USER MOD reduce.3.24.130724 H: found=0, std=0, add=1100, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1102 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: B 83 GLN : amide:sc= 0.619 K(o=-9,f=-17!) USER MOD Set 1.2: B 98 ASN : amide:sc= -9.61! C(o=-9!,f=-11!) USER MOD Set 2.1: B 71 ASN : amide:sc= -1.13! K(o=-1.6!,f=-3.9) USER MOD Set 2.2: B 128 GLN : amide:sc= -0.464! C(o=-1.6!,f=-6.3!) USER MOD Set 3.1: A 5 ASN : amide:sc= 0.0928 K(o=-0.52,f=-2.4!) USER MOD Set 3.2: A 62 GLN : amide:sc= -0.613 K(o=-0.52,f=-2.4) USER MOD Set 4.1: A 17 GLN : amide:sc= -2.92! C(o=-2.7!,f=-39!) USER MOD Set 4.2: A 32 ASN : amide:sc= -1.32! C(o=-2.7!,f=-40!) USER MOD Set 4.3: A 36 LYS NZ :NH3+ 178:sc= 1.58 (180deg=0.87) USER MOD Single : A 4 ASN : amide:sc= -2.76! C(o=-2.8!,f=-18!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ -164:sc= -0.723 (180deg=-1.4) USER MOD Single : A 13 LYS NZ :NH3+ -147:sc= 0.747 (180deg=0.426) USER MOD Single : A 14 LYS NZ :NH3+ 165:sc= 0.357 (180deg=-0.284) USER MOD Single : A 16 SER OG : rot 96:sc= 1.21 USER MOD Single : A 18 SER OG : rot 180:sc= -0.351 USER MOD Single : A 27 SER OG : rot 180:sc= -0.136 USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 30 THR OG1 : rot 92:sc= 0.648 USER MOD Single : A 37 ASN : amide:sc= -1.75 K(o=-1.7,f=-7.5!) USER MOD Single : A 38 LYS NZ :NH3+ -163:sc= -0.0467 (180deg=-0.48) USER MOD Single : A 39 TYR OH : rot -117:sc= 0.0156 USER MOD Single : A 40 ASN : amide:sc= -0.0126 X(o=-0.013,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0.0113 USER MOD Single : A 44 GLN : amide:sc= -0.0146 K(o=-0.015,f=-1.7!) USER MOD Single : A 48 LYS NZ :NH3+ -145:sc= 1.58! (180deg=0.575) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.376 K(o=-0.38,f=-1.8!) USER MOD Single : A 55 THR OG1 : rot -135:sc= 0.352 USER MOD Single : A 64 GLN :FLIP amide:sc= -2.84! C(o=-4!,f=-2.8!) USER MOD Single : B 70 ASN : amide:sc= -6.37! C(o=-6.4!,f=-22!) USER MOD Single : B 73 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.022) USER MOD Single : B 78 LYS NZ :NH3+ -173:sc= 0.0752 (180deg=-0.581!) USER MOD Single : B 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 LYS NZ :NH3+ 156:sc= 0.902 (180deg=-0.0217) USER MOD Single : B 82 SER OG : rot 89:sc= 1.17 USER MOD Single : B 84 SER OG : rot 180:sc= 0.1 USER MOD Single : B 93 SER OG : rot 180:sc= 0.00634 USER MOD Single : B 95 GLN : amide:sc= -1.86 K(o=-1.9,f=-13!) USER MOD Single : B 96 THR OG1 : rot 101:sc= 0.584 USER MOD Single : B 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 103 ASN : amide:sc= -2.5! C(o=-2.5!,f=-8.3!) USER