1.921 -6.253 1.00 0.00 H new ATOM 0 HD11 LEU A 30 5.815 2.677 -4.500 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.066 0.917 -4.420 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.861 1.983 -3.238 1.00 0.00 H new ATOM 0 HD21 LEU A 30 7.622 4.172 -5.323 1.00 0.00 H new ATOM 0 HD22 LEU A 30 8.667 3.567 -4.015 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.227 3.505 -5.703 1.00 0.00 H new ATOM 493 N ILE A 31 12.008 0.975 -4.708 1.00 0.00 N ATOM 494 CA ILE A 31 13.195 0.607 -3.952 1.00 0.00 C ATOM 495 C ILE A 31 13.394 1.502 -2.740 1.00 0.00 C ATOM 496 O ILE A 31 13.067 2.687 -2.759 1.00 0.00 O ATOM 497 CB ILE A 31 14.466 0.574 -4.836 1.00 0.00 C ATOM 498 CG1 ILE A 31 14.582 1.573 -6.000 1.00 0.00 C ATOM 499 CG2 ILE A 31 14.662 -0.852 -5.371 1.00 0.00 C ATOM 500 CD1 ILE A 31 15.066 2.922 -5.483 1.00 0.00 C ATOM 0 H ILE A 31 11.980 1.962 -4.966 1.00 0.00 H new ATOM 0 HA ILE A 31 13.027 -0.407 -3.590 1.00 0.00 H new ATOM 0 HB ILE A 31 15.252 0.902 -4.156 1.00 0.00 H new ATOM 0 HG12 ILE A 31 15.275 1.192 -6.750 1.00 0.00 H new ATOM 0 HG13 ILE A 31 13.615 1.688 -6.489 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.555 -0.887 -5.995 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.777 -1.542 -4.535 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.794 -1.141 -5.963 1.00 0.00 H new ATOM 0 HD11 ILE A 31 15.145 3.623 -6.314 1.00 0.00 H new ATOM 0 HD12 ILE A 31 14.357 3.307 -4.750 1.00 0.00 H new ATOM 0 HD13 ILE A 31 16.043 2.803 -5.014 1.00 0.00 H new ATOM 512 N ALA A 32 13.920 0.908 -1.670 1.00 0.00 N ATOM 513 CA ALA A 32 14.217 1.613 -0.439 1.00 0.00 C ATOM 514 C ALA A 32 15.610 2.218 -0.631 1.00 0.00 C ATOM 515 O ALA A 32 16.536 1.492 -1.003 1.00 0.00 O ATOM 516 CB ALA A 32 14.152 0.647 0.747 1.00 0.00 C ATOM 0 H ALA A 32 14.151 -0.085 -1.640 1.00 0.00 H new ATOM 0 HA ALA A 32 13.495 2.400 -0.221 1.00 0.00 H new ATOM 0 HB1 ALA A 32 14.377 1.186 1.668 1.00 0.00 H new ATOM 0 HB2 ALA A 32 13.152 0.218 0.812 1.00 0.00 H new ATOM 0 HB3 ALA A 32 14.881 -0.151 0.607 1.00 0.00 H new ATOM 522 N VAL A 33 15.784 3.523 -0.401 1.00 0.00 N ATOM 523 CA VAL A 33 17.069 4.206 -0.547 1.00 0.00 C ATOM 524 C VAL A 33 17.654 4.453 0.851 1.00 0.00 C ATOM 525 O VAL A 33 17.401 5.503 1.434 1.00 0.00 O ATOM 526 CB VAL A 33 16.962 5.446 -1.476 1.00 0.00 C ATOM 527 CG1 VAL A 33 16.681 4.955 -2.904 1.00 0.00 C ATOM 528 CG2 VAL A 33 15.913 6.514 -1.134 1.00 0.00 C ATOM 0 H VAL A 33 15.027 4.140 -0.105 1.00 0.00 H new ATOM 0 HA VAL A 33 17.790 3.579 -1.072 1.00 0.00 H new ATOM 0 HB VAL A 33 17.918 5.953 -1.345 1.00 0.00 H new ATOM 0 HG11 VAL A 33 16.602 5.811 -3.574 1.00 0.00 H new ATOM 0 HG12 VAL A 33 17.495 4.310 -3.234 1.00 0.00 H new ATOM 0 HG13 VAL A 33 15.746 4.395 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 33 15.957 7.316 -1.870 1.00 0.00 H new ATOM 0 HG22 VAL A 33 14.920 6.065 -1.145 1.00 0.00 H new ATOM 0 HG23 VAL A 33 16.116 6.920 -0.143 1.00 0.00 H new ATOM 538 N PRO A 34 18.445 3.520 1.423 1.00 0.00 N ATOM 539 CA PRO A 34 19.001 3.712 2.754 1.00 0.00 C ATOM 540 C PRO A 34 20.035 4.839 2.806 1.00 0.00 C ATOM 541 O PRO A 34 19.886 5.764 3.600 1.00 0.00 O ATOM 542 CB PRO A 34 19.606 2.360 3.155 1.00 0.00 C ATOM 543 CG PRO A 34 19.959 1.706 1.822 1.00 0.00 C ATOM 544 CD PRO A 34 18.848 2.217 0.903 1.00 0.00 C ATOM 0 HA PRO A 34 18.225 4.024 3.453 1.00 0.00 H new ATOM 0 HB2 PRO A 34 20.488 2.487 3.783 1.00 0.00 H new ATOM 0 HB3 PRO A 34 18.896 1.757 3.720 1.00 0.00 H new ATOM 0 HG2 PRO A 34 20.947 2.005 1.471 1.00 0.00 H new ATOM 0 HG3 PRO A 34 19.961 0.618 1.891 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.203 2.302 -0.124 1.00 0.00 H new ATOM 0 HD3 PRO A 34 18.005 1.526 0.893 1.00 0.00 H new ATOM 552 N ARG A 35 21.080 4.786 1.966 1.00 0.00 N ATOM 553 CA ARG A 35 22.148 5.783 1.944 1.00 0.00 C ATOM 554 C ARG A 35 22.834 5.858 0.578 1.00 0.00 C ATOM 555 O ARG A 35 23.673 5.021 0.248 1.00 0.00 O ATOM 556 CB ARG A 35 23.148 5.461 3.077 1.00 0.00 C ATOM 557 CG ARG A 35 23.755 4.037 3.057 1.00 0.00 C ATOM 558 CD ARG A 35 25.257 4.053 2.752 1.00 0.00 C ATOM 559 NE ARG A 35 25.734 2.762 2.235 1.00 0.00 N ATOM 560 CZ ARG A 35 26.838 2.568 1.509 1.00 0.00 C ATOM 561 NH1 ARG A 35 27.735 3.533 1.319 1.00 0.00 N ATOM 562 NH2 ARG A 35 27.038 1.390 0.946 1.00 0.00 N ATOM 0 H ARG A 35 21.204 4.042 1.279 1.00 0.00 H new ATOM 0 HA ARG A 35 21.720 6.771 2.113 1.00 0.00 H new ATOM 0 HB2 ARG A 35 23.963 6.183 3.032 1.00 0.00 H new ATOM 0 HB3 ARG A 35 22.644 5.607 4.033 1.00 0.00 H new ATOM 0 HG2 ARG A 35 23.587 3.558 4.022 1.00 0.00 H new ATOM 0 HG3 ARG A 35 23.240 3.435 2.308 1.00 0.00 H new ATOM 0 HD2 ARG A 35 25.469 4.835 2.023 1.00 0.00 H new ATOM 0 HD3 ARG A 35 25.807 4.305 3.659 1.00 0.00 H new ATOM 0 HE ARG A 35 25.170 1.940 2.450 1.00 0.00 H new ATOM 0 HH11 ARG A 35 27.589 4.454 1.734 1.00 0.00 H new ATOM 0 HH12 ARG A 35 28.568 3.352 0.759 1.00 0.00 H new ATOM 0 HH21 ARG A 35 26.354 0.643 1.069 1.00 0.00 H new ATOM 0 HH22 ARG A 35 27.877 1.227 0.389 1.00 0.00 H new ATOM 576 N LYS A 36 22.415 6.779 -0.286 1.00 0.00 N ATOM 577 CA LYS A 36 23.004 6.988 -1.607 1.00 0.00 C ATOM 578 C LYS A 36 22.691 8.419 -2.018 1.00 0.00 C ATOM 579 O LYS A 36 21.771 9.039 -1.485 1.00 0.00 O ATOM 580 CB LYS A 36 22.562 5.961 -2.682 1.00 0.00 C ATOM 581 CG LYS A 36 21.062 5.633 -2.776 1.00 0.00 C ATOM 582 CD LYS A 36 20.665 4.403 -1.939 1.00 0.00 C ATOM 583 CE LYS A 36 20.157 3.218 -2.783 1.00 0.00 C ATOM 584 NZ LYS A 36 21.227 2.426 -3.430 1.00 0.00 N ATOM 0 H LYS A 36 21.642 7.413 -0.084 1.00 0.00 H new ATOM 0 HA LYS A 36 24.079 6.825 -1.536 1.00 0.00 H new ATOM 0 HB2 LYS A 36 22.887 6.331 -3.654 1.00 0.00 H new ATOM 0 HB3 LYS A 36 23.099 5.030 -2.499 1.00 0.00 H new ATOM 0 HG2 LYS A 36 20.485 6.495 -2.442 1.00 0.00 H new ATOM 0 HG3 LYS A 36 20.798 5.457 -3.819 1.00 0.00 H new ATOM 0 HD2 LYS A 36 21.526 4.079 -1.355 1.00 0.00 H new ATOM 0 HD3 LYS A 36 19.889 4.692 -1.230 1.00 0.00 H new ATOM 0 HE2 LYS A 36 19.569 2.559 -2.145 1.00 0.00 H new ATOM 0 HE3 LYS A 36 19.486 3.598 -3.554 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 20.802 1.650 -3.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 21.776 3.039 -4.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 21.856 2.032 -2.702 1.00 0.00 H new ATOM 598 N ASP A 37 23.455 8.921 -2.980 1.00 0.00 N ATOM 599 CA ASP A 37 23.309 10.271 -3.512 1.00 0.00 C ATOM 600 C ASP A 37 22.021 10.441 -4.314 1.00 0.00 C ATOM 601 O ASP A 37 21.403 11.504 -4.275 1.00 0.00 O ATOM 602 CB ASP A 37 24.525 10.544 -4.386 1.00 0.00 C ATOM 603 CG ASP A 37 24.395 11.837 -5.179 1.00 0.00 C ATOM 604 OD1 ASP A 37 23.894 11.766 -6.326 1.00 0.00 O ATOM 605 OD2 ASP A 37 24.865 12.861 -4.645 1.00 0.00 O ATOM 0 H ASP A 37 24.207 8.392 -3.421 1.00 0.00 H new ATOM 0 HA ASP A 37 23.247 10.983 -2.689 1.00 0.00 H new ATOM 0 HB2 ASP A 37 25.415 10.594 -3.759 1.00 0.00 H new ATOM 0 HB3 ASP A 37 24.667 9.712 -5.075 1.00 0.00 H new ATOM 610 N ARG A 38 21.596 9.389 -5.023 1.00 0.00 N ATOM 611 CA ARG A 38 20.381 9.402 -5.829 1.00 0.00 C ATOM 612 C ARG A 38 19.155 9.136 -4.960 1.00 0.00 C ATOM 613 O ARG A 38 18.484 8.110 -5.112 1.00 0.00 O ATOM 614 CB ARG A 38 20.505 8.422 -7.011 1.00 0.00 C ATOM 615 CG ARG A 38 19.465 8.754 -8.096 1.00 0.00 C ATOM 616 CD ARG A 38 19.155 7.620 -9.077 1.00 0.00 C ATOM 617 NE ARG A 38 20.342 6.992 -9.681 1.00 0.00 N ATOM 618 CZ ARG A 38 20.317 5.824 -10.337 1.00 0.00 C ATOM 619 NH1 ARG A 38 19.188 5.127 -10.406 1.00 0.00 N ATOM 620 NH2 ARG A 38 21.423 5.332 -10.891 1.00 0.00 N ATOM 0 H ARG A 38 22.094 8.499 -5.050 1.00 0.00 H new ATOM 0 HA ARG A 38 20.247 10.395 -6.259 1.00 0.00 H new ATOM 0 HB2 ARG A 38 21.509 8.476 -7.432 1.00 0.00 H new ATOM 0 HB3 ARG A 38 20.361 7.400 -6.661 1.00 0.00 H new ATOM 0 HG2 ARG A 38 18.538 9.053 -7.607 1.00 0.00 H new ATOM 0 HG3 ARG A 38 19.818 9.615 -8.663 1.00 0.00 H new ATOM 0 HD2 ARG A 38 18.580 6.854 -8.557 1.00 0.00 H new ATOM 0 HD3 ARG A 38 18.521 8.009 -9.874 1.00 0.00 H new ATOM 0 HE ARG A 38 21.236 7.475 -9.595 1.00 0.00 H new ATOM 0 HH11 ARG A 38 18.342 5.481 -9.960 1.00 0.00 H new ATOM 0 HH12 ARG A 38 19.167 4.238 -10.905 1.00 0.00 H new ATOM 0 HH21 ARG A 38 22.301 5.845 -10.818 1.00 0.00 H new ATOM 0 HH22 ARG A 38 21.392 4.442 -11.388 1.00 0.00 H new ATOM 634 N MET A 39 18.944 9.979 -3.963 1.00 0.00 N ATOM 635 CA MET A 39 17.804 9.911 -3.071 1.00 0.00 C ATOM 636 C MET A 39 16.731 10.780 -3.743 1.00 0.00 C ATOM 637 O MET A 39 17.040 11.583 -4.631 1.00 0.00 O ATOM 638 CB MET A 39 18.236 10.364 -1.664 1.00 0.00 C ATOM 639 CG MET A 39 18.171 9.195 -0.670 1.00 0.00 C ATOM 640 SD MET A 39 19.181 9.361 0.829 1.00 0.00 S ATOM 641 CE MET A 39 18.612 10.993 1.381 1.00 0.00 C ATOM 0 H MET A 39 19.578 10.748 -3.748 1.00 0.00 H new ATOM 0 HA MET A 39 17.398 8.911 -2.917 1.00 0.00 H new ATOM 0 HB2 MET A 39 19.251 10.760 -1.700 1.00 0.00 H new ATOM 0 HB3 MET A 39 17.590 11.173 -1.323 1.00 0.00 H new ATOM 0 HG2 MET A 39 17.132 9.058 -0.370 1.00 0.00 H new ATOM 0 HG3 MET A 39 18.475 8.286 -1.189 1.00 0.00 H new ATOM 0 HE1 MET A 39 18.990 11.190 2.384 1.00 0.00 H new ATOM 0 HE2 MET A 39 18.981 11.757 0.697 1.00 0.00 H new ATOM 0 HE3 MET A 39 17.522 11.013 1.394 1.00 0.00 H new ATOM 651 N SER A 40 15.473 10.542 -3.397 1.00 0.00 N ATOM 652 CA SER A 40 14.301 11.229 -3.917 1.00 0.00 C ATOM 653 C SER A 40 13.195 11.042 -2.884 1.00 0.00 C ATOM 654 O SER A 40 12.749 9.910 -2.693 1.00 0.00 O ATOM 655 CB SER A 40 13.865 10.614 -5.256 1.00 0.00 C ATOM 656 OG SER A 40 14.741 10.988 -6.301 1.00 0.00 O ATOM 0 H SER A 40 15.231 9.827 -2.710 1.00 0.00 H new ATOM 0 HA SER A 40 14.516 12.283 -4.090 1.00 0.00 H new ATOM 0 HB2 SER A 40 13.841 9.528 -5.169 1.00 0.00 H new ATOM 0 HB3 SER A 40 12.852 10.937 -5.495 1.00 0.00 H new ATOM 0 HG SER A 40 15.565 11.358 -5.921 1.00 0.00 H new ATOM 662 N PRO A 41 12.776 12.083 -2.153 1.00 0.00 N ATOM 663 CA PRO A 41 11.713 11.926 -1.189 1.00 0.00 C ATOM 664 C PRO A 41 10.417 11.675 -1.956 1.00 0.00 C ATOM 665 O PRO A 41 10.234 12.166 -3.073 1.00 0.00 O ATOM 666 CB PRO A 41 11.693 13.219 -0.381 1.00 0.00 C ATOM 667 CG PRO A 41 12.268 14.261 -1.335 1.00 0.00 C ATOM 668 CD PRO A 41 13.200 13.464 -2.242 1.00 0.00 C ATOM 0 HA PRO A 41 11.846 11.085 -0.509 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.681 13.479 -0.069 1.00 0.00 H new ATOM 0 HB3 PRO A 41 12.294 13.133 0.525 1.00 0.00 H new ATOM 0 HG2 PRO A 41 11.482 14.754 -1.907 1.00 0.00 H new ATOM 0 HG3 PRO A 41 12.807 15.040 -0.796 1.00 0.00 H new ATOM 0 HD2 PRO A 41 13.142 13.822 -3.270 1.00 0.00 H new ATOM 0 HD3 PRO A 41 14.237 13.573 -1.925 1.00 0.00 H new ATOM 676 N VAL A 42 9.519 10.900 -1.362 1.00 0.00 N ATOM 677 CA VAL A 42 8.225 10.579 -1.938 1.00 0.00 C ATOM 678 C VAL A 42 7.210 10.637 -0.800 1.00 0.00 C ATOM 679 O VAL A 42 7.578 10.524 0.376 1.00 0.00 O ATOM 680 CB VAL A 42 8.275 9.206 -2.659 1.00 0.00 C ATOM 681 CG1 VAL A 42 8.165 8.017 -1.688 1.00 0.00 C ATOM 682 CG2 VAL A 42 7.165 9.054 -3.712 1.00 0.00 C ATOM 0 H VAL A 42 9.675 10.470 -0.450 1.00 0.00 H new ATOM 0 HA VAL A 42 7.931 11.291 -2.709 1.00 0.00 H new ATOM 0 HB VAL A 42 9.251 9.190 -3.144 1.00 0.00 H new ATOM 0 HG11 VAL A 42 8.206 7.084 -2.250 1.00 0.00 H new ATOM 0 HG12 VAL A 42 8.991 8.050 -0.978 1.00 0.00 H new ATOM 0 HG13 VAL A 42 7.220 8.074 -1.148 1.00 0.00 H new ATOM 0 HG21 VAL A 42 7.245 8.076 -4.187 1.00 0.00 H new ATOM 0 HG22 VAL A 42 6.191 9.145 -3.230 1.00 0.00 H new ATOM 0 HG23 VAL A 42 7.270 9.833 -4.467 1.00 0.00 H new ATOM 692 N THR A 43 5.944 10.833 -1.151 1.00 0.00 N ATOM 693 CA THR A 43 4.836 10.879 -0.207 1.00 0.00 C ATOM 694 C THR A 43 4.036 9.574 -0.411 1.00 0.00 C ATOM 695 O THR A 43 4.071 8.990 -1.496 1.00 0.00 O ATOM 696 CB THR A 43 3.989 12.156 -0.397 1.00 0.00 C ATOM 697 OG1 THR A 43 4.716 13.262 -0.914 1.00 0.00 O ATOM 698 CG2 THR A 43 3.323 12.626 0.897 1.00 0.00 C ATOM 0 H THR A 43 5.654 10.967 -2.120 1.00 0.00 H new ATOM 0 HA THR A 43 5.185 10.936 0.824 1.00 0.00 H new ATOM 0 HB THR A 43 3.239 11.845 -1.124 1.00 0.00 H new ATOM 0 HG1 THR A 43 4.117 14.032 -1.009 1.00 0.00 H new ATOM 0 HG21 THR A 43 2.742 13.527 0.701 1.00 0.00 H new ATOM 0 HG22 THR A 43 2.664 11.843 1.272 1.00 0.00 H new ATOM 0 HG23 THR A 43 4.088 12.843 1.642 1.00 0.00 H new ATOM 706 N ILE A 44 3.286 9.126 0.593 1.00 0.00 N ATOM 707 CA ILE A 44 2.461 7.922 0.643 1.00 0.00 C ATOM 708 C ILE A 44 1.054 8.384 0.962 1.00 0.00 C ATOM 709 O ILE A 44 0.861 8.950 2.033 1.00 0.00 O ATOM 710 CB ILE A 44 2.950 6.972 1.764 1.00 0.00 C ATOM 711 CG1 ILE A 44 4.434 6.607 1.621 1.00 0.00 C ATOM 712 CG2 ILE A 44 2.068 5.709 1.898 1.00 0.00 C ATOM 713 CD1 ILE A 44 4.797 5.843 0.353 1.00 0.00 C ATOM 0 H ILE A 44 3.236 9.643 1.471 1.00 0.00 H new ATOM 0 HA ILE A 44 2.511 7.381 -0.302 1.00 0.00 H new ATOM 0 HB ILE A 44 2.847 7.533 2.693 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.022 7.524 1.654 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.729 6.009 2.483 1.00 0.00 H new ATOM 0 HG21 ILE A 44 2.455 5.078 2.698 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.045 6.003 2.131 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.082 5.155 0.960 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.867 5.634 0.348 1.00 0.00 H new ATOM 0 HD12 ILE A 44 4.243 4.905 0.323 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.541 6.444 -0.520 1.00 0.00 H new ATOM 725 N ALA A 45 0.117 8.236 0.031 1.00 0.00 N ATOM 726 CA ALA A 45 -1.274 8.623 0.209 1.00 0.00 C ATOM 727 C ALA A 45 -2.060 7.404 0.668 1.00 0.00 C ATOM 728 O ALA A 45 -1.852 6.320 0.126 1.00 0.00 O ATOM 729 CB ALA A 45 -1.813 9.145 -1.119 1.00 0.00 C ATOM 0 H ALA A 45 0.310 7.835 -0.887 1.00 0.00 H new ATOM 0 HA ALA A 45 -1.367 9.409 0.958 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -2.856 9.438 -0.998 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -1.227 10.008 -1.435 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -1.742 8.362 -1.874 1.00 0.00 H new ATOM 735 N LEU A 46 -2.973 7.565 1.621 1.00 0.00 N ATOM 736 CA LEU A 46 -3.808 6.499 2.156 1.00 0.00 C ATOM 737 C LEU A 46 -5.224 7.022 2.310 1.00 0.00 C ATOM 738 O LEU A 46 -5.450 8.087 2.888 1.00 0.00 O ATOM 739 CB LEU A 46 -3.241 5.963 3.485 1.00 0.00 C ATOM 740 CG LEU A 46 -4.195 4.996 4.225 1.00 0.00 C ATOM 741 CD1 LEU A 46 -3.398 3.948 5.007 1.00 0.00 C ATOM 742 CD2 LEU A 46 -5.121 5.685 5.238 1.00 0.00 C ATOM 0 H LEU A 46 -3.156 8.470 2.055 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.817 5.655 1.466 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.300 5.450 3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -3.014 6.805 4.138 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.803 4.552 3.437 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.086 3.277 5.521 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.778 