MOD Single : B 104 LYS NZ :NH3+ -166:sc=-0.00722 (180deg=-0.219) USER MOD Single : B 105 TYR OH : rot 64:sc= -0.112 USER MOD Single : B 106 ASN : amide:sc= -1.47 X(o=-1.5,f=-1.8!) USER MOD Single : B 108 SER OG : rot 180:sc= 0.00973 USER MOD Single : B 110 GLN : amide:sc= -0.102 K(o=-0.1,f=-1.3) USER MOD Single : B 114 LYS NZ :NH3+ -107:sc= 1.7 (180deg=-2.61!) USER MOD Single : B 117 TYR OH : rot 180:sc= 0 USER MOD Single : B 118 TYR OH : rot -124:sc= 0.126 USER MOD Single : B 120 ASN : amide:sc= -0.758 X(o=-0.76,f=-0.7) USER MOD Single : B 121 THR OG1 : rot 12:sc= -0.0928 USER MOD Single : B 130 GLN :FLIP amide:sc= -1.17 F(o=-2.5,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 18 N ILE A 2 0.486 10.695 2.248 1.00 0.00 N ATOM 19 CA ILE A 2 1.219 9.527 2.683 1.00 0.00 C ATOM 20 C ILE A 2 2.621 9.953 3.052 1.00 0.00 C ATOM 21 O ILE A 2 3.329 10.536 2.220 1.00 0.00 O ATOM 22 CB ILE A 2 1.286 8.498 1.541 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.125 8.099 1.100 1.00 0.00 C ATOM 24 CG2 ILE A 2 2.035 7.246 2.005 1.00 0.00 C ATOM 25 CD1 ILE A 2 -0.028 7.249 -0.173 1.00 0.00 C ATOM 0 HA ILE A 2 0.720 9.075 3.541 1.00 0.00 H new ATOM 0 HB ILE A 2 1.813 8.952 0.702 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -0.622 7.537 1.891 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -0.727 8.988 0.914 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.077 6.524 1.190 1.00 0.00 H new ATOM 0 HG22 ILE A 2 3.048 7.517 2.302 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.514 6.804 2.854 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -1.029 6.960 -0.495 1.00 0.00 H new ATOM 0 HD12 ILE A 2 0.454 7.828 -0.961 1.00 0.00 H new ATOM 0 HD13 ILE A 2 0.560 6.354 0.031 1.00 0.00 H new ATOM 37 N ILE A 3 3.045 9.642 4.264 1.00 0.00 N ATOM 38 CA ILE A 3 4.384 9.995 4.691 1.00 0.00 C ATOM 39 C ILE A 3 5.319 8.823 4.382 1.00 0.00 C ATOM 40 O ILE A 3 4.993 7.665 4.684 1.00 0.00 O ATOM 41 CB ILE A 3 4.400 10.328 6.196 1.00 0.00 C ATOM 42 CG1 ILE A 3 3.192 11.214 6.556 1.00 0.00 C ATOM 43 CG2 ILE A 3 5.686 11.084 6.542 1.00 0.00 C ATOM 44 CD1 ILE A 3 3.211 12.520 5.761 1.00 0.00 C ATOM 0 H ILE A 3 2.487 9.151 4.962 1.00 0.00 H new ATOM 0 HA ILE A 3 4.722 10.882 4.155 1.00 0.00 H new ATOM 0 HB ILE A 3 4.350 9.397 6.760 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.267 10.674 6.352 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.204 11.434 7.623 1.00 0.00 H new ATOM 0 HG21 ILE A 3 5.695 11.318 7.606 1.00 0.00 H new ATOM 0 HG22 ILE A 3 6.549 10.464 6.300 1.00 0.00 H new ATOM 0 HG23 ILE A 3 5.731 12.009 5.967 1.00 0.00 H new ATOM 0 HD11 ILE A 3 2.347 13.125 6.035 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.125 13.069 5.986 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.174 12.297 4.695 1.00 0.00 H new ATOM 56 N ASN A 4 6.377 9.109 3.632 1.00 0.00 N ATOM 57 CA ASN A 4 7.281 8.076 3.118 1.00 0.00 C ATOM 58 C ASN A 4 8.570 7.986 3.908 1.00 0.00 C ATOM 59 O ASN A 4 9.362 8.934 3.933 1.00 0.00 O ATOM 60 CB ASN A 4 7.621 8.343 1.656 1.00 0.00 C ATOM 61 CG ASN A 4 8.598 7.289 1.157 1.00 0.00 C ATOM 62 OD1 ASN A 4 8.784 6.253 1.799 1.00 0.00 O ATOM 63 ND2 ASN A 4 9.248 7.491 0.066 1.00 0.00 N ATOM 0 H ASN A 4 6.635 10.058 3.362 1.00 0.00 H new ATOM 0 HA ASN A 4 6.752 7.128 3.218 1.00 0.00 H new ATOM 0 HB2 ASN A 4 6.713 8.326 1.053 1.00 0.00 H new ATOM 0 HB3 ASN A 4 8.057 9.336 1.549 1.00 0.00 H new ATOM 0 HD21 ASN A 4 9.916 6.795 -0.266 1.00 0.00 H new ATOM 0 HD22 ASN A 4 9.096 8.347 -0.467 1.00 0.00 H new ATOM 70 N ASN A 5 8.821 6.823 4.485 1.00 0.00 N ATOM 71 CA ASN A 5 10.071 6.576 5.203 1.00 0.00 C ATOM 72 C ASN A 5 11.006 5.692 4.387 1.00 0.00 C ATOM 73 O ASN A 5 12.022 5.229 4.897 1.00 0.00 O ATOM 74 CB ASN A 5 9.794 5.897 6.544 1.00 0.00 C ATOM 75 CG ASN A 5 8.950 6.795 7.411 1.00 0.00 C ATOM 76 OD1 ASN A 5 9.468 7.721 8.039 1.00 0.00 O ATOM 77 ND2 ASN A 5 7.674 6.593 7.474 1.00 0.00 N ATOM 0 H ASN A 5 8.178 6.031 4.473 1.00 0.00 H new ATOM 0 HA ASN A 5 10.548 7.542 5.371 1.00 0.00 H new ATOM 0 HB2 ASN A 5 9.282 4.948 6.382 1.00 0.00 H new ATOM 0 HB3 ASN A 5 10.734 5.670 7.047 1.00 0.00 H new ATOM 0 HD21 ASN A 5 7.089 7.202 8.046 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.253 5.825 6.952 1.00 0.00 H new ATOM 84 N LEU A 6 10.655 5.424 3.134 1.00 0.00 N ATOM 85 CA LEU A 6 11.439 4.489 2.324 1.00 0.00 C ATOM 86 C LEU A 6 12.862 4.965 2.174 1.00 0.00 C ATOM 87 O LEU A 6 13.801 4.186 2.343 1.00 0.00 O ATOM 88 CB LEU A 6 10.815 4.307 0.929 1.00 0.00 C ATOM 89 CG LEU A 6 11.694 3.357 0.087 1.00 0.00 C ATOM 90 CD1 LEU A 6 11.843 2.019 0.795 1.00 0.00 C ATOM 91 CD2 LEU A 6 11.053 3.126 -1.283 1.00 0.00 C ATOM 0 H LEU A 6 9.848 5.831 2.661 1.00 0.00 H new ATOM 0 HA LEU A 6 11.436 3.531 2.843 1.00 0.00 H new ATOM 0 HB2 LEU A 6 9.808 3.901 1.021 1.00 0.00 H new ATOM 0 HB3 LEU A 6 10.725 5.272 0.431 1.00 0.00 H new ATOM 0 HG LEU A 6 12.675 3.815 -0.040 1.00 0.00 H new ATOM 0 HD11 LEU A 6 12.465 1.356 0.193 1.00 0.00 H new ATOM 0 HD12 LEU A 6 12.311 2.172 1.767 1.00 0.00 H new ATOM 0 HD13 LEU A 6 10.860 1.569 0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 6 11.680 2.455 -1.870 1.00 0.00 H new ATOM 