3.374 4.318 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -2.762 4.446 5.739 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -5.758 4.940 5.714 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.521 6.187 5.997 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -5.742 6.418 4.723 1.00 0.00 H new ATOM 754 N ILE A 47 -6.169 6.252 1.790 1.00 0.00 N ATOM 755 CA ILE A 47 -7.601 6.537 1.849 1.00 0.00 C ATOM 756 C ILE A 47 -8.331 5.225 2.082 1.00 0.00 C ATOM 757 O ILE A 47 -8.012 4.184 1.507 1.00 0.00 O ATOM 758 CB ILE A 47 -8.153 7.296 0.610 1.00 0.00 C ATOM 759 CG1 ILE A 47 -7.089 8.113 -0.154 1.00 0.00 C ATOM 760 CG2 ILE A 47 -9.315 8.193 1.083 1.00 0.00 C ATOM 761 CD1 ILE A 47 -7.627 8.764 -1.430 1.00 0.00 C ATOM 0 H ILE A 47 -5.957 5.383 1.299 1.00 0.00 H new ATOM 0 HA ILE A 47 -7.775 7.226 2.676 1.00 0.00 H new ATOM 0 HB ILE A 47 -8.498 6.557 -0.113 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.695 8.889 0.503 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.255 7.460 -0.411 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -9.723 8.739 0.232 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -10.096 7.574 1.525 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -8.949 8.901 1.827 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -6.828 9.323 -1.918 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -7.995 7.992 -2.105 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.442 9.442 -1.177 1.00 0.00 H new ATOM 773 N SER A 48 -9.280 5.267 3.003 1.00 0.00 N ATOM 774 CA SER A 48 -10.101 4.135 3.353 1.00 0.00 C ATOM 775 C SER A 48 -10.991 3.776 2.151 1.00 0.00 C ATOM 776 O SER A 48 -11.196 4.597 1.254 1.00 0.00 O ATOM 777 CB SER A 48 -10.844 4.472 4.641 1.00 0.00 C ATOM 778 OG SER A 48 -11.419 5.765 4.680 1.00 0.00 O ATOM 0 H SER A 48 -9.500 6.109 3.535 1.00 0.00 H new ATOM 0 HA SER A 48 -9.523 3.235 3.562 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.633 3.735 4.791 1.00 0.00 H new ATOM 0 HB3 SER A 48 -10.153 4.373 5.478 1.00 0.00 H new ATOM 0 HG SER A 48 -11.589 6.020 5.611 1.00 0.00 H new ATOM 784 N CYS A 49 -11.494 2.542 2.087 1.00 0.00 N ATOM 785 CA CYS A 49 -12.318 2.136 0.959 1.00 0.00 C ATOM 786 C CYS A 49 -13.669 2.843 0.943 1.00 0.00 C ATOM 787 O CYS A 49 -14.397 2.878 1.943 1.00 0.00 O ATOM 788 CB CYS A 49 -12.677 0.655 1.007 1.00 0.00 C ATOM 789 SG CYS A 49 -11.427 -0.397 0.264 1.00 0.00 S ATOM 0 H CYS A 49 -11.346 1.821 2.793 1.00 0.00 H new ATOM 0 HA CYS A 49 -11.711 2.386 0.089 1.00 0.00 H new ATOM 0 HB2 CYS A 49 -12.824 0.356 2.045 1.00 0.00 H new ATOM 0 HB3 CYS A 49 -13.626 0.500 0.493 1.00 0.00 H new ATOM 0 HG CYS A 49 -10.787 0.269 -0.651 1.00 0.00 H new ATOM 795 N ARG A 50 -14.091 3.287 -0.239 1.00 0.00 N ATOM 796 CA ARG A 50 -15.381 3.948 -0.379 1.00 0.00 C ATOM 797 C ARG A 50 -16.508 2.982 -0.665 1.00 0.00 C ATOM 798 O ARG A 50 -17.610 3.242 -0.180 1.00 0.00 O ATOM 799 CB ARG A 50 -15.351 5.048 -1.420 1.00 0.00 C ATOM 800 CG ARG A 50 -15.661 6.428 -0.826 1.00 0.00 C ATOM 801 CD ARG A 50 -16.811 7.142 -1.512 1.00 0.00 C ATOM 802 NE ARG A 50 -18.107 6.530 -1.194 1.00 0.00 N ATOM 803 CZ ARG A 50 -18.988 6.087 -2.094 1.00 0.00 C ATOM 804 NH1 ARG A 50 -18.838 6.376 -3.384 1.00 0.00 N ATOM 805 NH2 ARG A 50 -19.988 5.325 -1.684 1.00 0.00 N ATOM 0 H ARG A 50 -13.561 3.201 -1.106 1.00 0.00 H new ATOM 0 HA ARG A 50 -15.580 4.404 0.591 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -14.368 5.071 -1.891 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -16.075 4.822 -2.203 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -15.895 6.314 0.232 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.768 7.050 -0.890 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -16.820 8.189 -1.209 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -16.657 7.124 -2.591 1.00 0.00 H new ATOM 0 HE ARG A 50 -18.354 6.436 -0.209 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -18.046 6.940 -3.692 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -19.515 6.034 -4.065 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -20.075 5.086 -0.696 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -20.672 4.976 -2.356 1.00 0.00 H new ATOM 819 N HIS A 51 -16.261 1.860 -1.339 1.00 0.00 N ATOM 820 CA HIS A 51 -17.320 0.915 -1.662 1.00 0.00 C ATOM 821 C HIS A 51 -17.006 -0.466 -1.094 1.00 0.00 C ATOM 822 O HIS A 51 -16.688 -1.408 -1.821 1.00 0.00 O ATOM 823 CB HIS A 51 -17.617 0.941 -3.173 1.00 0.00 C ATOM 824 CG HIS A 51 -18.891 0.233 -3.572 1.00 0.00 C ATOM 825 ND1 HIS A 51 -20.068 0.207 -2.853 1.00 0.00 N ATOM 826 CD2 HIS A 51 -19.117 -0.419 -4.756 1.00 0.00 C ATOM 827 CE1 HIS A 51 -20.973 -0.472 -3.578 1.00 0.00 C ATOM 828 NE2 HIS A 51 -20.445 -0.864 -4.746 1.00 0.00 N ATOM 0 H HIS A 51 -15.336 1.586 -1.670 1.00 0.00 H new ATOM 0 HA HIS A 51 -18.249 1.215 -1.177 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -17.674 1.979 -3.502 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -16.781 0.485 -3.703 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -18.401 -0.563 -5.552 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -21.986 -0.674 -3.263 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -20.918 -1.385 -5.484 1.00 0.00 H new ATOM 836 N VAL A 52 -17.066 -0.585 0.233 1.00 0.00 N ATOM 837 CA VAL A 52 -16.819 -1.848 0.934 1.00 0.00 C ATOM 838 C VAL A 52 -18.044 -2.760 0.867 1.00 0.00 C ATOM 839 O VAL A 52 -17.960 -3.940 1.182 1.00 0.00 O ATOM 840 CB VAL A 52 -16.419 -1.598 2.406 1.00 0.00 C ATOM 841 CG1 VAL A 52 -15.126 -0.795 2.484 1.00 0.00 C ATOM 842 CG2 VAL A 52 -17.487 -0.860 3.228 1.00 0.00 C ATOM 0 H VAL A 52 -17.288 0.193 0.854 1.00 0.00 H new ATOM 0 HA VAL A 52 -15.989 -2.346 0.432 1.00 0.00 H new ATOM 0 HB VAL A 52 -16.295 -2.592 2.836 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -14.863 -0.630 3.529 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -14.325 -1.346 1.990 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -15.264 0.166 1.989 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -17.130 -0.723 4.249 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -17.683 0.114 2.779 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -18.406 -1.446 3.240 1.00 0.00 H new ATOM 852 N GLU A 53 -19.175 -2.229 0.413 1.00 0.00 N ATOM 853 CA GLU A 53 -20.455 -2.900 0.288 1.00 0.00 C ATOM 854 C GLU A 53 -20.412 -4.187 -0.540 1.00 0.00 C ATOM 855 O GLU A 53 -21.149 -5.117 -0.229 1.00 0.00 O ATOM 856 CB GLU A 53 -21.395 -1.861 -0.334 1.00 0.00 C ATOM 857 CG GLU A 53 -22.888 -2.060 -0.093 1.00 0.00 C ATOM 858 CD GLU A 53 -23.633 -0.721 -0.037 1.00 0.00 C ATOM 859 OE1 GLU A 53 -23.192 0.295 -0.634 1.00 0.00 O ATOM 860 OE2 GLU A 53 -24.640 -0.670 0.699 1.00 0.00 O ATOM 0 H GLU A 53 -19.220 -1.258 0.105 1.00 0.00 H new ATOM 0 HA GLU A 53 -20.793 -3.241 1.267 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -21.116 -0.878 0.047 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -21.223 -1.847 -1.410 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.307 -2.677 -0.888 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -23.038 -2.600 0.842 1.00 0.00 H new ATOM 867 N THR A 54 -19.551 -4.272 -1.553 1.00 0.00 N ATOM 868 CA THR A 54 -19.417 -5.444 -2.414 1.00 0.00 C ATOM 869 C THR A 54 -18.144 -6.231 -2.057 1.00 0.00 C ATOM 870 O THR A 54 -17.762 -7.145 -2.784 1.00 0.00 O ATOM 871 CB THR A 54 -19.521 -4.941 -3.870 1.00 0.00 C ATOM 872 OG1 THR A 54 -19.922 -5.906 -4.818 1.00 0.00 O ATOM 873 CG2 THR A 54 -18.242 -4.271 -4.360 1.00 0.00 C ATOM 0 H THR A 54 -18.916 -3.514 -1.802 1.00 0.00 H new ATOM 0 HA THR A 54 -20.211 -6.177 -2.270 1.00 0.00 H new ATOM 0 HB THR A 54 -20.323 -4.206 -3.805 1.00 0.00 H new ATOM 0 HG1 THR A 54 -19.960 -5.495 -5.707 1.00 0.00 H new ATOM 0 HG21 THR A 54 -18.377 -3.939 -5.389 1.00 0.00 H new ATOM 0 HG22 THR A 54 -18.016 -3.412 -3.728 1.00 0.00 H new ATOM 0 HG23 THR A 54 -17.418 -4.983 -4.313 1.00 0.00 H new ATOM 881 N LEU A 55 -17.469 -5.884 -0.957 1.00 0.00 N ATOM 882 CA LEU A 55 -16.246 -6.530 -0.498 1.00 0.00 C ATOM 883 C LEU A 55 -16.509 -7.304 0.787 1.00 0.00 C ATOM 884 O LEU A 55 -17.560 -7.186 1.421 1.00 0.00 O ATOM 885 CB LEU A 55 -15.159 -5.475 -0.211 1.00 0.00 C ATOM 886 CG LEU A 55 -14.685 -4.696 -1.446 1.00 0.00 C ATOM 887 CD1 LEU A 55 -13.699 -3.604 -1.022 1.00 0.00 C ATOM 888 CD2 LEU A 55 -14.008 -5.636 -2.447 1.00 0.00 C ATOM 0 H LEU A 55 -17.771 -5.124 -0.347 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.910 -7.209 -1.282 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -15.543 -4.767 0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -14.300 -5.971 0.242 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.553 -4.240 -1.923 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -13.365 -3.054 -1.902 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -14.190 -2.919 -0.330 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -12.839 -4.061 -0.532 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -13.679 -5.066 -3.316 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -13.147 -6.110 -1.976 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -14.716 -6.402 -2.763 1.00 0.00 H new ATOM 900 N GLU A 56 -15.523 -8.115 1.137 1.00 0.00 N ATOM 901 CA GLU A 56 -15.465 -8.947 2.329 1.00 0.00 C ATOM 902 C GLU A 56 -14.972 -8.082 3.491 1.00 0.00 C ATOM 903 O GLU A 56 -14.303 -7.067 3.275 1.00 0.00 O ATOM 904 CB GLU A 56 -14.420 -10.050 2.093 1.00 0.00 C ATOM 905 CG GLU A 56 -15.004 -11.238 1.341 1.00 0.00 C ATOM 906 CD GLU A 56 -15.911 -12.044 2.260 1.00 0.00 C ATOM 907 OE1 GLU A 56 -17.152 -11.874 2.155 1.00 0.00 O ATOM 908 OE2 GLU A 56 -15.354 -12.837 3.054 1.00 0.00 O ATOM 0 H GLU A 56 -14.689 -8.216 0.559 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.444 -9.374 2.546 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.582 -9.641 1.529 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.025 -10.386 3.052 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -15.567 -10.889 0.476 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -14.200 -11.871 0.964 1.00 0.00 H new ATOM 915 N LYS A 57 -15.246 -8.524 4.719 1.00 0.00 N ATOM 916 CA LYS A 57 -14.846 -7.867 5.954 1.00 0.00 C ATOM 917 C LYS A 57 -14.247 -8.875 6.939 1.00 0.00 C ATOM 918 O LYS A 57 -13.403 -8.500 7.747 1.00 0.00 O ATOM 919 CB LYS A 57 -16.052 -7.147 6.582 1.00 0.00 C ATOM 920 CG LYS A 57 -16.514 -5.915 5.797 1.00 0.00 C ATOM 921 CD LYS A 57 -17.703 -6.215 4.873 1.00 0.00 C ATOM 922 CE LYS A 57 -18.176 -4.970 4.120 1.00 0.00 C ATOM 923 NZ LYS A 57 -18.529 -3.886 5.059 1.00 0.00 N ATOM 0 H LYS A 57 -15.773 -9.382 4.882 1.00 0.00 H new ATOM 0 HA LYS A 57 -14.078 -7.129 5.721 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -16.882 -7.849 6.660 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -15.794 -6.844 7.597 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -16.792 -5.126 6.496 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -15.683 -5.535 5.202 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -17.419 -6.985 4.156 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -18.527 -6.616 5.463 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -17.392 -4.629 3.444 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -19.041 -5.219 3.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -19.078 -3.158 4.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -19.098 -4.274 5.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -17.660 -3.462 5.442 1.00 0.00 H new ATOM 937 N ASP A 58 -14.594 -10.161 6.840 1.00 0.00 N ATOM 938 CA ASP A 58 -14.138 -11.272 7.693 1.00 0.00 C ATOM 939 C ASP A 58 -12.626 -11.416 7.714 1.00 0.00 C ATOM 940 O ASP A 58 -12.060 -11.915 8.680 1.00 0.00 O ATOM 941 CB ASP A 58 -14.726 -12.600 7.183 1.00 0.00 C ATOM 942 CG ASP A 58 -16.069 -12.905 7.833 1.00 0.00 C ATOM 943 OD1 ASP A 58 -16.081 -13.146 9.058 1.00 0.00 O ATOM 944 OD2 ASP A 58 -17.091 -12.951 7.105 1.00 0.00 O ATOM 0 H ASP A 58 -15.241 -10.478 6.118 1.00 0.00 H new ATOM 0 HA ASP A 58 -14.480 -11.043 8.702 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -14.847 -12.553 6.101 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -14.028 -13.411 7.391 1.00 0.00 H new ATOM 949 N ARG A 59 -11.971 -10.979 6.644 1.00 0.00 N ATOM 950 CA ARG A 59 -10.528 -11.062 6.452 1.00 0.00 C ATOM 951 C ARG A 59 -9.770 -9.789 6.838 1.00 0.00 C ATOM 952 O ARG A 59 -8.543 -9.776 6.748 1.00 0.00 O ATOM 953 CB ARG A 59 -10.304 -11.408 4.974 1.00 0.00 C ATOM 954 CG ARG A 59 -10.988 -12.717 4.524 1.00 0.00 C ATOM 955 CD ARG A 59 -11.545 -12.611 3.098 1.00 0.00 C ATOM 956 NE ARG A 59 -12.512 -13.683 2.819 1.00 0.00 N ATOM 957 CZ ARG A 59 -12.204 -14.945 2.505 1.00 0.00 C ATOM 958 NH1 ARG A 59 -10.940 -15.342 2.368 1.00 0.00 N ATOM 959 NH2 ARG A 59 -13.180 -15.822 2.350 1.00 0.00 N ATOM 0 H ARG A 59 -12.449 -10.541 5.857 1.00 0.00 H new ATOM 0 HA ARG A 59 -10.127 -11.825 7.119 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -10.674 -10.587 4.359 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -9.233 -11.488 4.789 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -10.271 -13.537 4.574 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -11.797 -12.959 5.213 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -12.025 -11.642 2.964 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -10.726 -12.662 2.381 1.00 0.00 H new ATOM 0 HE ARG A 59 -13.502 -13.443 2.869 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -10.179 -14.677 2.503 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -10.733 -16.311 2.128 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -14.150 -15.532 2.470 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -12.963 -16.789 2.110 1.00 0.00 H new ATOM 973 N GLY A 60 -10.478 -8.750 7.275 1.00 0.00 N ATOM 974 CA GLY A 60 -9.959 -7.454 7.666 1.00 0.00 C ATOM 975 C GLY A 60 -10.678 -6.406 6.825 1.00 0.00 C ATOM 976 O GLY A 60 -11.279 -6.714 5.792 1.00 0.00 O ATOM 0 H GLY A 60 -11.492 -8.800 7.369 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -10.128 -7.277 8.728 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -8.882 -7.406 7.502 1.00 0.00 H new ATOM 980 N ASN A 61 -10.652 -5.151 7.267 1.00 0.00 N ATOM 981 CA ASN A 61 -11.301 -4.072 6.532 1.00 0.00 C ATOM 982 C ASN A 61 -10.400 -3.647 5.360 1.00 0.00 C ATOM 983 O ASN A 61 -9.244 -3.292 5.610 1.00 0.00 O ATOM 984 CB ASN A 61 -11.586 -2.882 7.454 1.00 0.00 C ATOM 985 CG ASN A 61 -12.683 -2.023 6.851 1.00 0.00 C ATOM 986 OD1 ASN A 61 -13.850 -2.170 7.199 1.00 0.00 O ATOM 987 ND2 ASN A 61 -12.374 -1.159 5.902 1.00 0.00 N ATOM 0 H ASN A 61 -10.190 -4.858 8.128 1.00 0.00 H new ATOM 0 HA ASN A 61 -12.256 -4.426 6.143 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.888 -3.237 8.440 