0 HD22 LEU A 6 10.067 2.680 -1.153 1.00 0.00 H new ATOM 0 HD23 LEU A 6 10.955 4.078 -1.804 1.00 0.00 H new ATOM 103 N LYS A 7 13.032 6.239 1.877 1.00 0.00 N ATOM 104 CA LYS A 7 14.363 6.771 1.707 1.00 0.00 C ATOM 105 C LYS A 7 15.164 6.566 2.981 1.00 0.00 C ATOM 106 O LYS A 7 16.288 6.071 2.947 1.00 0.00 O ATOM 107 CB LYS A 7 14.300 8.262 1.308 1.00 0.00 C ATOM 108 CG LYS A 7 13.930 9.154 2.510 1.00 0.00 C ATOM 109 CD LYS A 7 13.687 10.587 2.012 1.00 0.00 C ATOM 110 CE LYS A 7 13.339 11.506 3.189 1.00 0.00 C ATOM 111 NZ LYS A 7 14.590 11.946 3.857 1.00 0.00 N ATOM 0 H LYS A 7 12.276 6.913 1.751 1.00 0.00 H new ATOM 0 HA LYS A 7 14.866 6.238 0.900 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.264 8.573 0.906 1.00 0.00 H new ATOM 0 HB3 LYS A 7 13.565 8.396 0.514 1.00 0.00 H new ATOM 0 HG2 LYS A 7 13.037 8.770 3.003 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.732 9.143 3.248 1.00 0.00 H new ATOM 0 HD2 LYS A 7 14.576 10.958 1.502 1.00 0.00 H new ATOM 0 HD3 LYS A 7 12.876 10.594 1.284 1.00 0.00 H new ATOM 0 HE2 LYS A 7 12.778 12.371 2.836 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.700 10.980 3.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 14.356 12.570 4.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 15.108 11.115 4.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 15.184 12.462 3.177 1.00 0.00 H new ATOM 125 N LEU A 8 14.549 6.890 4.111 1.00 0.00 N ATOM 126 CA LEU A 8 15.188 6.705 5.401 1.00 0.00 C ATOM 127 C LEU A 8 15.410 5.224 5.661 1.00 0.00 C ATOM 128 O LEU A 8 16.479 4.804 6.104 1.00 0.00 O ATOM 129 CB LEU A 8 14.263 7.235 6.503 1.00 0.00 C ATOM 130 CG LEU A 8 14.044 8.743 6.340 1.00 0.00 C ATOM 131 CD1 LEU A 8 13.053 9.229 7.400 1.00 0.00 C ATOM 132 CD2 LEU A 8 15.373 9.487 6.485 1.00 0.00 C ATOM 0 H LEU A 8 13.608 7.282 4.157 1.00 0.00 H new ATOM 0 HA LEU A 8 16.140 7.236 5.400 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.305 6.716 6.463 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.697 7.028 7.481 1.00 0.00 H new ATOM 0 HG LEU A 8 13.640 8.943 5.348 1.00 0.00 H new ATOM 0 HD11 LEU A 8 12.895 10.302 7.286 1.00 0.00 H new ATOM 0 HD12 LEU A 8 12.104 8.708 7.277 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.453 9.024 8.393 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.205 10.558 6.367 1.00 0.00 H new ATOM 0 HD22 LEU A 8 15.794 9.292 7.471 1.00 0.00 H new ATOM 0 HD23 LEU A 8 16.068 9.142 5.720 1.00 0.00 H new ATOM 144 N ILE A 9 14.370 4.440 5.409 1.00 0.00 N ATOM 145 CA ILE A 9 14.417 3.018 5.662 1.00 0.00 C ATOM 146 C ILE A 9 15.416 2.323 4.766 1.00 0.00 C ATOM 147 O ILE A 9 16.195 1.497 5.226 1.00 0.00 O ATOM 148 CB ILE A 9 13.021 2.393 5.536 1.00 0.00 C ATOM 149 CG1 ILE A 9 12.141 2.906 6.679 1.00 0.00 C ATOM 150 CG2 ILE A 9 13.114 0.865 5.635 1.00 0.00 C ATOM 151 CD1 ILE A 9 10.694 2.497 6.430 1.00 0.00 C ATOM 0 H ILE A 9 13.484 4.772 5.028 1.00 0.00 H new ATOM 0 HA ILE A 9 14.756 2.877 6.688 1.00 0.00 H new ATOM 0 HB ILE A 9 12.594 2.667 4.571 1.00 0.00 H new ATOM 0 HG12 ILE A 9 12.487 2.499 7.629 1.00 0.00 H new ATOM 0 HG13 ILE A 9 12.216 3.991 6.751 1.00 0.00 H new ATOM 0 HG21 ILE A 9 12.117 0.433 5.544 1.00 0.00 H new ATOM 0 HG22 ILE A 9 13.748 0.486 4.833 1.00 0.00 H new ATOM 0 HG23 ILE A 9 13.543 0.588 6.598 1.00 0.00 H new ATOM 0 HD11 ILE A 9 10.067 2.862 7.244 1.00 0.00 H new ATOM 0 HD12 ILE A 9 10.352 2.926 5.488 1.00 0.00 H new ATOM 0 HD13 ILE A 9 10.627 1.410 6.380 1.00 0.00 H new ATOM 163 N ARG A 10 15.418 2.661 3.488 1.00 0.00 N ATOM 164 CA ARG A 10 16.331 1.999 2.580 1.00 0.00 C ATOM 165 C ARG A 10 17.763 2.225 3.020 1.00 0.00 C ATOM 166 O ARG A 10 18.557 1.282 3.094 1.00 0.00 O ATOM 167 CB ARG A 10 16.146 2.467 1.136 1.00 0.00 C ATOM 168 CG ARG A 10 17.111 1.670 0.257 1.00 0.00 C ATOM 169 CD ARG A 10 17.008 2.117 -1.206 1.00 0.00 C ATOM 170 NE ARG A 10 17.281 3.552 -1.342 1.00 0.00 N ATOM 171 CZ ARG A 10 18.388 4.155 -0.886 1.00 0.00 C ATOM 172 NH1 ARG A 10 19.359 3.473 -0.356 1.00 0.00 N ATOM 173 NH2 ARG A 10 18.498 5.436 -1.015 1.00 0.00 N ATOM 0 H ARG A 10 14.816 3.369 3.067 1.00 0.00 H new ATOM 0 HA ARG A 10 16.105 0.933 2.611 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.117 2.310 0.813 1.00 0.00 H new ATOM 0 HB3 ARG A 10 16.347 3.535 1.052 1.00 0.00 H new ATOM 0 HG2 ARG A 10 18.132 1.807 0.613 1.00 0.00 H new ATOM 0 HG3 ARG A 10 16.886 0.606 0.334 1.00 0.00 H new ATOM 0 HD2 ARG A 10 17.714 1.551 -1.813 1.00 0.00 H new ATOM 0 HD3 ARG A 10 16.011 1.896 -1.587 1.00 0.00 H new ATOM 0 HE ARG A 10 16.584 4.128 -1.814 1.00 0.00 H new ATOM 0 HH11 ARG A 10 19.288 2.458 -0.281 1.00 0.00 H new ATOM 0 HH12 ARG A 10 20.192 3.952 -0.015 1.00 0.00 H new ATOM 0 HH21 ARG A 10 17.750 5.970 -1.457 1.00 0.00 H new ATOM 0 HH22 ARG A 10 19.333 5.913 -0.674 1.00 0.00 H new ATOM 187 N GLU A 11 18.074 3.451 3.389 1.00 0.00 N ATOM 188 CA GLU A 11 19.385 3.744 3.914 1.00 0.00 C ATOM 189 C GLU A 11 19.563 3.043 5.252 1.00 0.00 C ATOM 190 O GLU A 11 20.637 2.528 5.551 1.00 0.00 O ATOM 191 CB GLU A 11 19.620 5.253 4.028 1.00 0.00 C ATOM 192 CG GLU A 11 19.657 5.869 2.610 1.00 0.00 C ATOM 193 CD GLU A 11 20.829 5.317 1.797 1.00 0.00 C ATOM 194 OE1 GLU A 11 21.780 