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -10.681 -2.290 7.592 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -13.107 -0.609 5.454 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -11.402 -1.041 5.617 1.00 0.00 H new ATOM 994 N PRO A 62 -10.866 -3.672 4.097 1.00 0.00 N ATOM 995 CA PRO A 62 -10.065 -3.271 2.939 1.00 0.00 C ATOM 996 C PRO A 62 -9.921 -1.749 2.865 1.00 0.00 C ATOM 997 O PRO A 62 -10.829 -1.026 3.272 1.00 0.00 O ATOM 998 CB PRO A 62 -10.822 -3.824 1.724 1.00 0.00 C ATOM 999 CG PRO A 62 -12.280 -3.806 2.185 1.00 0.00 C ATOM 1000 CD PRO A 62 -12.199 -4.082 3.683 1.00 0.00 C ATOM 0 HA PRO A 62 -9.047 -3.658 2.992 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -10.671 -3.205 0.840 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -10.493 -4.831 1.468 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -12.751 -2.844 1.982 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -12.870 -4.565 1.671 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -12.964 -3.525 4.224 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -12.365 -5.138 3.894 1.00 0.00 H new ATOM 1008 N ILE A 63 -8.826 -1.252 2.284 1.00 0.00 N ATOM 1009 CA ILE A 63 -8.509 0.165 2.090 1.00 0.00 C ATOM 1010 C ILE A 63 -7.724 0.349 0.763 1.00 0.00 C ATOM 1011 O ILE A 63 -7.549 -0.621 0.009 1.00 0.00 O ATOM 1012 CB ILE A 63 -7.789 0.769 3.318 1.00 0.00 C ATOM 1013 CG1 ILE A 63 -6.357 0.229 3.499 1.00 0.00 C ATOM 1014 CG2 ILE A 63 -8.571 0.643 4.640 1.00 0.00 C ATOM 1015 CD1 ILE A 63 -5.405 1.393 3.777 1.00 0.00 C ATOM 0 H ILE A 63 -8.096 -1.862 1.916 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.438 0.729 2.001 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.732 1.832 3.084 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -6.327 -0.484 4.323 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -6.043 -0.306 2.603 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -7.994 1.092 5.448 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -9.527 1.158 4.548 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -8.746 -0.410 4.860 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -4.392 1.012 3.905 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -5.427 2.089 2.939 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.716 1.909 4.685 1.00 0.00 H new ATOM 1027 N TYR A 64 -7.272 1.581 0.490 1.00 0.00 N ATOM 1028 CA TYR A 64 -6.516 2.049 -0.669 1.00 0.00 C ATOM 1029 C TYR A 64 -5.243 2.789 -0.203 1.00 0.00 C ATOM 1030 O TYR A 64 -5.277 3.507 0.804 1.00 0.00 O ATOM 1031 CB TYR A 64 -7.359 3.073 -1.472 1.00 0.00 C ATOM 1032 CG TYR A 64 -8.840 2.857 -1.721 1.00 0.00 C ATOM 1033 CD1 TYR A 64 -9.711 3.962 -1.771 1.00 0.00 C ATOM 1034 CD2 TYR A 64 -9.331 1.583 -2.033 1.00 0.00 C ATOM 1035 CE1 TYR A 64 -11.060 3.789 -2.114 1.00 0.00 C ATOM 1036 CE2 TYR A 64 -10.674 1.401 -2.405 1.00 0.00 C ATOM 1037 CZ TYR A 64 -11.542 2.510 -2.453 1.00 0.00 C ATOM 1038 OH TYR A 64 -12.861 2.354 -2.732 1.00 0.00 O ATOM 0 H TYR A 64 -7.446 2.346 1.142 1.00 0.00 H new ATOM 0 HA TYR A 64 -6.265 1.182 -1.280 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -7.259 4.033 -0.965 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -6.885 3.178 -2.448 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -9.338 4.950 -1.544 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -8.670 0.730 -1.987 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -11.729 4.637 -2.118 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -11.039 0.415 -2.653 1.00 0.00 H new ATOM 0 HH TYR A 64 -13.108 2.937 -3.479 1.00 0.00 H new ATOM 1048 N LEU A 65 -4.111 2.659 -0.905 1.00 0.00 N ATOM 1049 CA LEU A 65 -2.852 3.341 -0.568 1.00 0.00 C ATOM 1050 C LEU A 65 -2.000 3.490 -1.841 1.00 0.00 C ATOM 1051 O LEU A 65 -2.047 2.650 -2.743 1.00 0.00 O ATOM 1052 CB LEU A 65 -2.154 2.632 0.621 1.00 0.00 C ATOM 1053 CG LEU A 65 -0.781 3.167 1.074 1.00 0.00 C ATOM 1054 CD1 LEU A 65 -0.534 2.926 2.566 1.00 0.00 C ATOM 1055 CD2 LEU A 65 0.368 2.443 0.370 1.00 0.00 C ATOM 0 H LEU A 65 -4.041 2.070 -1.735 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.034 4.355 -0.212 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -2.828 2.673 1.477 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -2.034 1.581 0.360 1.00 0.00 H new ATOM 0 HG LEU A 65 -0.805 4.230 0.835 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.445 3.319 2.841 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.304 3.431 3.149 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.566 1.856 2.772 1.00 0.00 H new ATOM 0 HD21 LEU A 65 1.319 2.848 0.715 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.322 1.378 0.599 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.283 2.586 -0.707 1.00 0.00 H new ATOM 1067 N GLY A 66 -1.194 4.551 -1.934 1.00 0.00 N ATOM 1068 CA GLY A 66 -0.360 4.803 -3.103 1.00 0.00 C ATOM 1069 C GLY A 66 0.753 5.792 -2.818 1.00 0.00 C ATOM 1070 O GLY A 66 1.078 6.016 -1.650 1.00 0.00 O ATOM 0 H GLY A 66 -1.104 5.255 -1.201 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.072 3.863 -3.447 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -0.981 5.183 -3.914 1.00 0.00 H new ATOM 1074 N LEU A 67 1.435 6.267 -3.861 1.00 0.00 N ATOM 1075 CA LEU A 67 2.520 7.239 -3.769 1.00 0.00 C ATOM 1076 C LEU A 67 1.956 8.569 -4.260 1.00 0.00 C ATOM 1077 O LEU A 67 1.067 8.608 -5.112 1.00 0.00 O ATOM 1078 CB LEU A 67 3.769 6.888 -4.622 1.00 0.00 C ATOM 1079 CG LEU A 67 4.246 5.437 -4.631 1.00 0.00 C ATOM 1080 CD1 LEU A 67 5.419 5.295 -5.603 1.00 0.00 C ATOM 1081 CD2 LEU A 67 4.701 4.986 -3.238 1.00 0.00 C ATOM 0 H LEU A 67 1.241 5.977 -4.819 1.00 0.00 H new ATOM 0 HA LEU A 67 2.862 7.262 -2.734 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.562 7.178 -5.652 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.595 7.509 -4.276 1.00 0.00 H new ATOM 0 HG LEU A 67 3.410 4.810 -4.942 1.00 0.00 H new ATOM 0 HD11 LEU A 67 5.761 4.260 -5.611 1.00 0.00 H new ATOM 0 HD12 LEU A 67 5.098 5.579 -6.605 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.235 5.945 -5.286 1.00 0.00 H new ATOM 0 HD21 LEU A 67 5.034 3.949 -3.282 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.524 5.617 -2.902 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.869 5.071 -2.538 1.00 0.00 H new ATOM 1093 N ASN A 68 2.475 9.672 -3.734 1.00 0.00 N ATOM 1094 CA ASN A 68 2.059 11.014 -4.122 1.00 0.00 C ATOM 1095 C ASN A 68 3.315 11.668 -4.685 1.00 0.00 C ATOM 1096 O ASN A 68 4.199 12.047 -3.915 1.00 0.00 O ATOM 1097 CB ASN A 68 1.395 11.808 -2.979 1.00 0.00 C ATOM 1098 CG ASN A 68 0.047 12.409 -3.374 1.00 0.00 C ATOM 1099 OD1 ASN A 68 -0.990 11.807 -3.149 1.00 0.00 O ATOM 1100 ND2 ASN A 68 0.024 13.608 -3.928 1.00 0.00 N ATOM 0 H ASN A 68 3.203 9.660 -3.020 1.00 0.00 H new ATOM 0 HA ASN A 68 1.265 10.987 -4.868 1.00 0.00 H new ATOM 0 HB2 ASN A 68 1.256 11.151 -2.121 1.00 0.00 H new ATOM 0 HB3 ASN A 68 2.065 12.608 -2.663 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -0.867 14.040 -4.172 1.00 0.00 H new ATOM 0 HD22 ASN A 68 0.897 14.102 -4.111 1.00 0.00 H new ATOM 1107 N GLY A 69 3.434 11.747 -6.012 1.00 0.00 N ATOM 1108 CA GLY A 69 4.586 12.344 -6.685 1.00 0.00 C ATOM 1109 C GLY A 69 4.535 12.246 -8.212 1.00 0.00 C ATOM 1110 O GLY A 69 5.028 13.158 -8.875 1.00 0.00 O ATOM 0 H GLY A 69 2.725 11.394 -6.655 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.656 13.394 -6.401 1.00 0.00 H new ATOM 0 HA3 GLY A 69 5.494 11.857 -6.330 1.00 0.00 H new ATOM 1114 N LEU A 70 3.931 11.197 -8.792 1.00 0.00 N ATOM 1115 CA LEU A 70 3.856 11.029 -10.256 1.00 0.00 C ATOM 1116 C LEU A 70 2.614 10.242 -10.706 1.00 0.00 C ATOM 1117 O LEU A 70 2.608 9.687 -11.799 1.00 0.00 O ATOM 1118 CB LEU A 70 5.165 10.376 -10.773 1.00 0.00 C ATOM 1119 CG LEU A 70 5.677 10.917 -12.128 1.00 0.00 C ATOM 1120 CD1 LEU A 70 7.205 10.990 -12.120 1.00 0.00 C ATOM 1121 CD2 LEU A 70 5.343 10.035 -13.337 1.00 0.00 C ATOM 0 H LEU A 70 3.484 10.446 -8.267 1.00 0.00 H new ATOM 0 HA LEU A 70 3.751 12.019 -10.699 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.944 10.519 -10.024 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.005 9.302 -10.865 1.00 0.00 H new ATOM 0 HG LEU A 70 5.182 11.883 -12.230 1.00 0.00 H new ATOM 0 HD11 LEU A 70 7.556 11.372 -13.079 1.00 0.00 H new ATOM 0 HD12 LEU A 70 7.533 11.656 -11.322 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.616 9.994 -11.954 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.741 10.493 -14.243 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.789 9.049 -13.203 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.261 9.935 -13.426 1.00 0.00 H new ATOM 1133 N ASN A 71 1.557 10.158 -9.890 1.00 0.00 N ATOM 1134 CA ASN A 71 0.306 9.448 -10.192 1.00 0.00 C ATOM 1135 C ASN A 71 0.648 7.952 -10.281 1.00 0.00 C ATOM 1136 O ASN A 71 0.647 7.327 -11.343 1.00 0.00 O ATOM 1137 CB ASN A 71 -0.400 10.083 -11.423 1.00 0.00 C ATOM 1138 CG ASN A 71 -0.218 11.607 -11.501 1.00 0.00 C ATOM 1139 OD1 ASN A 71 0.461 12.131 -12.383 1.00 0.00 O ATOM 1140 ND2 ASN A 71 -0.683 12.345 -10.506 1.00 0.00 N ATOM 0 H ASN A 71 1.547 10.597 -8.969 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.446 9.547 -9.410 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -0.008 9.629 -12.333 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.464 9.851 -11.384 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -0.478 13.344 -10.473 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.246 11.915 -9.772 1.00 0.00 H new ATOM 1147 N LEU A 72 1.037 7.375 -9.134 1.00 0.00 N ATOM 1148 CA LEU A 72 1.444 5.977 -9.014 1.00 0.00 C ATOM 1149 C LEU A 72 1.009 5.392 -7.679 1.00 0.00 C ATOM 1150 O LEU A 72 1.258 6.001 -6.644 1.00 0.00 O ATOM 1151 CB LEU A 72 2.986 5.823 -9.126 1.00 0.00 C ATOM 1152 CG LEU A 72 3.869 7.044 -9.465 1.00 0.00 C ATOM 1153 CD1 LEU A 72 4.108 7.967 -8.260 1.00 0.00 C ATOM 1154 CD2 LEU A 72 5.238 6.565 -9.940 1.00 0.00 C ATOM 0 H LEU A 72 1.076 7.882 -8.250 1.00 0.00 H new ATOM 0 HA LEU A 72 0.960 5.442 -9.832 1.00 0.00 H new ATOM 0 HB2 LEU A 72 3.340 5.423 -8.176 1.00 0.00 H new ATOM 0 HB3 LEU A 72 3.180 5.064 -9.884 1.00 0.00 H new ATOM 0 HG LEU A 72 3.335 7.603 -10.234 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.735 8.806 -8.563 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.152 8.342 -7.894 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.606 7.409 -7.467 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.862 7.426 -10.179 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.713 5.981 -9.152 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.118 5.945 -10.829 1.00 0.00 H new ATOM 1166 N CYS A 73 0.400 4.206 -7.677 1.00 0.00 N ATOM 1167 CA CYS A 73 -0.048 3.526 -6.464 1.00 0.00 C ATOM 1168 C CYS A 73 0.166 2.019 -6.592 1.00 0.00 C ATOM 1169 O CYS A 73 0.527 1.514 -7.653 1.00 0.00 O ATOM 1170 CB CYS A 73 -1.516 3.834 -6.154 1.00 0.00 C ATOM 1171 SG CYS A 73 -1.922 5.601 -6.262 1.00 0.00 S ATOM 0 H CYS A 73 0.202 3.684 -8.531 1.00 0.00 H new ATOM 0 HA CYS A 73 0.550 3.900 -5.633 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -2.150 3.280 -6.847 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -1.751 3.476 -5.152 1.00 0.00 H new ATOM 0 HG CYS A 73 -1.846 5.989 -7.500 1.00 0.00 H new ATOM 1177 N LEU A 74 -0.101 1.299 -5.506 1.00 0.00 N ATOM 1178 CA LEU A 74 0.046 -0.144 -5.383 1.00 0.00 C ATOM 1179 C LEU A 74 -0.710 -0.923 -6.437 1.00 0.00 C ATOM 1180 O LEU A 74 -1.722 -0.453 -6.960 1.00 0.00 O ATOM 1181 CB LEU A 74 -0.559 -0.591 -4.056 1.00 0.00 C ATOM 1182 CG LEU A 74 0.171 -0.077 -2.823 1.00 0.00 C ATOM 1183 CD1 LEU A 74 -0.774 -0.233 -1.633 1.00 0.00 C ATOM 1184 CD2 LEU A 74 1.405 -0.923 -2.530 1.00 0.00 C ATOM 0 H LEU A 74 -0.442 1.730 -4.647 1.00 0.00 H new ATOM 0 HA LEU A 74 1.114 -0.340 -5.478 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.596 -0.258 -4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.573 -1.681 -4.026 1.00 0.00 H new ATOM 0 HG LEU A 74 0.471 0.957 -2.991 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.283 0.126 -0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -1.680 0.347 -1.809 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.035 -1.284 -1.511 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.910 -0.536 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.105 -1.956 -2.354 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.084 -0.883 -3.381 1.00 0.00 H new ATOM 1196 N MET A 75 -0.281 -2.163 -6.678 1.00 0.00 N ATOM 1197 CA MET A 75 -0.930 -3.021 -7.659 1.00 0.00 C ATOM 1198 C MET A 75 -0.442 -4.450 -7.458 1.00 0.00 C ATOM 1199 O MET A 75 0.719 -4.607 -7.059 1.00 0.00 O ATOM 1200 CB MET A 75 -0.533 -2.498 -9.042 1.00 0.00 C ATOM 1201 CG MET A 75 -1.703 -2.422 -9.999 1.00 0.00 C ATOM 1202 SD MET A 75 -2.266 -3.993 -10.696 1.00 0.00 S ATOM 1203 CE MET A 75 -0.857 -4.420 -11.738 1.00 0.00 C ATOM 0 H MET A 75 0.514 -2.592 -6.205 1.00 0.00 H new ATOM 0 HA MET A 75 -2.015 -3.013 -7.556 1.00 0.00 H new ATOM 0 HB2 MET A 75 -0.090 -1.507 -8.937 1.00 0.00 H new ATOM 0 HB3 MET A 75 0.234 -3.147 -9.464 1.00 0.00 H new ATOM 0 HG2 MET A 75 -2.541 -1.957 -9.480 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.431 -1.760 -10.821 1.00 0.00 H new ATOM 0 HE1 MET A 75 -1.195 -5.031 -12.575 1.00 0.00 H new ATOM 0 HE2 MET A 75 -0.396 -3.508 -12.118 1.00 0.00 H new ATOM 0 HE3 MET A 75 -0.127 -4.979 -11.152 1.00 0.00 H new ATOM 1213 N CYS A 76 -1.254 -5.463 -7.783 1.00 0.00 N ATOM 1214 CA CYS A 76 -0.919 -6.878 -7.626 1.00 0.00 C ATOM 1215 C CYS A 76 -1.030 -7.625 -8.963 1.00 0.00 C ATOM 1216 O CYS A 76 -2.141 -7.778 -9.471 1.00 0.00 O ATOM 1217 CB CYS A 76 -1.892 -7.535 -6.623 1.00 0.00 C ATOM 1218 SG CYS A 76 -2.230 -6.524 -5.152 1.00 0.00 S ATOM 0 H CYS A 76 -2.185 -5.315 -8.172 1.00 0.00 H new ATOM 0 HA CYS A 76 0.107 -6.939 -7.264 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -2.833 -7.746 -7.131 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -1.479 -8.493 -6.306 1.00 0.00 H new ATOM 0 HG CYS A 76 -3.081 -5.589 -5.454 1.00 0.00 H new ATOM 1224 N ALA A 77 0.074 -8.097 -9.551 1.00 0.00 N ATOM 1225 CA ALA A 77 0.062 -8.848 -10.810 1.00 0.00 C ATOM 1226 C ALA A 77 0.907 -10.107 -10.624 1.00 0.00 C ATOM 1227 O ALA A 77 1.916 -10.049 -9.932 1.00 0.00 O ATOM 1228 CB ALA A 77 0.622 -7.982 -11.930 1.00 0.00 C ATOM 0 H ALA A 77 1.008 -7.967 -9.163 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.956 -9.130 -11.078 1.00 0.00 H new ATOM 0 HB1 ALA A 77 0.611 -8.544 -12.864 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.010 -7.086 -12.038 1.00 0.00 H new ATOM 0 HB3 ALA A 77 1.646 -7.695 -11.691 1.00 0.00 H new ATOM 1234 N LYS A 78 0.519 -11.232 -11.221 1.00 0.00 N ATOM 1235 CA LYS A 78 1.207 -12.518 -11.130 1.00 0.00 C ATOM 1236 C LYS A 78 2.181 -12.660 -12.285 1.00 0.00 C ATOM 1237 O LYS A 78 1.745 -12.616 -13.436 1.00 0.00 O ATOM 1238 CB LYS A 78 0.143 -13.629 -11.061 1.00 0.00 C ATOM 1239 CG LYS A 78 0.668 -15.060 -10.876 1.00 0.00 C ATOM 1240 CD LYS A 78 -0.521 -15.965 -10.505 1.00 0.00 C ATOM 1241 CE LYS A 78 -0.171 -17.455 -10.542 1.00 0.00 C ATOM 1242 NZ LYS A 78 -1.363 -18.310 -10.318 1.00 0.00 N ATOM 0 H LYS A 78 -0.317 -11.274 -11.805 1.00 0.00 H new ATOM 0 HA LYS A 78 1.811 -12.593 -10.226 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -0.535 -13.404 -10.238 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -0.447 -13.596 -11.977 1.00 0.00 H new ATOM 0 HG2 LYS A 78 1.142 -15.412 -11.792 1.00 0.00 H new ATOM 0 HG3 LYS A 78 1.426 -15.088 -10.093 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -0.872 -15.704 -9.506 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -1.345 -15.773 -11.192 1.00 0.00 H new ATOM 0 HE2 LYS A 78 0.275 -17.699 -11.506 1.00 0.00 H new ATOM 0 HE3 LYS A 78 0.579 -17.671 -9.