4.844 2.386 1.00 0.00 O ATOM 195 OE2 GLU A 11 20.757 5.365 0.583 1.00 0.00 O ATOM 0 H GLU A 11 17.442 4.250 3.335 1.00 0.00 H new ATOM 0 HA GLU A 11 20.136 3.366 3.220 1.00 0.00 H new ATOM 0 HB2 GLU A 11 18.827 5.713 4.617 1.00 0.00 H new ATOM 0 HB3 GLU A 11 20.558 5.449 4.548 1.00 0.00 H new ATOM 0 HG2 GLU A 11 18.721 5.656 2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 11 19.741 6.953 2.684 1.00 0.00 H new ATOM 202 N LYS A 12 18.473 2.917 6.000 1.00 0.00 N ATOM 203 CA LYS A 12 18.493 2.160 7.233 1.00 0.00 C ATOM 204 C LYS A 12 18.825 0.715 6.898 1.00 0.00 C ATOM 205 O LYS A 12 19.701 0.104 7.518 1.00 0.00 O ATOM 206 CB LYS A 12 17.136 2.254 7.940 1.00 0.00 C ATOM 207 CG LYS A 12 17.234 1.633 9.335 1.00 0.00 C ATOM 208 CD LYS A 12 15.908 1.843 10.087 1.00 0.00 C ATOM 209 CE LYS A 12 15.649 3.345 10.299 1.00 0.00 C ATOM 210 NZ LYS A 12 16.933 4.062 10.533 1.00 0.00 N ATOM 0 H LYS A 12 17.569 3.330 5.770 1.00 0.00 H new ATOM 0 HA LYS A 12 19.246 2.565 7.909 1.00 0.00 H new ATOM 0 HB2 LYS A 12 16.827 3.297 8.017 1.00 0.00 H new ATOM 0 HB3 LYS A 12 16.374 1.738 7.355 1.00 0.00 H new ATOM 0 HG2 LYS A 12 17.454 0.568 9.256 1.00 0.00 H new ATOM 0 HG3 LYS A 12 18.055 2.088 9.890 1.00 0.00 H new ATOM 0 HD2 LYS A 12 15.087 1.401 9.522 1.00 0.00 H new ATOM 0 HD3 LYS A 12 15.943 1.333 11.050 1.00 0.00 H new ATOM 0 HE2 LYS A 12 15.146 3.761 9.426 1.00 0.00 H new ATOM 0 HE3 LYS A 12 14.983 3.490 11.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 16.738 5.000 10.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 17.520 3.515 11.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 17.439 4.172 9.631 1.00 0.00 H new ATOM 224 N LYS A 13 18.194 0.214 5.834 1.00 0.00 N ATOM 225 CA LYS A 13 18.492 -1.112 5.317 1.00 0.00 C ATOM 226 C LYS A 13 19.922 -1.130 4.823 1.00 0.00 C ATOM 227 O LYS A 13 20.613 -2.138 4.933 1.00 0.00 O ATOM 228 CB LYS A 13 17.558 -1.489 4.150 1.00 0.00 C ATOM 229 CG LYS A 13 16.075 -1.438 4.571 1.00 0.00 C ATOM 230 CD LYS A 13 15.889 -1.917 6.009 1.00 0.00 C ATOM 231 CE LYS A 13 16.192 -3.430 6.102 1.00 0.00 C ATOM 232 NZ LYS A 13 15.141 -4.110 6.896 1.00 0.00 N ATOM 0 H LYS A 13 17.471 0.713 5.316 1.00 0.00 H new ATOM 0 HA LYS A 13 18.344 -1.835 6.120 1.00 0.00 H new ATOM 0 HB2 LYS A 13 17.724 -0.807 3.316 1.00 0.00 H new ATOM 0 HB3 LYS A 13 17.802 -2.491 3.797 1.00 0.00 H new ATOM 0 HG2 LYS A 13 15.702 -0.418 4.474 1.00 0.00 H new ATOM 0 HG3 LYS A 13 15.483 -2.059 3.899 1.00 0.00 H new ATOM 0 HD2 LYS A 13 16.551 -1.363 6.675 1.00 0.00 H new ATOM 0 HD3 LYS A 13 14.869 -1.721 6.338 1.00 0.00 H new ATOM 0 HE2 LYS A 13 16.240 -3.862 5.102 1.00 0.00 H new ATOM 0 HE3 LYS A 13 17.167 -3.586 6.