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -1.083 -19.311 -10.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -1.774 -18.096 -9.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -2.068 -18.123 -11.059 1.00 0.00 H new ATOM 1256 N VAL A 79 3.464 -12.885 -11.985 1.00 0.00 N ATOM 1257 CA VAL A 79 4.505 -13.027 -13.010 1.00 0.00 C ATOM 1258 C VAL A 79 4.389 -14.324 -13.826 1.00 0.00 C ATOM 1259 O VAL A 79 5.124 -14.496 -14.797 1.00 0.00 O ATOM 1260 CB VAL A 79 5.929 -12.860 -12.409 1.00 0.00 C ATOM 1261 CG1 VAL A 79 6.245 -11.386 -12.126 1.00 0.00 C ATOM 1262 CG2 VAL A 79 6.167 -13.668 -11.124 1.00 0.00 C ATOM 0 H VAL A 79 3.810 -12.974 -11.030 1.00 0.00 H new ATOM 0 HA VAL A 79 4.338 -12.213 -13.715 1.00 0.00 H new ATOM 0 HB VAL A 79 6.598 -13.255 -13.174 1.00 0.00 H new ATOM 0 HG11 VAL A 79 7.248 -11.303 -11.706 1.00 0.00 H new ATOM 0 HG12 VAL A 79 6.192 -10.818 -13.055 1.00 0.00 H new ATOM 0 HG13 VAL A 79 5.520 -10.988 -11.416 1.00 0.00 H new ATOM 0 HG21 VAL A 79 7.183 -13.496 -10.769 1.00 0.00 H new ATOM 0 HG22 VAL A 79 5.458 -13.352 -10.359 1.00 0.00 H new ATOM 0 HG23 VAL A 79 6.029 -14.729 -11.331 1.00 0.00 H new ATOM 1272 N GLY A 80 3.450 -15.212 -13.484 1.00 0.00 N ATOM 1273 CA GLY A 80 3.250 -16.502 -14.148 1.00 0.00 C ATOM 1274 C GLY A 80 3.668 -17.641 -13.218 1.00 0.00 C ATOM 1275 O GLY A 80 3.900 -18.766 -13.655 1.00 0.00 O ATOM 0 H GLY A 80 2.794 -15.049 -12.720 1.00 0.00 H new ATOM 0 HA2 GLY A 80 2.203 -16.617 -14.429 1.00 0.00 H new ATOM 0 HA3 GLY A 80 3.833 -16.541 -15.068 1.00 0.00 H new ATOM 1279 N ASP A 81 3.784 -17.326 -11.927 1.00 0.00 N ATOM 1280 CA ASP A 81 4.188 -18.220 -10.858 1.00 0.00 C ATOM 1281 C ASP A 81 3.528 -17.741 -9.570 1.00 0.00 C ATOM 1282 O ASP A 81 2.633 -18.397 -9.036 1.00 0.00 O ATOM 1283 CB ASP A 81 5.725 -18.179 -10.783 1.00 0.00 C ATOM 1284 CG ASP A 81 6.375 -19.251 -9.905 1.00 0.00 C ATOM 1285 OD1 ASP A 81 7.537 -19.587 -10.241 1.00 0.00 O ATOM 1286 OD2 ASP A 81 5.778 -19.687 -8.894 1.00 0.00 O ATOM 0 H ASP A 81 3.586 -16.385 -11.588 1.00 0.00 H new ATOM 0 HA ASP A 81 3.879 -19.251 -11.027 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.122 -18.273 -11.794 1.00 0.00 H new ATOM 0 HB3 ASP A 81 6.026 -17.199 -10.412 1.00 0.00 H new ATOM 1291 N GLN A 82 3.849 -16.511 -9.163 1.00 0.00 N ATOM 1292 CA GLN A 82 3.368 -15.876 -7.941 1.00 0.00 C ATOM 1293 C GLN A 82 3.068 -14.381 -8.147 1.00 0.00 C ATOM 1294 O GLN A 82 3.519 -13.815 -9.151 1.00 0.00 O ATOM 1295 CB GLN A 82 4.444 -16.107 -6.858 1.00 0.00 C ATOM 1296 CG GLN A 82 5.905 -16.140 -7.354 1.00 0.00 C ATOM 1297 CD GLN A 82 6.893 -16.159 -6.191 1.00 0.00 C ATOM 1298 OE1 GLN A 82 7.435 -17.198 -5.799 1.00 0.00 O ATOM 1299 NE2 GLN A 82 7.119 -15.006 -5.592 1.00 0.00 N ATOM 0 H GLN A 82 4.475 -15.910 -9.698 1.00 0.00 H new ATOM 0 HA GLN A 82 2.420 -16.317 -7.633 1.00 0.00 H new ATOM 0 HB2 GLN A 82 4.353 -15.320 -6.109 1.00 0.00 H new ATOM 0 HB3 GLN A 82 4.230 -17.051 -6.356 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.058 -17.021 -7.977 1.00 0.00 H new ATOM 0 HG3 GLN A 82 6.097 -15.269 -7.981 1.00 0.00 H new ATOM 0 HE21 GLN A 82 6.663 -14.158 -5.929 1.00 0.00 H new ATOM 0 HE22 GLN A 82 7.750 -14.962 -4.792 1.00 0.00 H new ATOM 1308 N PRO A 83 2.276 -13.749 -7.254 1.00 0.00 N ATOM 1309 CA PRO A 83 1.934 -12.337 -7.343 1.00 0.00 C ATOM 1310 C PRO A 83 3.136 -11.471 -6.943 1.00 0.00 C ATOM 1311 O PRO A 83 3.944 -11.854 -6.098 1.00 0.00 O ATOM 1312 CB PRO A 83 0.740 -12.141 -6.406 1.00 0.00 C ATOM 1313 CG PRO A 83 1.009 -13.156 -5.303 1.00 0.00 C ATOM 1314 CD PRO A 83 1.677 -14.315 -6.049 1.00 0.00 C ATOM 0 HA PRO A 83 1.675 -12.035 -8.358 1.00 0.00 H new ATOM 0 HB2 PRO A 83 0.693 -11.124 -6.017 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -0.207 -12.333 -6.911 1.00 0.00 H new ATOM 0 HG2 PRO A 83 1.659 -12.747 -4.529 1.00 0.00 H new ATOM 0 HG3 PRO A 83 0.088 -13.471 -4.812 1.00 0.00 H new ATOM 0 HD2 PRO A 83 2.435 -14.790 -5.426 1.00 0.00 H new ATOM 0 HD3 PRO A 83 0.947 -15.083 -6.304 1.00 0.00 H new ATOM 1322 N THR A 84 3.192 -10.258 -7.485 1.00 0.00 N ATOM 1323 CA THR A 84 4.232 -9.266 -7.267 1.00 0.00 C ATOM 1324 C THR A 84 3.610 -7.855 -7.310 1.00 0.00 C ATOM 1325 O THR A 84 2.508 -7.643 -7.838 1.00 0.00 O ATOM 1326 CB THR A 84 5.332 -9.446 -8.340 1.00 0.00 C ATOM 1327 OG1 THR A 84 4.803 -9.534 -9.642 1.00 0.00 O ATOM 1328 CG2 THR A 84 6.179 -10.704 -8.179 1.00 0.00 C ATOM 0 H THR A 84 2.470 -9.925 -8.124 1.00 0.00 H new ATOM 0 HA THR A 84 4.691 -9.396 -6.287 1.00 0.00 H new ATOM 0 HB THR A 84 5.945 -8.556 -8.195 1.00 0.00 H new ATOM 0 HG1 THR A 84 3.824 -9.548 -9.597 1.00 0.00 H new ATOM 0 HG21 THR A 84 6.923 -10.746 -8.975 1.00 0.00 H new ATOM 0 HG22 THR A 84 6.682 -10.682 -7.212 1.00 0.00 H new ATOM 0 HG23 THR A 84 5.538 -11.584 -8.235 1.00 0.00 H new ATOM 1336 N LEU A 85 4.318 -6.857 -6.774 1.00 0.00 N ATOM 1337 CA LEU A 85 3.906 -5.452 -6.710 1.00 0.00 C ATOM 1338 C LEU A 85 4.127 -4.758 -8.059 1.00 0.00 C ATOM 1339 O LEU A 85 5.127 -5.029 -8.715 1.00 0.00 O ATOM 1340 CB LEU A 85 4.687 -4.782 -5.562 1.00 0.00 C ATOM 1341 CG LEU A 85 3.878 -4.770 -4.250 1.00 0.00 C ATOM 1342 CD1 LEU A 85 4.841 -4.611 -3.074 1.00 0.00 C ATOM 1343 CD2 LEU A 85 2.786 -3.715 -4.123 1.00 0.00 C ATOM 0 H LEU A 85 5.234 -7.013 -6.354 1.00 0.00 H new ATOM 0 HA LEU A 85 2.839 -5.370 -6.505 1.00 0.00 H new ATOM 0 HB2 LEU A 85 5.627 -5.311 -5.405 1.00 0.00 H new ATOM 0 HB3 LEU A 85 4.940 -3.760 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 85 3.349 -5.723 -4.252 1.00 0.00 H new ATOM 0 HD11 LEU A 85 4.277 -4.601 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 85 5.544 -5.444 -3.065 1.00 0.00 H new ATOM 0 HD13 LEU A 85 5.389 -3.674 -3.177 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.294 -3.815 -3.155 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.228 -2.722 -4.204 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.053 -3.852 -4.918 1.00 0.00 H new ATOM 1355 N GLN A 86 3.206 -3.891 -8.504 1.00 0.00 N ATOM 1356 CA GLN A 86 3.333 -3.179 -9.797 1.00 0.00 C ATOM 1357 C GLN A 86 2.951 -1.700 -9.645 1.00 0.00 C ATOM 1358 O GLN A 86 1.948 -1.248 -10.182 1.00 0.00 O ATOM 1359 CB GLN A 86 2.533 -3.929 -10.905 1.00 0.00 C ATOM 1360 CG GLN A 86 3.357 -4.442 -12.097 1.00 0.00 C ATOM 1361 CD GLN A 86 2.474 -4.990 -13.224 1.00 0.00 C ATOM 1362 OE1 GLN A 86 2.408 -6.185 -13.480 1.00 0.00 O ATOM 1363 NE2 GLN A 86 1.744 -4.141 -13.930 1.00 0.00 N ATOM 0 H GLN A 86 2.357 -3.661 -7.988 1.00 0.00 H new ATOM 0 HA GLN A 86 4.375 -3.181 -10.118 1.00 0.00 H new ATOM 0 HB2 GLN A 86 2.025 -4.778 -10.448 1.00 0.00 H new ATOM 0 HB3 GLN A 86 1.760 -3.260 -11.283 1.00 0.00 H new ATOM 0 HG2 GLN A 86 3.975 -3.632 -12.484 1.00 0.00 H new ATOM 0 HG3 GLN A 86 4.035 -5.225 -11.757 1.00 0.00 H new ATOM 0 HE21 GLN A 86 1.787 -3.142 -13.729 1.00 0.00 H new ATOM 0 HE22 GLN A 86 1.138 -4.486 -14.675 1.00 0.00 H new ATOM 1372 N LEU A 87 3.744 -0.928 -8.905 1.00 0.00 N ATOM 1373 CA LEU A 87 3.518 0.474 -8.625 1.00 0.00 C ATOM 1374 C LEU A 87 4.217 1.304 -9.651 1.00 0.00 C ATOM 1375 O LEU A 87 5.439 1.236 -9.754 1.00 0.00 O ATOM 1376 CB LEU A 87 4.009 0.921 -7.232 1.00 0.00 C ATOM 1377 CG LEU A 87 4.483 -0.148 -6.248 1.00 0.00 C ATOM 1378 CD1 LEU A 87 3.443 -1.234 -6.041 1.00 0.00 C ATOM 1379 CD2 LEU A 87 5.847 -0.783 -6.559 1.00 0.00 C ATOM 0 H LEU A 87 4.595 -1.284 -8.470 1.00 0.00 H new ATOM 0 HA LEU A 87 2.437 0.615 -8.650 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.830 1.623 -7.379 1.00 0.00 H new ATOM 0 HB3 LEU A 87 3.199 1.473 -6.756 1.00 0.00 H new ATOM 0 HG LEU A 87 4.623 0.411 -5.323 1.00 0.00 H new ATOM 0 HD11 LEU A 87 3.823 -1.972 -5.334 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.528 -0.791 -5.647 1.00 0.00 H new ATOM 0 HD13 LEU A 87 3.230 -1.720 -6.993 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.084 -1.527 -5.798 1.00 0.00 H new ATOM 0 HD22 LEU A 87 5.810 -1.263 -7.537 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.616 -0.010 -6.563 1.00 0.00 H new ATOM 1391 N LYS A 88 3.437 2.075 -10.385 1.00 0.00 N ATOM 1392 CA LYS A 88 3.963 2.973 -11.412 1.00 0.00 C ATOM 1393 C LYS A 88 2.884 3.781 -12.129 1.00 0.00 C ATOM 1394 O LYS A 88 3.156 4.895 -12.570 1.00 0.00 O ATOM 1395 CB LYS A 88 4.793 2.224 -12.470 1.00 0.00 C ATOM 1396 CG LYS A 88 4.085 1.041 -13.147 1.00 0.00 C ATOM 1397 CD LYS A 88 4.929 -0.234 -13.050 1.00 0.00 C ATOM 1398 CE LYS A 88 4.404 -1.379 -13.920 1.00 0.00 C ATOM 1399 NZ LYS A 88 4.296 -1.049 -15.359 1.00 0.00 N ATOM 0 H LYS A 88 2.422 2.101 -10.291 1.00 0.00 H new ATOM 0 HA LYS A 88 4.601 3.665 -10.862 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.094 2.934 -13.240 1.00 0.00 H new ATOM 0 HB3 LYS A 88 5.705 1.858 -11.999 1.00 0.00 H new ATOM 0 HG2 LYS A 88 3.115 0.876 -12.677 1.00 0.00 H new ATOM 0 HG3 LYS A 88 3.896 1.277 -14.194 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.954 -0.006 -13.343 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.960 -0.562 -12.011 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.063 -2.239 -13.805 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.422 -1.678 -13.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 3.590 -1.669 -15.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 4.003 -0.057 -15.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.219 -1.190 -15.818 1.00 0.00 H new ATOM 1413 N GLU A 89 1.672 3.257 -12.246 1.00 0.00 N ATOM 1414 CA GLU A 89 0.548 3.879 -12.925 1.00 0.00 C ATOM 1415 C GLU A 89 -0.715 3.481 -12.175 1.00 0.00 C ATOM 1416 O GLU A 89 -1.116 2.318 -12.249 1.00 0.00 O ATOM 1417 CB GLU A 89 0.521 3.403 -14.396 1.00 0.00 C ATOM 1418 CG GLU A 89 0.501 1.871 -14.624 1.00 0.00 C ATOM 1419 CD GLU A 89 1.219 1.458 -15.913 1.00 0.00 C ATOM 1420 OE1 GLU A 89 0.812 1.864 -17.018 1.00 0.00 O ATOM 1421 OE2 GLU A 89 2.208 0.689 -15.803 1.00 0.00 O ATOM 0 H GLU A 89 1.437 2.346 -11.852 1.00 0.00 H new ATOM 0 HA GLU A 89 0.628 4.966 -12.935 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -0.358 3.832 -14.878 1.00 0.00 H new ATOM 0 HB3 GLU A 89 1.394 3.813 -14.904 1.00 0.00 H new ATOM 0 HG2 GLU A 89 0.972 1.375 -13.775 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.532 1.526 -14.662 1.00 0.00 H new ATOM 1428 N LYS A 90 -1.283 4.364 -11.348 1.00 0.00 N ATOM 1429 CA LYS A 90 -2.504 4.082 -10.592 1.00 0.00 C ATOM 1430 C LYS A 90 -2.836 5.279 -9.725 1.00 0.00 C ATOM 1431 O LYS A 90 -1.942 6.030 -9.338 1.00 0.00 O ATOM 1432 CB LYS A 90 -2.320 2.866 -9.665 1.00 0.00 C ATOM 1433 CG LYS A 90 -2.972 1.565 -10.159 1.00 0.00 C ATOM 1434 CD LYS A 90 -4.001 1.016 -9.173 1.00 0.00 C ATOM 1435 CE LYS A 90 -5.182 1.950 -8.887 1.00 0.00 C ATOM 1436 NZ LYS A 90 -6.061 2.094 -10.061 1.00 0.00 N ATOM 0 H LYS A 90 -0.906 5.298 -11.184 1.00 0.00 H new ATOM 0 HA LYS A 90 -3.301 3.872 -11.305 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.253 2.690 -9.529 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.730 3.110 -8.685 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.454 1.746 -11.120 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.198 0.816 -10.327 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -4.387 0.073 -9.561 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.498 0.791 -8.232 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -5.758 1.562 -8.047 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -4.807 2.930 -8.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.725 2.879 -9.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.485 2.292 -10.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.595 1.213 -10.205 1.00 0.00 H new ATOM 1450 N ASP A 91 -4.089 5.326 -9.285 1.00 0.00 N ATOM 1451 CA ASP A 91 -4.612 6.384 -8.447 1.00 0.00 C ATOM 1452 C ASP A 91 -5.422 5.786 -7.315 1.00 0.00 C ATOM 1453 O ASP A 91 -5.981 4.696 -7.476 1.00 0.00 O ATOM 1454 CB ASP A 91 -5.524 7.259 -9.313 1.00 0.00 C ATOM 1455 CG ASP A 91 -4.767 8.469 -9.816 1.00 0.00 C ATOM 1456 OD1 ASP A 91 -4.508 8.560 -11.033 1.00 0.00 O ATOM 1457 OD2 ASP A 91 -4.425 9.285 -8.927 1.00 0.00 O ATOM 0 H ASP A 91 -4.780 4.610 -9.510 1.00 0.00 H new ATOM 0 HA ASP A 91 -3.797 6.972 -8.026 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -5.900 6.680 -10.157 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -6.390 7.578 -8.734 1.00 0.00 H new ATOM 1462 N ILE A 92 -5.501 6.502 -6.192 1.00 0.00 N ATOM 1463 CA ILE A 92 -6.266 6.113 -5.005 1.00 0.00 C ATOM 1464 C ILE A 92 -7.553 6.945 -4.946 1.00 0.00 C ATOM 1465 O ILE A 92 -8.620 6.423 -4.626 1.00 0.00 O ATOM 1466 CB ILE A 92 -5.483 6.257 -3.671 1.00 0.00 C ATOM 1467 CG1 ILE A 92 -4.825 7.628 -3.367 1.00 0.00 C ATOM 1468 CG2 ILE A 92 -4.493 5.111 -3.430 1.00 0.00 C ATOM 1469 CD1 ILE A 92 -3.461 7.920 -3.998 1.00 0.00 C ATOM 0 H ILE A 92 -5.021 7.395 -6.080 1.00 0.00 H new ATOM 0 HA ILE A 92 -6.487 5.051 -5.107 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.295 6.194 -2.946 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -5.516 8.409 -3.685 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -4.720 7.717 -2.286 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -3.977 5.269 -2.483 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -5.033 4.165 -3.396 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -3.764 5.084 -4.240 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -3.126 8.913 -3.697 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -2.738 7.176 -3.663 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -3.546 7.879 -5.084 1.00 0.00 H new ATOM 1481 N MET A 93 -7.470 8.231 -5.303 1.00 0.00 N ATOM 1482 CA MET A 93 -8.603 9.134 -5.263 1.00 0.00 C ATOM 1483 C MET A 93 -9.676 8.702 -6.253 1.00 0.00 C ATOM 1484 O MET A 93 -10.847 8.832 -5.936 1.00 0.00 O ATOM 1485 CB MET A 93 -8.137 10.575 -5.489 1.00 0.00 C ATOM 1486 CG MET A 93 -9.048 11.580 -4.789 1.00 0.00 C ATOM 1487 SD MET A 93 -8.680 11.650 -3.020 1.00 0.00 S ATOM 1488 CE MET A 93 -10.159 12.467 -2.402 1.00 0.00 C ATOM 0 H MET A 93 -6.607 8.667 -5.628 1.00 0.00 H new ATOM 0 HA MET A 93 -9.060 9.093 -4.274 1.00 0.00 H new ATOM 0 HB2 MET A 93 -7.118 10.690 -5.120 1.00 0.00 H new ATOM 0 HB3 MET A 93 -8.115 10.787 -6.558 1.00 0.00 H new ATOM 0 HG2 MET A 93 -8.917 12.567 -5.232 1.00 0.00 H new ATOM 0 HG3 MET A 93 -10.091 11.299 -4.938 1.00 0.00 H new ATOM 0 HE1 MET A 93 -10.085 12.584 -1.321 1.00 0.00 H new ATOM 0 HE2 MET A 93 -10.254 13.448 -2.868 1.00 0.00 H new ATOM 0 HE3 MET A 93 -11.035 11.865 -2.643 1.00 0.00 H new ATOM 1498 N ASP A 94 -9.316 8.118 -7.402 1.00 0.00 N ATOM 1499 CA ASP A 94 -10.325 7.679 -8.376 1.00 0.00 C ATOM 1500 C ASP A 94 -11.150 6.522 -7.813 1.00 0.00 C ATOM 1501 O ASP A 94 -12.373 6.507 -7.995 1.00 0.00 O ATOM 1502 CB ASP A 94 -9.688 7.337 -9.723 1.00 0.00 C ATOM 1503 CG ASP A 94 -9.424 8.625 -10.482 1.00 0.00 C ATOM 1504 OD1 ASP A 94 -10.392 9.300 -10.902 1.00 0.00 O ATOM 1505 OD2 ASP A 94 -8.249 9.047 -10.518 1.00 0.00 O ATOM 0 H ASP A 94 -8.350 7.940 -7.678 1.00 0.00 H new ATOM 0 HA ASP A 94 -11.010 8.507 -8.558 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -8.757 6.791 -9.572 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -10.348 6.689 -10.299 1.00 0.00 H new ATOM 1510 N LEU A 95 -10.504 5.574 -7.113 1.00 0.00 N ATOM 1511 CA LEU A 95 -11.196 4.431 -6.495 1.00 0.00 C ATOM 1512 C LEU A 95 -12.126 4.955 -5.400 1.00 0.00 C ATOM 1513 O LEU A 95 -13.168 4.372 -5.133 1.00 0.00 O ATOM 1514 CB LEU A 95 -10.235 3.424 -5.848 1.00 0.00 C ATOM 1515 CG LEU A 95 -9.179 2.801 -6.774 1.00 0.00 C ATOM 1516 CD1 LEU A 95 -8.333 1.846 -5.935 1.00 0.00 C ATOM 1517 CD2 LEU A 95 -9.718 1.973 -7.950 1.00 0.00 C ATOM 0 H LEU A 95 -9.495 5.578 -6.961 1.00 0.00 H new ATOM 0 HA LEU A 95 -11.737 3.918 -7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -9.719 3.922 -5.027 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -10.826 2.619 -5.412 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.640 3.645 -7.204 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.572 1.386 -6.565 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.851 2.399 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -8.971 1.070 -5.512 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.884 1.584 -8.534 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.312 1.143 -7.568 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.341 2.604 -8.584 1.00 0.00 H new ATOM 1529 N TYR A 96 -11.739 6.052 -4.749 1.00 0.00 N ATOM 1530 CA TYR A 96 -12.520 6.700 -3.710 1.00 0.00 C ATOM 1531 C TYR A 96 -13.641 7.541 -4.337 1.00 0.00 C ATOM 1532 O TYR A 96 -14.721 7.699 -3.767 1.00 0.00 O ATOM 1533 CB TYR A 96 -11.580 7.541 -2.829 1.00 0.00 C ATOM 1534 CG TYR A 96 -12.225 7.994 -1.542 1.00 0.00 C ATOM 1535 CD1 TYR A 96 -12.116 7.216 -0.377 1.00 0.00 C ATOM 1536 CD2 TYR A 96 -13.037 9.137 -1.548 1.00 0.00 C ATOM 1537 CE1 TYR A 96 -12.846 7.550 0.779 1.00 0.00 C ATOM 1538 CE2 TYR A 96 -13.811 9.445 -0.424 1.00 0.00 C ATOM 1539 CZ TYR A 96 -13.736 8.648 0.736 1.00 0.00 C ATOM 1540 OH TYR A 96 -14.625 8.881 1.731 1.00 0.00 O ATOM 0 H TYR A 96 -10.853 6.521 -4.938 1.00 0.00 H new ATOM 0 HA TYR A 96 -13.001 5.955 -3.076 1.00 0.00 H new ATOM 0 HB2 TYR A 96 -10.690 6.957 -2.597 1.00 0.00 H new ATOM 0 HB3 TYR A 96 -11.250 8.415 -3.391 1.00 0.00 H new ATOM 0 HD1 TYR A 96 -11.466 6.354 -0.369 1.00 0.00 H new ATOM 0 HD2 TYR A 96 -13.065 9.777 -2.417 1.00 0.00 H new ATOM 0 HE1 TYR A 96 -12.728 6.976 1.686 1.00 0.00 H new ATOM 0 HE2 TYR A 96 -14.471 10.300 -0.445 1.00 0.00 H new ATOM 0 HH TYR A 96 -14.210 9.447 2.415 1.00 0.00 H new ATOM 1550 N ASN A 97 -13.430 8.056 -5.542 1.00 0.00 N ATOM 1551 CA ASN A 97 -14.390 8.886 -6.237 1.00 0.00 C ATOM 1552 C ASN A 97 -15.525 8.093 -6.879 1.00 0.00 C ATOM 1553 O ASN A 97 -16.650 8.586 -6.900 1.00 0.00 O ATOM 1554 CB ASN A 97 -13.653 9.696 -7.302 1.00 0.00 C ATOM 1555 CG ASN A 97 -14.532 10.791 -7.872 1.00 0.00 C ATOM 1556 OD1 ASN A 97 -15.270 11.464 -7.160 1.00 0.00 O ATOM 1557 ND2 ASN A 97 -14.401 11.066 -9.153 1.00 0.00 N ATOM 0 H ASN A 97 -12.570 7.902 -6.068 1.00 0.00 H new ATOM 0 HA ASN A 97 -14.856 9.538 -5.498 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -12.755 10.137 -6.869 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -13.328 9.034 -8.104 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -14.916 11.845 -9.563 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -13.784 10.500 -9.736 1.00 0.00 H new ATOM 1564 N GLN A 98 -15.276 6.868 -7.347 1.00 0.00 N ATOM 1565 CA GLN A 98 -16.292 6.044 -8.010 1.00 0.00 C ATOM 1566 C GLN A 98 -16.424 4.654 -7.358 1.00 0.00 C ATOM 1567 O GLN A 98 -15.579 4.293 -6.543 1.00 0.00 O ATOM 1568 CB GLN A 98 -15.885 5.977 -9.491 1.00 0.00 C ATOM 1569 CG GLN A 98 -14.832 4.895 -9.774 1.00 0.00 C ATOM 1570 CD GLN A 98 -13.966 5.250 -10.969 1.00 0.00 C ATOM 1571 OE1 GLN A 98 -14.194 4.812 -12.089 1.00 0.00 O ATOM 1572 NE2 GLN A 98 -12.925 6.032 -10.745 1.00 0.00 N ATOM 0 H GLN A 98 -14.363 6.418 -7.277 1.00 0.00 H new ATOM 0 HA GLN A 98 -17.285 6.481 -7.910 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -16.770 5.783 -10.097 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -15.494 6.947 -9.799 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -14.202 4.763 -8.895 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -15.330 3.942 -9.956 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -12.748 6.389 -9.806 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -12.298 6.279 -11.511 1.00 0.00 H new ATOM 1581 N PRO A 99 -17.450 3.845 -7.675 1.00 0.00 N ATOM 1582 CA PRO A 99 -17.621 2.511 -7.113 1.00 0.00 C ATOM 1583 C PRO A 99 -16.717 1.513 -7.851 1.00 0.00 C ATOM 1584 O PRO A 99 -17.205 0.631 -8.552 1.00 0.00 O ATOM 1585 CB PRO A 99 -19.112 2.191 -7.278 1.00 0.00 C ATOM 1586 CG PRO A 99 -19.472 2.928 -8.570 1.00 0.00 C ATOM 1587 CD PRO A 99 -18.524 4.131 -8.609 1.00 0.00 C ATOM 0 HA PRO A 99 -17.334 2.450 -6.063 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -19.290 1.119 -7.360 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -19.699 2.547 -6.431 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -19.336 2.288 -9.442 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -20.515 3.246 -8.567 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -18.132 4.283 -9.615 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -19.047 5.045 -8.329 1.00 0.00 H new ATOM 1595 N GLU A 100 -15.399 1.633 -7.693 1.00 0.00 N ATOM 1596 CA GLU A 100 -14.448 0.725 -8.331 1.00 0.00 C ATOM 1597 C GLU A 100 -13.578 0.030 -7.273 1.00 0.00 C ATOM 1598 O GLU A 100 -12.398 0.346 -7.116 1.00 0.00 O ATOM 1599 CB GLU A 100 -13.650 1.413 -9.457 1.00 0.00 C ATOM 1600 CG GLU A 100 -14.325 1.332 -10.840 1.00 0.00 C ATOM 1601 CD GLU A 100 -14.520 -0.119 -11.315 1.00 0.00 C ATOM 1602 OE1 GLU A 100 -15.655 -0.493 -11.695 1.00 0.00 O ATOM 1603 OE2 GLU A 100 -13.571 -0.931 -11.268 1.00 0.00 O ATOM 0 H GLU A 100 -14.963 2.358 -7.123 1.00 0.00 H new ATOM 0 HA GLU A 100 -15.004 -0.064 -8.838 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -13.503 2.461 -9.196 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -12.662 0.958 -9.519 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -15.293 1.831 -10.798 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.720 1.871 -11.569 1.00 0.00 H new ATOM 1610 N PRO A 101 -14.140 -0.925 -6.511 1.00 0.00 N ATOM 1611 CA PRO A 101 -13.419 -1.687 -5.506 1.00 0.00 C ATOM 1612 C PRO A 101 -12.610 -2.796 -6.220 1.00 0.00 C ATOM 1613 O PRO A 101 -12.867 -3.989 -6.024 1.00 0.00 O ATOM 1614 CB PRO A 101 -14.532 -2.210 -4.591 1.00 0.00 C ATOM 1615 CG PRO A 101 -15.719 -2.432 -5.517 1.00 0.00 C ATOM 1616 CD PRO A 101 -15.526 -1.368 -6.585 1.00 0.00 C ATOM 0 HA PRO A 101 -12.686 -1.128 -4.923 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -14.236 -3.135 -4.097 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -14.770 -1.492 -3.807 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -15.716 -3.436 -5.942 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -16.667 -2.310 -4.993 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -15.748 -1.771 -7.573 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -16.206 -0.532 -6.421 1.00 0.00 H new ATOM 1624 N VAL A 102 -11.624 -2.411 -7.038 1.00 0.00 N ATOM 1625 CA VAL A 102 -10.775 -3.311 -7.812 1.00 0.00 C ATOM 1626 C VAL A 102 -9.848 -4.029 -6.839 1.00 0.00 C ATOM 1627 O VAL A 102 -8.811 -3.486 -6.461 1.00 0.00 O ATOM 1628 CB VAL A 102 -9.986 -2.539 -8.893 1.00 0.00 C ATOM 1629 CG1 VAL A 102 -9.164 -3.513 -9.751 1.00 0.00 C ATOM 1630 CG2 VAL A 102 -10.865 -1.727 -9.851 1.00 0.00 C ATOM 0 H VAL A 102 -11.391 -1.428 -7.181 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.384 -4.042 -8.344 1.00 0.00 H new ATOM 0 HB VAL A 102 -9.355 -1.845 -8.337 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -8.613 -2.955 -10.508 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.462 -4.053 -9.116 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.833 -4.223 -10.238 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -10.234 -1.216 -10.578 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -11.550 -2.396 -10.372 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -11.436 -0.991 -9.285 1.00 0.00 H new ATOM 1640 N LYS A 103 -10.191 -5.255 -6.434 1.00 0.00 N ATOM 1641 CA LYS A 103 -9.429 -6.077 -5.488 1.00 0.00 C ATOM 1642 C LYS A 103 -7.944 -6.133 -5.834 1.00 0.00 C ATOM 1643 O LYS A 103 -7.112 -6.201 -4.938 1.00 0.00 O ATOM 1644 CB LYS A 103 -10.044 -7.480 -5.388 1.00 0.00 C ATOM 1645 CG LYS A 103 -11.519 -7.411 -4.962 1.00 0.00 C ATOM 1646 CD LYS A 103 -12.118 -8.786 -4.625 1.00 0.00 C ATOM 1647 CE LYS A 103 -13.609 -8.745 -4.989 1.00 0.00 C ATOM 1648 NZ LYS A 103 -14.372 -9.985 -4.735 1.00 0.00 N ATOM 0 H LYS A 103 -11.036 -5.719 -6.767 1.00 0.00 H new ATOM 0 HA LYS A 103 -9.493 -5.603 -4.508 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -9.964 -7.984 -6.351 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -9.482 -8.076 -4.668 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -11.609 -6.760 -4.092 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -12.101 -6.955 -5.763 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -11.609 -9.572 -5.183 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -11.988 -9.011 -3.566 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -14.077 -7.934 -4.431 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -13.698 -8.497 -6.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -15.364 -9.846 -5.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -13.961 -10.765 -5.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -14.329 -10.218 -3.722 1.00 0.00 H new ATOM 1662 N SER A 104 -7.611 -6.036 -7.118 1.00 0.00 N ATOM 1663 CA SER A 104 -6.256 -6.051 -7.644 1.00 0.00 C ATOM 1664 C SER A 104 -5.401 -4.858 -7.171 1.00 0.00 C ATOM 1665 O SER A 104 -4.177 -4.888 -7.315 1.00 0.00 O ATOM 1666 CB SER A 104 -6.432 -6.055 -9.177 1.00 0.00 C ATOM 1667 OG SER A 104 -5.417 -6.669 -9.930 1.00 0.00 O ATOM 0 H SER A 104 -8.314 -5.941 -7.851 1.00 0.00 H new ATOM 0 HA SER A 104 -5.708 -6.921 -7.282 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.374 -6.551 -9.409 1.00 0.00 H new ATOM 0 HB3 SER A 104 -6.525 -5.022 -9.511 1.00 0.00 H new ATOM 0 HG SER A 104 -5.637 -6.612 -10.883 1.00 0.00 H new ATOM 1673 N PHE A 105 -6.016 -3.809 -6.616 1.00 0.00 N ATOM 1674 CA PHE A 105 -5.367 -2.597 -6.122 1.00 0.00 C ATOM 1675 C PHE A 105 -5.772 -2.305 -4.659 1.00 0.00 C ATOM 1676 O PHE A 105 -5.328 -1.298 -4.108 1.00 0.00 O ATOM 1677 CB PHE A 105 -5.809 -1.382 -6.960 1.00 0.00 C ATOM 1678 CG PHE A 105 -6.009 -1.548 -8.456 1.00 0.00 C ATOM 1679 CD1 PHE A 105 -7.013 -0.796 -9.099 1.00 0.00 C ATOM 1680 CD2 PHE A 105 -5.163 -2.366 -9.226 1.00 0.00 C ATOM 1681 CE1 PHE A 105 -7.147 -0.831 -10.498 1.00 0.00 C ATOM 1682 CE2 PHE A 105 -5.330 -2.440 -10.616 1.00 0.00 C ATOM 1683 CZ PHE A 105 -6.292 -1.650 -11.252 1.00 0.00 C ATOM 0 H PHE A 105 -7.028 -3.784 -6.495 1.00 0.00 H new ATOM 0 HA PHE A 105 -4.291 -2.757 -6.192 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -6.748 -1.019 -6.542 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -5.069 -0.595 -6.813 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -7.685 -0.188 -8.512 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.383 -2.938 -8.746 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -7.901 -0.233 -10.988 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -4.713 -3.110 -11.197 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.378 -1.670 -12.328 1.00 0.00 H new ATOM 1693 N LEU A 106 -6.682 -3.089 -4.063 1.00 0.00 N ATOM 1694 CA LEU A 106 -7.185 -2.918 -2.694 1.00 0.00 C ATOM 1695 C LEU A 106 -6.397 -3.800 -1.735 1.00 0.00 C ATOM 1696 O LEU A 106 -5.964 -4.885 -2.132 1.00 0.00 O ATOM 1697 CB LEU A 106 -8.676 -3.303 -2.599 1.00 0.00 C ATOM 1698 CG LEU A 106 -9.715 -2.638 -3.539 1.00 0.00 C ATOM 1699 CD1 LEU A 106 -11.011 -2.525 -2.746 1.00 0.00 C ATOM 1700 CD2 LEU A 106 -9.327 -1.296 -4.158 1.00 0.00 C ATOM 0 H LEU A 106 -7.102 -3.888 -4.539 1.00 0.00 H new ATOM 0 HA LEU A 106 -7.067 -1.868 -2.426 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -8.742 -4.380 -2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -8.995 -3.108 -1.575 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.804 -3.276 -4.418 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -11.778 -2.061 -3.366 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.341 -3.519 -2.444 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -10.843 -1.914 -1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.138 -0.940 -4.793 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -9.140 -0.570 -3.366 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -8.425 -1.419 -4.757 1.00 0.00 H new ATOM 1712 N PHE A 107 -6.290 -3.382 -0.464 1.00 0.00 N ATOM 1713 CA PHE A 107 -5.538 -4.144 0.539 1.00 0.00 C ATOM 1714 C PHE A 107 -6.227 -4.193 1.909 1.00 0.00 C ATOM 1715 O PHE A 107 -6.718 -3.157 2.363 1.00 0.00 O ATOM 1716 CB PHE A 107 -4.131 -3.536 0.707 1.00 0.00 C ATOM 1717 CG PHE A 107 -3.241 -3.599 -0.521 1.00 0.00 C ATOM 1718 CD1 PHE A 107 -3.465 -2.736 -1.614 1.00 0.00 C ATOM 1719 CD2 PHE A 107 -2.194 -4.542 -0.583 1.00 0.00 C ATOM 1720 CE1 PHE A 107 -2.732 -2.904 -2.799 1.00 0.00 C ATOM 1721 CE2 PHE A 107 -1.439 -4.677 -1.759 1.00 0.00 C ATOM 1722 CZ PHE A 107 -1.724 -3.876 -2.872 1.00 0.00 C ATOM 0 H PHE A 107 -6.713 -2.524 -0.110 1.00 0.00 H new ATOM 0 HA PHE A 107 -5.481 -5.168 0.170 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -4.238 -2.493 1.003 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -3.628 -4.050 1.526 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -4.199 -1.947 -1.539 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -1.973 -5.160 0.274 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -2.945 -2.283 -3.657 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -0.637 -5.399 -1.805 1.00 0.00 H new ATOM 0 HZ PHE A 107 -1.167 -4.007 -3.788 1.00 0.00 H new ATOM 1732 N TYR A 108 -6.337 -5.365 2.556 1.00 0.00 N ATOM 1733 CA TYR A 108 -6.945 -5.481 3.890 1.00 0.00 C ATOM 1734 C TYR A 108 -5.921 -5.009 4.918 1.00 0.00 C ATOM 1735 O TYR A 108 -4.740 -5.360 4.827 1.00 0.00 O ATOM 1736 CB TYR A 108 -7.326 -6.917 4.325 1.00 0.00 C ATOM 1737 CG TYR A 108 -8.440 -7.661 3.603 1.00 0.00 C ATOM 1738 CD1 TYR A 108 -9.619 -7.028 3.168 1.00 0.00 C ATOM 1739 CD2 TYR A 108 -8.280 -9.036 3.367 1.00 0.00 C ATOM 1740 CE1 TYR A 108 -10.561 -7.728 2.386 1.00 0.00 C ATOM 1741 CE2 TYR A 108 -9.146 -9.713 2.496 1.00 0.00 C ATOM 1742 CZ TYR A 108 -10.295 -9.066 2.003 1.00 0.00 C ATOM 1743 OH TYR A 108 -11.136 -9.762 1.191 1.00 0.00 O ATOM 0 H TYR A 108 -6.010 -6.252 2.172 1.00 0.00 H new ATOM 0 HA TYR A 108 -7.861 -4.892 3.838 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -6.426 -7.528 4.249 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -7.595 -6.875 5.380 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -9.804 -5.998 3.435 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -7.485 -9.576 3.860 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -11.479 -7.247 2.081 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -8.931 -10.730 2.204 1.00 0.00 H new ATOM 0 HH TYR A 108 -10.778 -10.662 1.044 1.00 0.00 H new ATOM 1753 N HIS A 109 -6.356 -4.226 5.906 1.00 0.00 N ATOM 1754 CA HIS A 109 -5.469 -3.763 6.971 1.00 0.00 C ATOM 1755 C HIS A 109 -5.290 -4.892 8.010 1.00 0.00 C ATOM 1756 O HIS A 109 -6.077 -5.838 8.040 1.00 0.00 O ATOM 1757 CB HIS A 109 -6.031 -2.478 7.612 1.00 0.00 C ATOM 1758 CG HIS A 109 -7.201 -2.630 8.566 1.00 0.00 C ATOM 1759 ND1 HIS A 109 -7.475 -1.787 9.618 1.00 0.00 N ATOM 1760 CD2 HIS A 109 -8.156 -3.610 8.577 1.00 0.00 C ATOM 1761 CE1 HIS A 109 -8.594 -2.221 10.224 1.00 0.00 C ATOM 1762 NE2 HIS A 109 -9.043 -3.344 9.630 1.00 0.00 N ATOM 0 H HIS A 109 -7.319 -3.899 5.990 1.00 0.00 H new ATOM 0 HA HIS A 109 -4.490 -3.518 6.560 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -5.220 -1.986 8.149 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -6.335 -1.806 6.809 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -8.216 -4.444 7.893 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -9.066 -1.738 11.067 1.00 0.00 H new ATOM 0 HE2 HIS A 109 -9.863 -3.891 9.893 1.00 0.00 H new ATOM 1770 N SER A 110 -4.258 -4.796 8.847 1.00 0.00 N ATOM 1771 CA SER A 110 -3.935 -5.724 9.926 1.00 0.00 C ATOM 1772 C SER A 110 -2.994 -4.974 10.872 1.00 0.00 C ATOM 1773 O SER A 110 -2.706 -3.786 10.661 1.00 0.00 O ATOM 1774 CB SER A 110 -3.376 -7.083 9.439 1.00 0.00 C ATOM 1775 OG SER A 110 -3.505 -8.042 10.478 1.00 0.00 O ATOM 0 H SER A 110 -3.590 -4.027 8.786 1.00 0.00 H new ATOM 0 HA SER A 110 -4.843 -6.022 10.450 1.00 0.00 H new ATOM 0 HB2 SER A 110 -3.916 -7.415 8.553 1.00 0.00 H new ATOM 0 HB3 SER A 110 -2.329 -6.978 9.153 1.00 0.00 H new ATOM 0 HG SER A 110 -3.154 -8.904 10.173 1.00 0.00 H new ATOM 1781 N GLN A 111 -2.597 -5.621 11.961 1.00 0.00 N ATOM 1782 CA GLN A 111 -1.718 -5.084 12.979 1.00 0.00 C ATOM 1783 C GLN A 111 -1.042 -6.225 13.715 1.00 0.00 C ATOM 1784 O GLN A 111 -1.568 -7.338 13.765 1.00 0.00 O ATOM 1785 CB GLN A 111 -2.473 -4.136 13.918 1.00 0.00 C ATOM 1786 CG GLN A 111 -3.839 -4.616 14.435 1.00 0.00 C ATOM 1787 CD GLN A 111 -3.808 -5.771 15.437 1.00 0.00 C ATOM 1788 OE1 GLN A 111 -3.391 -5.622 16.580 1.00 0.00 O ATOM 1789 NE2 GLN A 111 -4.371 -6.914 15.082 1.00 0.00 N ATOM 0 H GLN A 111 -2.895 -6.576 12.162 1.00 0.00 H new ATOM 0 HA GLN A 111 -0.940 -4.483 12.509 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -1.836 -3.932 14.779 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -2.620 -3.189 13.399 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -4.347 -3.771 14.900 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -4.443 -4.919 13.580 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -4.718 -7.038 14.131 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -4.458 -7.672 15.759 1.00 0.00 H new ATOM 1798 N SER A 112 0.084 -5.908 14.342 1.00 0.00 N ATOM 1799 CA SER A 112 0.921 -6.845 15.076 1.00 0.00 C ATOM 1800 C SER A 112 1.112 -6.508 16.563 1.00 0.00 C ATOM 1801 O SER A 112 1.869 -7.199 17.251 1.00 0.00 O ATOM 1802 CB SER A 112 2.258 -6.885 14.339 1.00 0.00 C ATOM 1803 OG SER A 112 2.818 -5.585 14.385 1.00 0.00 O ATOM 0 H SER A 112 0.451 -4.957 14.353 1.00 0.00 H new ATOM 0 HA SER A 112 0.428 -7.817 15.098 1.00 0.00 H new ATOM 0 HB2 SER A 112 2.929 -7.607 14.805 1.00 0.00 H new ATOM 0 HB3 SER A 112 2.115 -7.203 13.306 1.00 0.00 H new ATOM 0 HG SER A 112 3.747 -5.618 14.074 1.00 0.00 H new ATOM 1809 N GLY A 113 0.486 -5.454 17.093 1.00 0.00 N ATOM 1810 CA GLY A 113 0.612 -5.062 18.495 1.00 0.00 C ATOM 1811 C GLY A 113 0.927 -3.580 18.608 1.00 0.00 C ATOM 1812 O GLY A 113 0.274 -2.852 19.360 1.00 0.00 O ATOM 0 H GLY A 113 -0.128 -4.844 16.554 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -0.314 -5.284 19.025 1.00 0.00 H new ATOM 0 HA3 GLY A 113 1.400 -5.645 18.972 1.00 0.00 H new ATOM 1816 N ARG A 114 1.935 -3.128 17.862 1.00 0.00 N ATOM 1817 CA ARG A 114 2.355 -1.730 17.830 1.00 0.00 C ATOM 1818 C ARG A 114 2.626 -1.255 16.401 1.00 0.00 C ATOM 1819 O ARG A 114 2.961 -0.079 16.210 1.00 0.00 O ATOM 1820 CB ARG A 114 3.581 -1.515 18.728 1.00 0.00 C ATOM 1821 CG ARG A 114 3.248 -1.126 20.171 1.00 0.00 C ATOM 1822 CD ARG A 114 2.913 -2.312 21.073 1.00 0.00 C ATOM 1823 NE ARG A 114 1.710 -2.020 21.864 1.00 0.00 N ATOM 1824 CZ ARG A 114 1.444 -2.463 23.091 1.00 0.00 C ATOM 1825 NH1 ARG A 114 2.280 -3.286 23.706 1.00 0.00 N ATOM 1826 NH2 ARG A 114 0.323 -2.099 23.694 1.00 0.00 N ATOM 0 H ARG A 114 2.489 -3.732 17.255 1.00 0.00 H new ATOM 0 HA ARG A 114 1.535 -1.126 18.219 1.00 0.00 H new ATOM 0 HB2 ARG A 114 4.173 -2.430 18.739 1.00 0.00 H new ATOM 0 HB3 ARG A 114 4.205 -0.736 18.290 1.00 0.00 H new ATOM 0 HG2 ARG A 114 4.095 -0.588 20.596 1.00 0.00 H new ATOM 0 HG3 ARG A 114 2.403 -0.437 20.165 1.00 0.00 H new ATOM 0 HD2 ARG A 114 2.753 -3.205 20.469 1.00 0.00 H new ATOM 0 HD3 ARG A 114 3.752 -2.523 21.736 1.00 0.00 H new ATOM 0 HE ARG A 114 1.009 -1.419 21.430 1.00 0.00 H new ATOM 0 HH11 ARG A 114 3.136 -3.586 23.240 1.00 0.00 H new ATOM 0 HH12 ARG A 114 2.068 -3.620 24.646 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -0.334 -1.481 23.219 1.00 0.00 H new ATOM 0 HH22 ARG A 114 0.117 -2.437 24.634 1.00 0.00 H new ATOM 1840 N ASN A 115 2.496 -2.124 15.399 1.00 0.00 N ATOM 1841 CA ASN A 115 2.731 -1.815 13.995 1.00 0.00 C ATOM 1842 C ASN A 115 1.537 -2.303 13.167 1.00 0.00 C ATOM 1843 O ASN A 115 0.690 -3.031 13.692 1.00 0.00 O ATOM 1844 CB ASN A 115 4.075 -2.436 13.595 1.00 0.00 C ATOM 1845 CG ASN A 115 5.283 -1.774 14.261 1.00 0.00 C ATOM 1846 OD1 ASN A 115 6.009 -2.394 15.034 1.00 0.00 O ATOM 1847 ND2 ASN A 115 5.508 -0.481 14.068 1.00 0.00 N ATOM 0 H ASN A 115 2.215 -3.093 15.551 1.00 0.00 H new ATOM 0 HA ASN A 115 2.804 -0.744 13.809 1.00 0.00 H new ATOM 0 HB2 ASN A 115 4.066 -3.495 13.851 1.00 0.00 H new ATOM 0 HB3 ASN A 115 4.187 -2.371 12.513 1.00 0.00 H new ATOM 0 HD21 ASN A 115 6.274 -0.018 14.558 1.00 0.00 H new ATOM 0 HD22 ASN A 115 4.915 0.050 13.430 1.00 0.00 H new ATOM 1854 N SER A 116 1.449 -1.920 11.889 1.00 0.00 N ATOM 1855 CA SER A 116 0.348 -2.273 10.990 1.00 0.00 C ATOM 1856 C SER A 116 0.857 -2.835 9.656 1.00 0.00 C ATOM 1857 O SER A 116 1.901 -2.397 9.177 1.00 0.00 O ATOM 1858 CB SER A 116 -0.523 -1.026 10.801 1.00 0.00 C ATOM 1859 OG SER A 116 -0.732 -0.288 12.003 1.00 0.00 O ATOM 0 H SER A 116 2.160 -1.342 11.441 1.00 0.00 H new ATOM 0 HA SER A 116 -0.250 -3.072 11.430 1.00 0.00 H new ATOM 0 HB2 SER A 116 -0.056 -0.375 10.062 1.00 0.00 H new ATOM 0 HB3 SER A 116 -1.489 -1.326 10.396 1.00 0.00 H new ATOM 0 HG SER A 116 -1.292 0.494 11.814 1.00 0.00 H new ATOM 1865 N THR A 117 0.094 -3.752 9.053 1.00 0.00 N ATOM 1866 CA THR A 117 0.384 -4.461 7.794 1.00 0.00 C ATOM 1867 C THR A 117 -0.710 -4.233 6.749 1.00 0.00 C ATOM 1868 O THR A 117 -1.776 -3.679 7.068 1.00 0.00 O ATOM 1869 CB THR A 117 0.474 -5.986 8.052 1.00 0.00 C ATOM 1870 OG1 THR A 117 0.467 -6.313 9.434 1.00 0.00 O ATOM 1871 CG2 THR A 117 1.711 -6.592 7.402 1.00 0.00 C ATOM 0 H THR A 117 -0.799 -4.040 9.453 1.00 0.00 H new ATOM 0 HA THR A 117 1.330 -4.069 7.420 1.00 0.00 H new ATOM 0 HB THR A 117 -0.421 -6.412 7.598 1.00 0.00 H new ATOM 0 HG1 THR A 117 0.524 -7.286 9.540 1.00 0.00 H new ATOM 0 HG21 THR A 117 1.741 -7.663 7.604 1.00 0.00 H new ATOM 0 HG22 THR A 117 1.674 -6.427 6.325 1.00 0.00 H new ATOM 0 HG23 THR A 117 2.605 -6.121 7.811 1.00 0.00 H new ATOM 1879 N PHE A 118 -0.487 -4.709 5.517 1.00 0.00 N ATOM 1880 CA PHE A 118 -1.416 -4.604 4.413 1.00 0.00 C ATOM 1881 C PHE A 118 -1.249 -5.862 3.585 1.00 0.00 C ATOM 1882 O PHE A 118 -0.122 -6.232 3.241 1.00 0.00 O ATOM 1883 CB PHE A 118 -1.148 -3.367 3.569 1.00 0.00 C ATOM 1884 CG PHE A 118 -1.568 -2.054 4.210 1.00 0.00 C ATOM 1885 CD1 PHE A 118 -2.899 -1.877 4.636 1.00 0.00 C ATOM 1886 CD2 PHE A 118 -0.645 -1.005 4.381 1.00 0.00 C ATOM 1887 CE1 PHE A 118 -3.286 -0.688 5.275 1.00 0.00 C ATOM 1888 CE2 PHE A 118 -1.045 0.201 4.983 1.00 0.00 C ATOM 1889 CZ PHE A 118 -2.362 0.356 5.444 1.00 0.00 C ATOM 0 H PHE A 118 0.376 -5.191 5.266 1.00 0.00 H new ATOM 0 HA PHE A 118 -2.436 -4.505 4.784 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -0.082 -3.321 3.345 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -1.669 -3.474 2.618 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -3.625 -2.659 4.470 1.00 0.00 H new ATOM 0 HD2 PHE A 118 0.375 -1.127 4.048 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -4.297 -0.576 5.638 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -0.338 1.010 5.091 1.00 0.00 H new ATOM 0 HZ PHE A 118 -2.663 1.274 5.926 1.00 0.00 H new ATOM 1899 N GLU A 119 -2.376 -6.511 3.313 1.00 0.00 N ATOM 1900 CA GLU A 119 -2.491 -7.732 2.539 1.00 0.00 C ATOM 1901 C GLU A 119 -3.249 -7.384 1.262 1.00 0.00 C ATOM 1902 O GLU A 119 -4.182 -6.600 1.317 1.00 0.00 O ATOM 1903 CB GLU A 119 -3.293 -8.770 3.347 1.00 0.00 C ATOM 1904 CG GLU A 119 -3.311 -10.171 2.705 1.00 0.00 C ATOM 1905 CD GLU A 119 -4.564 -10.978 3.059 1.00 0.00 C ATOM 1906 OE1 GLU A 119 -5.642 -10.686 2.499 1.00 0.00 O ATOM 1907 OE2 GLU A 119 -4.444 -11.985 3.788 1.00 0.00 O ATOM 0 H GLU A 119 -3.280 -6.177 3.647 1.00 0.00 H new ATOM 0 HA GLU A 119 -1.510 -8.147 2.308 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -2.870 -8.844 4.349 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -4.318 -8.418 3.459 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -3.246 -10.069 1.622 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -2.428 -10.723 3.027 1.00 0.00 H new ATOM 1914 N SER A 120 -2.878 -7.970 0.136 1.00 0.00 N ATOM 1915 CA SER A 120 -3.481 -7.802 -1.193 1.00 0.00 C ATOM 1916 C SER A 120 -4.880 -8.457 -1.253 1.00 0.00 C ATOM 1917 O SER A 120 -4.974 -9.667 -1.059 1.00 0.00 O ATOM 1918 CB SER A 120 -2.560 -8.467 -2.218 1.00 0.00 C ATOM 1919 OG SER A 120 -1.257 -7.914 -2.195 1.00 0.00 O ATOM 0 H SER A 120 -2.094 -8.622 0.116 1.00 0.00 H new ATOM 0 HA SER A 120 -3.598 -6.740 -1.407 1.00 0.00 H new ATOM 0 HB2 SER A 120 -2.504 -9.537 -2.015 1.00 0.00 H new ATOM 0 HB3 SER A 120 -2.985 -8.353 -3.215 1.00 0.00 H new ATOM 0 HG SER A 120 -1.317 -6.939 -2.114 1.00 0.00 H new ATOM 1925 N VAL A 121 -5.959 -7.743 -1.613 1.00 0.00 N ATOM 1926 CA VAL A 121 -7.316 -8.340 -1.635 1.00 0.00 C ATOM 1927 C VAL A 121 -7.481 -9.367 -2.758 1.00 0.00 C ATOM 1928 O VAL A 121 -8.047 -10.442 -2.542 1.00 0.00 O ATOM 1929 CB VAL A 121 -8.424 -7.260 -1.640 1.00 0.00 C ATOM 1930 CG1 VAL A 121 -9.857 -7.822 -1.665 1.00 0.00 C ATOM 1931 CG2 VAL A 121 -8.377 -6.392 -0.378 1.00 0.00 C ATOM 0 H VAL A 121 -5.926 -6.762 -1.891 1.00 0.00 H new ATOM 0 HA VAL A 121 -7.434 -8.894 -0.704 1.00 0.00 H new ATOM 0 HB VAL A 121 -8.217 -6.701 -2.552 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.571 -6.998 -1.667 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.996 -8.425 -2.563 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -10.020 -8.441 -0.783 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -9.171 -5.646 -0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -8.516 -7.021 0.501 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -7.411 -5.891 -0.317 1.00 0.00 H new ATOM 1941 N ALA A 122 -6.997 -9.058 -3.962 1.00 0.00 N ATOM 1942 CA ALA A 122 -7.093 -9.986 -5.106 1.00 0.00 C ATOM 1943 C ALA A 122 -6.266 -11.269 -4.933 1.00 0.00 C ATOM 1944 O ALA A 122 -6.577 -12.271 -5.589 1.00 0.00 O ATOM 1945 CB ALA A 122 -6.644 -9.329 -6.409 1.00 0.00 C ATOM 0 H ALA A 122 -6.534 -8.175 -4.177 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.150 -10.250 -5.146 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -6.730 -10.045 -7.226 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -7.274 -8.464 -6.617 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -5.607 -9.008 -6.316 1.00 0.00 H new ATOM 1951 N PHE A 123 -5.216 -11.228 -4.110 1.00 0.00 N ATOM 1952 CA PHE A 123 -4.311 -12.333 -3.817 1.00 0.00 C ATOM 1953 C PHE A 123 -4.021 -12.295 -2.311 1.00 0.00 C ATOM 1954 O PHE A 123 -2.963 -11.813 -1.910 1.00 0.00 O ATOM 1955 CB PHE A 123 -3.023 -12.196 -4.650 1.00 0.00 C ATOM 1956 CG PHE A 123 -3.129 -12.594 -6.108 1.00 0.00 C ATOM 1957 CD1 PHE A 123 -3.089 -11.629 -7.135 1.00 0.00 C ATOM 1958 CD2 PHE A 123 -3.182 -13.961 -6.437 1.00 0.00 C ATOM 1959 CE1 PHE A 123 -3.076 -12.040 -8.481 1.00 0.00 C ATOM 1960 CE2 PHE A 123 -3.170 -14.368 -7.781 1.00 0.00 C ATOM 1961 CZ PHE A 123 -3.107 -13.406 -8.806 1.00 0.00 C ATOM 0 H PHE A 123 -4.964 -10.378 -3.606 1.00 0.00 H new ATOM 0 HA PHE A 123 -4.756 -13.292 -4.081 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -2.690 -11.159 -4.600 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -2.246 -12.802 -4.184 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -3.068 -10.577 -6.890 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -3.232 -14.701 -5.652 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -3.042 -11.301 -9.268 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -3.209 -15.419 -8.028 1.00 0.00 H new ATOM 0 HZ PHE A 123 -3.083 -13.717 -9.840 1.00 0.00 H new ATOM 1971 N PRO A 124 -4.956 -12.764 -1.473 1.00 0.00 N ATOM 1972 CA PRO A 124 -4.793 -12.757 -0.026 1.00 0.00 C ATOM 1973 C PRO A 124 -3.680 -13.694 0.438 1.00 0.00 C ATOM 1974 O PRO A 124 -3.212 -14.555 -0.306 1.00 0.00 O ATOM 1975 CB PRO A 124 -6.152 -13.164 0.533 1.00 0.00 C ATOM 1976 CG PRO A 124 -6.710 -14.052 -0.576 1.00 0.00 C ATOM 1977 CD PRO A 124 -6.230 -13.354 -1.837 1.00 0.00 C ATOM 0 HA PRO A 124 -4.488 -11.774 0.333 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -6.059 -13.702 1.476 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -6.789 -12.300 0.721 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -6.330 -15.071 -0.508 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -7.798 -14.114 -0.536 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -6.118 -14.059 -2.661 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -6.940 -12.593 -2.162 1.00 0.00 H new ATOM 1985 N GLY A 125 -3.273 -13.541 1.696 1.00 0.00 N ATOM 1986 CA GLY A 125 -2.217 -14.312 2.326 1.00 0.00 C ATOM 1987 C GLY A 125 -0.836 -13.707 2.060 1.00 0.00 C ATOM 1988 O GLY A 125 0.113 -14.067 2.756 1.00 0.00 O ATOM 0 H GLY A 125 -3.688 -12.851 2.322 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -2.393 -14.359 3.401 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -2.243 -15.336 1.954 1.00 0.00 H new ATOM 1992 N TRP A 126 -0.726 -12.778 1.106 1.00 0.00 N ATOM 1993 CA TRP A 126 0.494 -12.093 0.708 1.00 0.00 C ATOM 1994 C TRP A 126 0.469 -10.653 1.218 1.00 0.00 C ATOM 1995 O TRP A 126 -0.434 -9.891 0.851 1.00 0.00 O ATOM 1996 CB TRP A 126 0.598 -12.114 -0.821 1.00 0.00 C ATOM 1997 CG TRP A 126 1.095 -13.387 -1.437 1.00 0.00 C ATOM 1998 CD1 TRP A 126 2.383 -13.791 -1.433 1.00 0.00 C ATOM 1999 CD2 TRP A 126 0.366 -14.407 -2.186 1.00 0.00 C ATOM 2000 NE1 TRP A 126 2.505 -14.959 -2.158 1.00 0.00 N ATOM 2001 CE2 TRP A 126 1.294 -15.378 -2.660 1.00 0.00 C ATOM 2002 CE3 TRP A 126 -0.984 -14.608 -2.527 1.00 0.00 C ATOM 2003 CZ2 TRP A 126 0.901 -16.467 -3.456 1.00 0.00 C ATOM 2004 CZ3 TRP A 126 -1.399 -15.697 -3.315 1.00 0.00 C ATOM 2005 CH2 TRP A 126 -0.456 -16.629 -3.783 1.00 0.00 C ATOM 0 H TRP A 126 -1.534 -12.471 0.564 1.00 0.00 H new ATOM 0 HA TRP A 126 1.360 -12.597 1.137 1.00 0.00 H new ATOM 0 HB2 TRP A 126 -0.387 -11.896 -1.234 1.00 0.00 H new ATOM 0 HB3 TRP A 126 1.259 -11.304 -1.130 1.00 0.00 H new ATOM 0 HD1 TRP A 126 3.194 -13.278 -0.938 1.00 0.00 H new ATOM 0 HE1 TRP A 126 3.386 -15.452 -2.304 1.00 0.00 H new ATOM 0 HE3 TRP A 126 -1.724 -13.905 -2.173 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 1.636 -17.173 -3.813 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 -2.444 -15.817 -3.561 1.00 0.00 H new ATOM 0 HH2 TRP A 126 -0.773 -17.464 -4.390 1.00 0.00 H new ATOM 2016 N PHE A 127 1.437 -10.268 2.052 1.00 0.00 N ATOM 2017 CA PHE A 127 1.544 -8.922 2.604 1.00 0.00 C ATOM 2018 C PHE A 127 2.635 -8.137 1.876 1.00 0.00 C ATOM 2019 O PHE A 127 3.628 -8.724 1.433 1.00 0.00 O ATOM 2020 CB PHE A 127 1.852 -8.979 4.109 1.00 0.00 C ATOM 2021 CG PHE A 127 0.762 -9.593 4.977 1.00 0.00 C ATOM 2022 CD1 PHE A 127 0.742 -10.983 5.204 1.00 0.00 C ATOM 2023 CD2 PHE A 127 -0.210 -8.783 5.599 1.00 0.00 C ATOM 2024 CE1 PHE A 127 -0.221 -11.547 6.058 1.00 0.00 C ATOM 2025 CE2 PHE A 127 -1.173 -9.352 6.453 1.00 0.00 C ATOM 2026 CZ PHE A 127 -1.183 -10.736 6.683 1.00 0.00 C ATOM 0 H PHE A 127 2.178 -10.894 2.366 1.00 0.00 H new ATOM 0 HA PHE A 127 0.589 -8.415 2.463 1.00 0.00 H new ATOM 0 HB2 PHE A 127 2.771 -9.548 4.253 1.00 0.00 H new ATOM 0 HB3 PHE A 127 2.046 -7.966 4.461 1.00 0.00 H new ATOM 0 HD1 PHE A 127 1.469 -11.618 4.720 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -0.216 -7.718 5.419 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.222 -12.612 6.235 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.907 -8.721 6.933 1.00 0.00 H new ATOM 0 HZ PHE A 127 -1.924 -11.174 7.335 1.00 0.00 H new ATOM 2036 N ILE A 128 2.470 -6.818 1.752 1.00 0.00 N ATOM 2037 CA ILE A 128 3.480 -5.987 1.099 1.00 0.00 C ATOM 2038 C ILE A 128 4.650 -5.716 2.037 1.00 0.00 C ATOM 2039 O ILE A 128 4.460 -5.435 3.221 1.00 0.00 O ATOM 2040 CB ILE A 128 2.925 -4.621 0.661 1.00 0.00 C ATOM 2041 CG1 ILE A 128 2.089 -3.899 1.734 1.00 0.00 C ATOM 2042 CG2 ILE A 128 2.097 -4.775 -0.609 1.00 0.00 C ATOM 2043 CD1 ILE A 128 2.199 -2.384 1.594 1.00 0.00 C ATOM 0 H ILE A 128 1.655 -6.308 2.092 1.00 0.00 H new ATOM 0 HA ILE A 128 3.800 -6.549 0.221 1.00 0.00 H new ATOM 0 HB ILE A 128 3.799 -3.994 0.483 1.00 0.00 H new ATOM 0 HG12 ILE A 128 1.045 -4.200 1.648 1.00 0.00 H new ATOM 0 HG13 ILE A 128 2.427 -4.200 2.725 1.00 0.00 H new ATOM 0 HG21 ILE A 128 1.709 -3.802 -0.910 1.00 0.00 H new ATOM 0 HG22 ILE A 128 2.723 -5.178 -1.405 1.00 0.00 H new ATOM 0 HG23 ILE A 128 1.266 -5.455 -0.421 1.00 0.00 H new ATOM 0 HD11 ILE A 128 1.598 -1.903 2.365 1.00 0.00 H new ATOM 0 HD12 ILE A 128 3.241 -2.083 1.705 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.837 -2.082 0.611 1.00 0.00 H new ATOM 2055 N ALA A 129 5.868 -5.759 1.496 1.00 0.00 N ATOM 2056 CA ALA A 129 7.054 -5.469 2.274 1.00 0.00 C ATOM 2057 C ALA A 129 7.366 -3.974 2.166 1.00 0.00 C ATOM 2058 O ALA A 129 7.135 -3.345 1.130 1.00 0.00 O ATOM 2059 CB ALA A 129 8.244 -6.295 1.790 1.00 0.00 C ATOM 0 H ALA A 129 6.050 -5.993 0.520 1.00 0.00 H new ATOM 0 HA ALA A 129 6.870 -5.734 3.315 1.00 0.00 H new ATOM 0 HB1 ALA A 129 9.121 -6.057 2.392 1.00 0.00 H new ATOM 0 HB2 ALA A 129 8.014 -7.356 1.887 1.00 0.00 H new ATOM 0 HB3 ALA A 129 8.447 -6.062 0.745 1.00 0.00 H new ATOM 2065 N VAL A 130 8.000 -3.446 3.207 1.00 0.00 N ATOM 2066 CA VAL A 130 8.423 -2.062 3.375 1.00 0.00 C ATOM 2067 C VAL A 130 9.944 -1.926 3.209 1.00 0.00 C ATOM 2068 O VAL A 130 10.450 -0.825 2.974 1.00 0.00 O ATOM 2069 CB VAL A 130 7.935 -1.573 4.760 1.00 0.00 C ATOM 2070 CG1 VAL A 130 8.255 -0.096 4.988 1.00 0.00 C ATOM 2071 CG2 VAL A 130 6.420 -1.813 4.946 1.00 0.00 C ATOM 0 H VAL A 130 8.250 -4.017 4.015 1.00 0.00 H new ATOM 0 HA VAL A 130 7.980 -1.434 2.602 1.00 0.00 H new ATOM 0 HB VAL A 130 8.476 -2.160 5.502 1.00 0.00 H new ATOM 0 HG11 VAL A 130 7.896 0.207 5.972 1.00 0.00 H new ATOM 0 HG12 VAL A 130 9.333 0.055 4.933 1.00 0.00 H new ATOM 0 HG13 VAL A 130 7.765 0.505 4.222 1.00 0.00 H new ATOM 0 HG21 VAL A 130 6.113 -1.457 5.930 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.869 -1.272 4.177 1.00 0.00 H new ATOM 0 HG23 VAL A 130 6.208 -2.879 4.863 1.00 0.00 H new ATOM 2081 N SER A 131 10.665 -3.046 3.297 1.00 0.00 N ATOM 2082 CA SER A 131 12.110 -3.155 3.174 1.00 0.00 C ATOM 2083 C SER A 131 12.847 -2.257 4.141 1.00 0.00 C ATOM 2084 O SER A 131 13.347 -1.189 3.767 1.00 0.00 O ATOM 2085 CB SER A 131 12.568 -2.856 1.761 1.00 0.00 C ATOM 2086 OG SER A 131 11.847 -3.684 0.869 1.00 0.00 O ATOM 0 H SER A 131 10.225 -3.950 3.466 1.00 0.00 H new ATOM 0 HA SER A 131 12.353 -4.188 3.422 1.00 0.00 H new ATOM 0 HB2 SER A 131 12.399 -1.806 1.523 1.00 0.00 H new ATOM 0 HB3 SER A 131 13.638 -3.037 1.664 1.00 0.00 H new ATOM 0 HG SER A 131 12.172 -3.542 -0.044 1.00 0.00 H new ATOM 2092 N SER A 132 12.999 -2.720 5.371 1.00 0.00 N ATOM 2093 CA SER A 132 13.696 -1.945 6.388 1.00 0.00 C ATOM 2094 C SER A 132 15.038 -2.568 6.783 1.00 0.00 C ATOM 2095 O SER A 132 15.834 -1.925 7.468 1.00 0.00 O ATOM 2096 CB SER A 132 12.784 -1.672 7.587 1.00 0.00 C ATOM 2097 OG SER A 132 11.458 -1.352 7.197 1.00 0.00 O ATOM 0 H SER A 132 12.651 -3.624 5.690 1.00 0.00 H new ATOM 0 HA SER A 132 13.948 -0.978 5.952 1.00 0.00 H new ATOM 0 HB2 SER A 132 12.768 -2.549 8.234 1.00 0.00 H new ATOM 0 HB3 SER A 132 13.196 -0.850 8.173 1.00 0.00 H new ATOM 0 HG SER A 132 10.889 -1.289 7.993 1.00 0.00 H new ATOM 2103 N GLU A 133 15.304 -3.796 6.326 1.00 0.00 N ATOM 2104 CA GLU A 133 16.516 -4.559 6.597 1.00 0.00 C ATOM 2105 C GLU A 133 17.767 -3.770 6.215 1.00 0.00 C ATOM 2106 O GLU A 133 18.601 -3.458 7.067 1.00 0.00 O ATOM 2107 CB GLU A 133 16.453 -5.914 5.868 1.00 0.00 C ATOM 2108 CG GLU A 133 15.583 -6.944 6.599 1.00 0.00 C ATOM 2109 CD GLU A 133 16.191 -7.267 7.964 1.00 0.00 C ATOM 2110 OE1 GLU A 133 17.197 -8.004 8.038 1.00 0.00 O ATOM 2111 OE2 GLU A 133 15.763 -6.612 8.942 1.00 0.00 O ATOM 0 H GLU A 133 14.648 -4.303 5.731 1.00 0.00 H new ATOM 0 HA GLU A 133 16.579 -4.748 7.669 1.00 0.00 H new ATOM 0 HB2 GLU A 133 16.060 -5.762 4.863 1.00 0.00 H new ATOM 0 HB3 GLU A 133 17.463 -6.310 5.760 1.00 0.00 H new ATOM 0 HG2 GLU A 133 14.573 -6.555 6.725 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.503 -7.853 6.003 1.00 0.00 H new ATOM 2118 N GLY A 134 17.869 -3.436 4.933 1.00 0.00 N ATOM 2119 CA GLY A 134 18.961 -2.683 4.357 1.00 0.00 C ATOM 2120 C GLY A 134 18.336 -1.715 3.371 1.00 0.00 C ATOM 2121 O GLY A 134 17.952 -0.613 3.744 1.00 0.00 O ATOM 0 H GLY A 134 17.162 -3.696 4.245 1.00 0.00 H new ATOM 0 HA2 GLY A 134 19.515 -2.149 5.129 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.669 -3.345 3.857 1.00 0.00 H new ATOM 2125 N GLY A 135 18.093 -2.136 2.130 1.00 0.00 N ATOM 2126 CA GLY A 135 17.488 -1.295 1.108 1.00 0.00 C ATOM 2127 C GLY A 135 17.031 -2.143 -0.066 1.00 0.00 C ATOM 2128 O GLY A 135 17.556 -1.981 -1.173 1.00 0.00 O ATOM 0 H GLY A 135 18.314 -3.078 1.807 1.00 0.00 H new ATOM 0 HA2 GLY A 135 16.640 -0.754 1.527 1.00 0.00 H new ATOM 0 HA3 GLY A 135 18.206 -0.548 0.769 1.00 0.00 H new ATOM 2132 N CYS A 136 16.112 -3.078 0.192 1.00 0.00 N ATOM 2133 CA CYS A 136 15.589 -3.976 -0.840 1.00 0.00 C ATOM 2134 C CYS A 136 14.330 -3.416 -1.518 1.00 0.00 C ATOM 2135 O CYS A 136 13.710 -2.489 -0.989 1.00 0.00 O ATOM 2136 CB CYS A 136 15.346 -5.351 -0.203 1.00 0.00 C ATOM 2137 SG CYS A 136 16.900 -6.290 -0.361 1.00 0.00 S ATOM 0 H CYS A 136 15.712 -3.233 1.117 1.00 0.00 H new ATOM 0 HA CYS A 136 16.322 -4.073 -1.641 1.00 0.00 H new ATOM 0 HB2 CYS A 136 15.063 -5.247 0.844 1.00 0.00 H new ATOM 0 HB3 CYS A 136 14.529 -5.870 -0.704 1.00 0.00 H new ATOM 0 HG CYS A 136 16.751 -7.468 0.167 1.00 0.00 H new ATOM 2143 N PRO A 137 13.936 -3.950 -2.688 1.00 0.00 N ATOM 2144 CA PRO A 137 12.746 -3.490 -3.368 1.00 0.00 C ATOM 2145 C PRO A 137 11.510 -3.931 -2.598 1.00 0.00 C ATOM 2146 O PRO A 137 11.562 -4.810 -1.733 1.00 0.00 O ATOM 2147 CB PRO A 137 12.795 -4.083 -4.776 1.00 0.00 C ATOM 2148 CG PRO A 137 13.582 -5.371 -4.577 1.00 0.00 C ATOM 2149 CD PRO A 137 14.552 -5.024 -3.446 1.00 0.00 C ATOM 0 HA PRO A 137 12.699 -2.403 -3.428 1.00 0.00 H new ATOM 0 HB2 PRO A 137 11.796 -4.276 -5.168 1.00 0.00 H new ATOM 0 HB3 PRO A 137 13.289 -3.413 -5.479 1.00 0.00 H new ATOM 0 HG2 PRO A 137 12.931 -6.202 -4.307 1.00 0.00 H new ATOM 0 HG3 PRO A 137 14.111 -5.663 -5.484 1.00 0.00 H new ATOM 0 HD2 PRO A 137 14.734 -5.891 -2.812 1.00 0.00 H new ATOM 0 HD3 PRO A 137 15.517 -4.713 -3.845 1.00 0.00 H new ATOM 2157 N LEU A 138 10.408 -3.266 -2.898 1.00 0.00 N ATOM 2158 CA LEU A 138 9.123 -3.511 -2.285 1.00 0.00 C ATOM 2159 C LEU A 138 8.450 -4.605 -3.094 1.00 0.00 C ATOM 2160 O LEU A 138 8.124 -4.406 -4.266 1.00 0.00 O ATOM 2161 CB LEU A 138 8.286 -2.243 -2.315 1.00 0.00 C ATOM 2162 CG LEU A 138 8.949 -1.003 -1.690 1.00 0.00 C ATOM 2163 CD1 LEU A 138 7.868 0.058 -1.542 1.00 0.00 C ATOM 2164 CD2 LEU A 138 9.624 -1.224 -0.337 1.00 0.00 C ATOM 0 H LEU A 138 10.386 -2.521 -3.594 1.00 0.00 H new ATOM 0 HA LEU A 138 9.235 -3.813 -1.244 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.035 -2.017 -3.351 1.00 0.00 H new ATOM 0 HB3 LEU A 138 7.348 -2.434 -1.794 1.00 0.00 H new ATOM 0 HG LEU A 138 9.759 -0.710 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.298 0.957 -1.101 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.456 0.297 -2.522 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.074 -0.319 -0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 138 10.058 -0.286 0.011 1.00 0.00 H new ATOM 0 HD22 LEU A 138 8.886 -1.572 0.385 1.00 0.00 H new ATOM 0 HD23 LEU A 138 10.411 -1.971 -0.441 1.00 0.00 H new ATOM 2176 N ILE A 139 8.273 -5.764 -2.480 1.00 0.00 N ATOM 2177 CA ILE A 139 7.661 -6.946 -3.063 1.00 0.00 C ATOM 2178 C ILE A 139 6.717 -7.580 -2.048 1.00 0.00 C ATOM 2179 O ILE A 139 6.663 -7.159 -0.891 1.00 0.00 O ATOM 2180 CB ILE A 139 8.730 -7.960 -3.534 1.00 0.00 C ATOM 2181 CG1 ILE A 139 10.065 -7.995 -2.762 1.00 0.00 C ATOM 2182 CG2 ILE A 139 9.058 -7.703 -5.007 1.00 0.00 C ATOM 2183 CD1 ILE A 139 9.921 -8.262 -1.265 1.00 0.00 C ATOM 0 H ILE A 139 8.567 -5.912 -1.515 1.00 0.00 H new ATOM 0 HA ILE A 139 7.092 -6.648 -3.944 1.00 0.00 H new ATOM 0 HB ILE A 139 8.261 -8.926 -3.344 1.00 0.00 H new ATOM 0 HG12 ILE A 139 10.702 -8.765 -3.197 1.00 0.00 H new ATOM 0 HG13 ILE A 139 10.576 -7.043 -2.901 1.00 0.00 H new ATOM 0 HG21 ILE A 139 9.811 -8.416 -5.342 1.00 0.00 H new ATOM 0 HG22 ILE A 139 8.155 -7.820 -5.607 1.00 0.00 H new ATOM 0 HG23 ILE A 139 9.441 -6.689 -5.123 1.00 0.00 H new ATOM 0 HD11 ILE A 139 10.907 -8.270 -0.800 1.00 0.00 H new ATOM 0 HD12 ILE A 139 9.313 -7.479 -0.813 1.00 0.00 H new ATOM 0 HD13 ILE A 139 9.440 -9.228 -1.112 1.00 0.00 H new ATOM 2195 N LEU A 140 5.884 -8.512 -2.512 1.00 0.00 N ATOM 2196 CA LEU A 140 4.959 -9.203 -1.629 1.00 0.00 C ATOM 2197 C LEU A 140 5.716 -10.348 -0.986 1.00 0.00 C ATOM 2198 O LEU A 140 6.672 -10.881 -1.550 1.00 0.00 O ATOM 2199 CB LEU A 140 3.775 -9.844 -2.375 1.00 0.00 C ATOM 2200 CG LEU A 140 2.826 -8.851 -3.056 1.00 0.00 C ATOM 2201 CD1 LEU A 140 1.865 -9.572 -3.998 1.00 0.00 C ATOM 2202 CD2 LEU A 140 1.996 -8.123 -2.004 1.00 0.00 C ATOM 0 H LEU A 140 5.835 -8.801 -3.489 1.00 0.00 H new ATOM 0 HA LEU A 140 4.572 -8.468 -0.924 1.00 0.00 H new ATOM 0 HB2 LEU A 140 4.167 -10.526 -3.130 1.00 0.00 H new ATOM 0 HB3 LEU A 140 3.202 -10.445 -1.669 1.00 0.00 H new ATOM 0 HG LEU A 140 3.434 -8.146 -3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 140 1.203 -8.845 -4.468 1.00 0.00 H new ATOM 0 HD12 LEU A 140 2.433 -10.096 -4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 140 1.272 -10.291 -3.432 1.00 0.00 H new ATOM 0 HD21 LEU A 140 1.324 -7.419 -2.494 1.00 0.00 H new ATOM 0 HD22 LEU A 140 1.412 -8.847 -1.436 1.00 0.00 H new ATOM 0 HD23 LEU A 140 2.658 -7.582 -1.328 1.00 0.00 H new ATOM 2214 N THR A 141 5.238 -10.776 0.164 1.00 0.00 N ATOM 2215 CA THR A 141 5.798 -11.888 0.898 1.00 0.00 C ATOM 2216 C THR A 141 4.617 -12.671 1.417 1.00 0.00 C ATOM 2217 O THR A 141 3.498 -12.175 1.408 1.00 0.00 O ATOM 2218 CB THR A 141 6.843 -11.434 1.913 1.00 0.00 C ATOM 2219 OG1 THR A 141 7.145 -12.406 2.899 1.00 0.00 O ATOM 2220 CG2 THR A 141 6.571 -10.083 2.572 1.00 0.00 C ATOM 0 H THR A 141 4.432 -10.351 0.623 1.00 0.00 H new ATOM 0 HA THR A 141 6.394 -12.561 0.282 1.00 0.00 H new ATOM 0 HB THR A 141 7.725 -11.300 1.286 1.00 0.00 H new ATOM 0 HG1 THR A 141 8.117 -12.517 2.962 1.00 0.00 H new ATOM 0 HG21 THR A 141 7.372 -9.853 3.275 1.00 0.00 H new ATOM 0 HG22 THR A 141 6.526 -9.308 1.807 1.00 0.00 H new ATOM 0 HG23 THR A 141 5.621 -10.123 3.104 1.00 0.00 H new ATOM 2228 N GLN A 142 4.847 -13.946 1.681 1.00 0.00 N ATOM 2229 CA GLN A 142 3.825 -14.849 2.155 1.00 0.00 C ATOM 2230 C GLN A 142 4.003 -14.952 3.649 1.00 0.00 C ATOM 2231 O GLN A 142 3.053 -14.928 4.423 1.00 0.00 O ATOM 2232 CB GLN A 142 4.018 -16.192 1.443 1.00 0.00 C ATOM 2233 CG GLN A 142 3.167 -17.301 2.060 1.00 0.00 C ATOM 2234 CD GLN A 142 3.312 -18.612 1.283 1.00 0.00 C ATOM 2235 OE1 GLN A 142 4.395 -18.960 0.804 1.00 0.00 O ATOM 2236 NE2 GLN A 142 2.241 -19.380 1.157 1.00 0.00 N ATOM 0 H GLN A 142 5.762 -14.384 1.569 1.00 0.00 H new ATOM 0 HA GLN A 142 2.811 -14.509 1.944 1.00 0.00 H new ATOM 0 HB2 GLN A 142 3.761 -16.083 0.389 1.00 0.00 H new ATOM 0 HB3 GLN A 142 5.069 -16.476 1.487 1.00 0.00 H new ATOM 0 HG2 GLN A 142 3.464 -17.456 3.097 1.00 0.00 H new ATOM 0 HG3 GLN A 142 2.121 -16.996 2.071 1.00 0.00 H new ATOM 0 HE21 GLN A 142 1.351 -19.083 1.557 1.00 0.00 H new ATOM 0 HE22 GLN A 142 2.306 -20.269 0.660 1.00 0.00 H new ATOM 2245 N GLU A 143 5.255 -15.145 4.035 1.00 0.00 N ATOM 2246 CA GLU A 143 5.678 -15.263 5.391 1.00 0.00 C ATOM 2247 C GLU A 143 7.156 -14.962 5.380 1.00 0.00 C ATOM 2248 O GLU A 143 7.894 -15.314 4.454 1.00 0.00 O ATOM 2249 CB GLU A 143 5.362 -16.632 5.986 1.00 0.00 C ATOM 2250 CG GLU A 143 5.688 -17.876 5.148 1.00 0.00 C ATOM 2251 CD GLU A 143 5.294 -19.135 5.940 1.00 0.00 C ATOM 2252 OE1 GLU A 143 4.116 -19.234 6.370 1.00 0.00 O ATOM 2253 OE2 GLU A 143 6.170 -19.983 6.216 1.00 0.00 O ATOM 0 H GLU A 143 6.025 -15.225 3.370 1.00 0.00 H new ATOM 0 HA GLU A 143 5.139 -14.567 6.034 1.00 0.00 H new ATOM 0 HB2 GLU A 143 5.898 -16.717 6.931 1.00 0.00 H new ATOM 0 HB3 GLU A 143 4.298 -16.657 6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 143 5.149 -17.843 4.201 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.751 -17.900 4.909 1.00 0.00 H new ATOM 2260 N LEU A 144 7.544 -14.278 6.433 1.00 0.00 N ATOM 2261 CA LEU A 144 8.855 -13.792 6.777 1.00 0.00 C ATOM 2262 C LEU A 144 8.972 -13.745 8.300 1.00 0.00 C ATOM 2263 O LEU A 144 8.017 -13.997 9.039 1.00 0.00 O ATOM 2264 CB LEU A 144 9.058 -12.401 6.146 1.00 0.00 C ATOM 2265 CG LEU A 144 8.244 -11.268 6.797 1.00 0.00 C ATOM 2266 CD1 LEU A 144 8.931 -9.918 6.555 1.00 0.00 C ATOM 2267 CD2 LEU A 144 6.810 -11.205 6.281 1.00 0.00 C ATOM 0 H LEU A 144 6.866 -14.021 7.150 1.00 0.00 H new ATOM 0 HA LEU A 144 9.632 -14.452 6.392 1.00 0.00 H new ATOM 0 HB2 LEU A 144 10.116 -12.145 6.199 1.00 0.00 H new ATOM 0 HB3 LEU A 144 8.796 -12.456 5.089 1.00 0.00 H new ATOM 0 HG LEU A 144 8.202 -11.483 7.865 1.00 0.00 H new ATOM 0 HD11 LEU A 144 8.347 -9.124 7.020 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.930 -9.935 6.990 1.00 0.00 H new ATOM 0 HD13 LEU A 144 9.005 -9.734 5.483 1.00 0.00 H new ATOM 0 HD21 LEU A 144 6.282 -10.389 6.773 1.00 0.00 H new ATOM 0 HD22 LEU A 144 6.818 -11.035 5.204 1.00 0.00 H new ATOM 0 HD23 LEU A 144 6.304 -12.146 6.496 1.00 0.00 H new ATOM 2279 N GLY A 145 10.162 -13.353 8.727 1.00 0.00 N ATOM 2280 CA GLY A 145 10.555 -13.188 10.112 1.00 0.00 C ATOM 2281 C GLY A 145 11.814 -12.330 10.193 1.00 0.00 C ATOM 2282 O GLY A 145 11.944 -11.524 11.105 1.00 0.00 O ATOM 0 H GLY A 145 10.918 -13.130 8.080 1.00 0.00 H new ATOM 0 HA2 GLY A 145 9.748 -12.720 10.675 1.00 0.00 H new ATOM 0 HA3 GLY A 145 10.738 -14.162 10.566 1.00 0.00 H new ATOM 2286 N LYS A 146 12.700 -12.419 9.191 1.00 0.00 N ATOM 2287 CA LYS A 146 13.955 -11.667 9.132 1.00 0.00 C ATOM 2288 C LYS A 146 14.381 -11.241 7.721 1.00 0.00 C ATOM 2289 O LYS A 146 15.507 -10.789 7.559 1.00 0.00 O ATOM 2290 CB LYS A 146 15.055 -12.494 9.835 1.00 0.00 C ATOM 2291 CG LYS A 146 15.106 -14.010 9.543 1.00 0.00 C ATOM 2292 CD LYS A 146 15.254 -14.510 8.093 1.00 0.00 C ATOM 2293 CE LYS A 146 16.384 -13.836 7.317 1.00 0.00 C ATOM 2294 NZ LYS A 146 16.985 -14.725 6.294 1.00 0.00 N ATOM 0 H LYS A 146 12.559 -13.028 8.385 1.00 0.00 H new ATOM 0 HA LYS A 146 13.793 -10.723 9.652 1.00 0.00 H new ATOM 0 HB2 LYS A 146 16.021 -12.067 9.565 1.00 0.00 H new ATOM 0 HB3 LYS A 146 14.938 -12.363 10.911 1.00 0.00 H new ATOM 0 HG2 LYS A 146 15.937 -14.423 10.115 1.00 0.00 H new ATOM 0 HG3 LYS A 146 14.193 -14.449 9.946 1.00 0.00 H new ATOM 0 HD2 LYS A 146 15.427 -15.586 8.106 1.00 0.00 H new ATOM 0 HD3 LYS A 146 14.315 -14.345 7.565 1.00 0.00 H new ATOM 0 HE2 LYS A 146 16.001 -12.938 6.832 1.00 0.00 H new ATOM 0 HE3 LYS A 146 17.158 -13.516 8.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 17.746 -14.218 5.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 17.376 -15.571 6.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 16.255 -15.010 5.610 1.00 0.00 H new ATOM 2308 N ALA A 147 13.571 -11.454 6.673 1.00 0.00 N ATOM 2309 CA ALA A 147 13.966 -11.066 5.308 1.00 0.00 C ATOM 2310 C ALA A 147 13.526 -9.661 4.910 1.00 0.00 C ATOM 2311 O ALA A 147 14.023 -9.116 3.920 1.00 0.00 O ATOM 2312 CB ALA A 147 13.376 -12.027 4.279 1.00 0.00 C ATOM 0 H ALA A 147 12.650 -11.887 6.741 1.00 0.00 H new ATOM 0 HA ALA A 147 15.055 -11.099 5.318 1.00 0.00 H new ATOM 0 HB1 ALA A 147 13.681 -11.721 3.278 1.00 0.00 H new ATOM 0 HB2 ALA A 147 13.737 -13.037 4.475 1.00 0.00 H new ATOM 0 HB3 ALA A 147 12.288 -12.011 4.348 1.00 0.00 H new ATOM 2318 N ASN A 148 12.494 -9.126 5.567 1.00 0.00 N ATOM 2319 CA ASN A 148 11.995 -7.798 5.282 1.00 0.00 C ATOM 2320 C ASN A 148 11.181 -7.346 6.493 1.00 0.00 C ATOM 2321 O ASN A 148 11.336 -7.879 7.594 1.00 0.00 O ATOM 2322 CB ASN A 148 11.256 -7.771 3.913 1.00 0.00 C ATOM 2323 CG ASN A 148 11.998 -6.933 2.857 1.00 0.00 C ATOM 2324 OD1 ASN A 148 13.030 -6.329 3.120 1.00 0.00 O ATOM 2325 ND2 ASN A 148 11.491 -6.847 1.641 1.00 0.00 N ATOM 0 H ASN A 148 11.988 -9.609 6.309 1.00 0.00 H new ATOM 0 HA ASN A 148 12.794 -7.069 5.149 1.00 0.00 H new ATOM 0 HB2 ASN A 148 11.140 -8.791 3.546 1.00 0.00 H new ATOM 0 HB3 ASN A 148 10.253 -7.367 4.053 1.00 0.00 H new ATOM 0 HD21 ASN A 148 11.959 -6.282 0.932 1.00 0.00 H new ATOM 0 HD22 ASN A 148 10.632 -7.346 1.410 1.00 0.00 H new ATOM 2332 N THR A 149 10.332 -6.351 6.304 1.00 0.00 N ATOM 2333 CA THR A 149 9.485 -5.760 7.321 1.00 0.00 C ATOM 2334 C THR A 149 8.194 -5.457 6.581 1.00 0.00 C ATOM 2335 O THR A 149 8.234 -4.700 5.619 1.00 0.00 O ATOM 2336 CB THR A 149 10.193 -4.519 7.886 1.00 0.00 C ATOM 2337 OG1 THR A 149 11.610 -4.655 7.789 1.00 0.00 O ATOM 2338 CG2 THR A 149 9.860 -4.315 9.353 1.00 0.00 C ATOM 0 H THR A 149 10.210 -5.913 5.391 1.00 0.00 H new ATOM 0 HA THR A 149 9.280 -6.391 8.186 1.00 0.00 H new ATOM 0 HB THR A 149 9.847 -3.668 7.299 1.00 0.00 H new ATOM 0 HG1 THR A 149 12.005 -4.608 8.685 1.00 0.00 H new ATOM 0 HG21 THR A 149 10.376 -3.429 9.723 1.00 0.00 H new ATOM 0 HG22 THR A 149 8.784 -4.182 9.467 1.00 0.00 H new ATOM 0 HG23 THR A 149 10.180 -5.187 9.923 1.00 0.00 H new ATOM 2346 N THR A 150 7.105 -6.132 6.912 1.00 0.00 N ATOM 2347 CA THR A 150 5.786 -5.981 6.311 1.00 0.00 C ATOM 2348 C THR A 150 4.902 -5.105 7.192 1.00 0.00 C ATOM 2349 O THR A 150 3.994 -4.442 6.685 1.00 0.00 O ATOM 2350 CB THR A 150 5.160 -7.379 6.204 1.00 0.00 C ATOM 2351 OG1 THR A 150 5.538 -8.163 7.321 1.00 0.00 O ATOM 2352 CG2 THR A 150 5.693 -8.127 4.988 1.00 0.00 C ATOM 0 H THR A 150 7.116 -6.839 7.647 1.00 0.00 H new ATOM 0 HA THR A 150 5.874 -5.513 5.331 1.00 0.00 H new ATOM 0 HB THR A 150 4.081 -7.238 6.140 1.00 0.00 H new ATOM 0 HG1 THR A 150 4.829 -8.808 7.523 1.00 0.00 H new ATOM 0 HG21 THR A 150 5.233 -9.114 4.937 1.00 0.00 H new ATOM 0 HG22 THR A 150 5.454 -7.568 4.083 1.00 0.00 H new ATOM 0 HG23 THR A 150 6.774 -8.235 5.072 1.00 0.00 H new ATOM 2360 N ASP A 151 5.155 -5.124 8.505 1.00 0.00 N ATOM 2361 CA ASP A 151 4.390 -4.369 9.484 1.00 0.00 C ATOM 2362 C ASP A 151 5.252 -3.288 10.078 1.00 0.00 C ATOM 2363 O ASP A 151 6.345 -3.547 10.579 1.00 0.00 O ATOM 2364 CB ASP A 151 3.717 -5.198 10.596 1.00 0.00 C ATOM 2365 CG ASP A 151 4.658 -5.952 11.531 1.00 0.00 C ATOM 2366 OD1 ASP A 151 4.792 -5.553 12.706 1.00 0.00 O ATOM 2367 OD2 ASP A 151 5.114 -7.046 11.118 1.00 0.00 O ATOM 0 H ASP A 151 5.909 -5.674 8.916 1.00 0.00 H new ATOM 0 HA ASP A 151 3.556 -3.943 8.927 1.00 0.00 H new ATOM 0 HB2 ASP A 151 3.099 -4.530 11.196 1.00 0.00 H new ATOM 0 HB3 ASP A 151 3.046 -5.919 10.129 1.00 0.00 H new ATOM 2372 N PHE A 152 4.767 -2.056 9.970 1.00 0.00 N ATOM 2373 CA PHE A 152 5.433 -0.887 10.509 1.00 0.00 C ATOM 2374 C PHE A 152 4.426 0.251 10.693 1.00 0.00 C ATOM 2375 O PHE A 152 3.221 0.007 10.704 1.00 0.00 O ATOM 2376 CB PHE A 152 6.655 -0.514 9.661 1.00 0.00 C ATOM 2377 CG PHE A 152 7.954 -0.644 10.431 1.00 0.00 C ATOM 2378 CD1 PHE A 152 8.060 -0.186 11.761 1.00 0.00 C ATOM 2379 CD2 PHE A 152 9.089 -1.171 9.794 1.00 0.00 C ATOM 2380 CE1 PHE A 152 9.269 -0.304 12.460 1.00 0.00 C ATOM 2381 CE2 PHE A 152 10.315 -1.222 10.478 1.00 0.00 C ATOM 2382 CZ PHE A 152 10.397 -0.837 11.823 1.00 0.00 C ATOM 0 H PHE A 152 3.888 -1.844 9.498 1.00 0.00 H new ATOM 0 HA PHE A 152 5.828 -1.109 11.500 1.00 0.00 H new ATOM 0 HB2 PHE A 152 6.692 -1.155 8.780 1.00 0.00 H new ATOM 0 HB3 PHE A 152 6.548 0.511 9.305 1.00 0.00 H new ATOM 0 HD1 PHE A 152 7.203 0.259 12.244 1.00 0.00 H new ATOM 0 HD2 PHE A 152 9.020 -1.536 8.780 1.00 0.00 H new ATOM 0 HE1 PHE A 152 9.331 0.016 13.490 1.00 0.00 H new ATOM 0 HE2 PHE A 152 11.202 -1.561 9.963 1.00 0.00 H new ATOM 0 HZ PHE A 152 11.324 -0.951 12.365 1.00 0.00 H new ATOM 2392 N GLY A 153 4.893 1.466 10.994 1.00 0.00 N ATOM 2393 CA GLY A 153 4.041 2.641 11.164 1.00 0.00 C ATOM 2394 C GLY A 153 3.930 3.378 9.819 1.00 0.00 C ATOM 2395 O GLY A 153 4.571 2.982 8.843 1.00 0.00 O ATOM 0 H GLY A 153 5.885 1.661 11.128 1.00 0.00 H new ATOM 0 HA2 GLY A 153 3.052 2.342 11.512 1.00 0.00 H new ATOM 0 HA3 GLY A 153 4.459 3.303 11.922 1.00 0.00 H new ATOM 2399 N LEU A 154 3.139 4.448 9.746 1.00 0.00 N ATOM 2400 CA LEU A 154 2.924 5.263 8.553 1.00 0.00 C ATOM 2401 C LEU A 154 2.802 6.705 9.033 1.00 0.00 C ATOM 2402 O LEU A 154 1.868 7.023 9.767 1.00 0.00 O ATOM 2403 CB LEU A 154 1.632 4.826 7.814 1.00 0.00 C ATOM 2404 CG LEU A 154 1.776 4.700 6.289 1.00 0.00 C ATOM 2405 CD1 LEU A 154 2.319 3.311 5.956 1.00 0.00 C ATOM 2406 CD2 LEU A 154 0.432 4.800 5.556 1.00 0.00 C ATOM 0 H LEU A 154 2.609 4.784 10.550 1.00 0.00 H new ATOM 0 HA LEU A 154 3.748 5.149 7.848 1.00 0.00 H new ATOM 0 HB2 LEU A 154 1.307 3.866 8.215 1.00 0.00 H new ATOM 0 HB3 LEU A 154 0.843 5.546 8.033 1.00 0.00 H new ATOM 0 HG LEU A 154 2.431 5.512 5.973 1.00 0.00 H new ATOM 0 HD11 LEU A 154 2.425 3.211 4.876 1.00 0.00 H new ATOM 0 HD12 LEU A 154 3.291 3.177 6.430 1.00 0.00 H new ATOM 0 HD13 LEU A 154 1.628 2.552 6.324 1.00 0.00 H new ATOM 0 HD21 LEU A 154 0.595 4.704 4.483 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -0.228 4.002 5.895 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -0.027 5.765 5.769 1.00 0.00 H new ATOM 2418 N THR A 155 3.768 7.561 8.711 1.00 0.00 N ATOM 2419 CA THR A 155 3.788 8.982 9.059 1.00 0.00 C ATOM 2420 C THR A 155 2.823 9.697 8.093 1.00 0.00 C ATOM 2421 O THR A 155 3.228 10.623 7.403 1.00 0.00 O ATOM 2422 CB THR A 155 5.241 9.518 8.952 1.00 0.00 C ATOM 2423 OG1 THR A 155 6.117 8.665 9.684 1.00 0.00 O ATOM 2424 CG2 THR A 155 5.391 10.919 9.561 1.00 0.00 C ATOM 0 H THR A 155 4.591 7.275 8.180 1.00 0.00 H new ATOM 0 HA THR A 155 3.463 9.160 10.084 1.00 0.00 H new ATOM 0 HB THR A 155 5.483 9.552 7.890 1.00 0.00 H new ATOM 0 HG1 THR A 155 7.035 9.002 9.615 1.00 0.00 H new ATOM 0 HG21 THR A 155 6.425 11.250 9.462 1.00 0.00 H new ATOM 0 HG22 THR A 155 4.735 11.615 9.038 1.00 0.00 H new ATOM 0 HG23 THR A 155 5.120 10.888 10.616 1.00 0.00 H new ATOM 2432 N MET A 156 1.611 9.173 7.881 1.00 0.00 N ATOM 2433 CA MET A 156 0.596 9.735 6.992 1.00 0.00 C ATOM 2434 C MET A 156 0.025 10.968 7.697 1.00 0.00 C ATOM 2435 O MET A 156 -0.488 10.888 8.813 1.00 0.00 O ATOM 2436 CB MET A 156 -0.468 8.693 6.625 1.00 0.00 C ATOM 2437 CG MET A 156 -1.250 8.264 7.859 1.00 0.00 C ATOM 2438 SD MET A 156 -1.986 6.614 7.823 1.00 0.00 S ATOM 2439 CE MET A 156 -2.087 6.407 9.616 1.00 0.00 C ATOM 0 H MET A 156 1.302 8.317 8.341 1.00 0.00 H new ATOM 0 HA MET A 156 1.025 10.033 6.035 1.00 0.00 H new ATOM 0 HB2 MET A 156 -1.150 9.108 5.883 1.00 0.00 H new ATOM 0 HB3 MET A 156 0.008 7.824 6.170 1.00 0.00 H new ATOM 0 HG2 MET A 156 -0.584 8.320 8.720 1.00 0.00 H new ATOM 0 HG3 MET A 156 -2.047 8.988 8.025 1.00 0.00 H new ATOM 0 HE1 MET A 156 -2.522 5.434 9.846 1.00 0.00 H new ATOM 0 HE2 MET A 156 -1.087 6.468 10.046 1.00 0.00 H new ATOM 0 HE3 MET A 156 -2.713 7.193 10.038 1.00 0.00 H new ATOM 2449 N LEU A 157 0.149 12.120 7.063 1.00 0.00 N ATOM 2450 CA LEU A 157 -0.308 13.396 7.602 1.00 0.00 C ATOM 2451 C LEU A 157 -1.660 13.751 6.999 1.00 0.00 C ATOM 2452 O LEU A 157 -2.000 13.298 5.904 1.00 0.00 O ATOM 2453 CB LEU A 157 0.725 14.500 7.311 1.00 0.00 C ATOM 2454 CG LEU A 157 2.201 14.125 7.575 1.00 0.00 C ATOM 2455 CD1 LEU A 157 3.149 15.266 7.195 1.00 0.00 C ATOM 2456 CD2 LEU A 157 2.449 13.761 9.043 1.00 0.00 C ATOM 0 H LEU A 157 0.578 12.200 6.141 1.00 0.00 H new ATOM 0 HA LEU A 157 -0.417 13.311 8.683 1.00 0.00 H new ATOM 0 HB2 LEU A 157 0.626 14.798 6.267 1.00 0.00 H new ATOM 0 HB3 LEU A 157 0.477 15.372 7.916 1.00 0.00 H new ATOM 0 HG LEU A 157 2.403 13.255 6.950 1.00 0.00 H new ATOM 0 HD11 LEU A 157 4.178 14.966 7.394 1.00 0.00 H new ATOM 0 HD12 LEU A 157 3.037 15.495 6.135 1.00 0.00 H new ATOM 0 HD13 LEU A 157 2.908 16.151 7.785 1.00 0.00 H new ATOM 0 HD21 LEU A 157 3.499 13.505 9.182 1.00 0.00 H new ATOM 0 HD22 LEU A 157 2.196 14.611 9.676 1.00 0.00 H new ATOM 0 HD23 LEU A 157 1.828 12.908 9.316 1.00 0.00 H new ATOM 2468 N PHE A 158 -2.433 14.581 7.683 1.00 0.00 N ATOM 2469 CA PHE A 158 -3.749 15.035 7.264 1.00 0.00 C ATOM 2470 C PHE A 158 -3.890 16.502 7.622 1.00 0.00 C ATOM 2471 O PHE A 158 -4.955 17.068 7.310 1.00 0.00 O ATOM 2472 CB PHE A 158 -4.828 14.150 7.878 1.00 0.00 C ATOM 2473 CG PHE A 158 -5.000 14.109 9.390 1.00 0.00 C ATOM 2474 CD1 PHE A 158 -6.014 14.860 10.021 1.00 0.00 C ATOM 2475 CD2 PHE A 158 -4.236 13.208 10.155 1.00 0.00 C ATOM 2476 CE1 PHE A 158 -6.301 14.667 11.387 1.00 0.00 C ATOM 2477 CE2 PHE A 158 -4.515 13.019 11.520 1.00 0.00 C ATOM 2478 CZ PHE A 158 -5.562 13.729 12.133 1.00 0.00 C ATOM 0 H PHE A 158 -2.148 14.972 8.581 1.00 0.00 H new ATOM 0 HA PHE A 158 -3.871 14.948 6.184 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -5.783 14.456 7.450 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -4.641 13.129 7.544 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -6.574 15.588 9.453 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -3.431 12.658 9.691 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -7.086 15.237 11.861 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -3.923 12.326 12.099 1.00 0.00 H new ATOM 0 HZ PHE A 158 -5.799 13.556 13.172 1.00 0.00 H new TER 2488 PHE A 158