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 15.561 -4.904 7.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 14.722 -3.435 7.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 14.401 -4.468 6.259 1.00 0.00 H new ATOM 246 N LYS A 14 20.336 -0.009 4.244 1.00 0.00 N ATOM 247 CA LYS A 14 21.676 0.161 3.687 1.00 0.00 C ATOM 248 C LYS A 14 21.746 -0.494 2.321 1.00 0.00 C ATOM 249 O LYS A 14 22.821 -0.878 1.848 1.00 0.00 O ATOM 250 CB LYS A 14 22.738 -0.409 4.636 1.00 0.00 C ATOM 251 CG LYS A 14 22.535 0.230 6.013 1.00 0.00 C ATOM 252 CD LYS A 14 23.492 -0.371 7.038 1.00 0.00 C ATOM 253 CE LYS A 14 23.131 0.168 8.428 1.00 0.00 C ATOM 254 NZ LYS A 14 21.758 -0.286 8.791 1.00 0.00 N ATOM 0 H LYS A 14 19.746 0.817 4.146 1.00 0.00 H new ATOM 0 HA LYS A 14 21.883 1.225 3.572 1.00 0.00 H new ATOM 0 HB2 LYS A 14 22.647 -1.493 4.702 1.00 0.00 H new ATOM 0 HB3 LYS A 14 23.739 -0.195 4.261 1.00 0.00 H new ATOM 0 HG2 LYS A 14 22.696 1.306 5.946 1.00 0.00 H new ATOM 0 HG3 LYS A 14 21.506 0.081 6.339 1.00 0.00 H new ATOM 0 HD2 LYS A 14 23.423 -1.459 7.026 1.00 0.00 H new ATOM 0 HD3 LYS A 14 24.522 -0.114 6.789 1.00 0.00 H new ATOM 0 HE2 LYS A 14 23.851 -0.186 9.166 1.00 0.00 H new ATOM 0 HE3 LYS A 14 23.179 1.257 8.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 21.605 -0.147 9.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 21.057 0.266 8.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 21.653 -1.294 8.559 1.00 0.00 H new ATOM 268 N ILE A 15 20.603 -0.525 1.661 1.00 0.00 N ATOM 269 CA ILE A 15 20.475 -1.039 0.307 1.00 0.00 C ATOM 270 C ILE A 15 20.430 0.102 -0.683 1.00 0.00 C ATOM 271 O ILE A 15 19.774 1.114 -0.449 1.00 0.00 O ATOM 272 CB ILE A 15 19.225 -1.952 0.185 1.00 0.00 C ATOM 273 CG1 ILE A 15 19.626 -3.423 0.321 1.00 0.00 C ATOM 274 CG2 ILE A 15 18.502 -1.746 -1.140 1.00 0.00 C ATOM 275 CD1 ILE A 15 20.466 -3.627 1.573 1.00 0.00 C ATOM 0 H ILE A 15 19.724 -0.189 2.055 1.00 0.00 H new ATOM 0 HA ILE A 15 21.349 -1.648 0.076 1.00 0.00 H new ATOM 0 HB ILE A 15 18.545 -1.679 0.992 1.00 0.00 H new ATOM 0 HG12 ILE A 15 18.734 -4.048 0.368 1.00 0.00 H new ATOM 0 HG13 ILE A 15 20.189 -3.736 -0.558 1.00 0.00 H new ATOM 0 HG21 ILE A 15 17.633 -2.403 -1.186 1.00 0.00 H new ATOM 0 HG22 ILE A 15 18.177 -0.709 -1.220 1.00 0.00 H new ATOM 0 HG23 ILE A 15 19.177 -1.979 -1.963 1.00 0.00 H new ATOM 0 HD11 ILE A 15 20.744 -4.678 1.657 1.00 0.00 H new ATOM 0 HD12 ILE A 15 21.367 -3.017 1.510 1.00 0.00 H new ATOM 0 HD13 ILE A 15 19.889 -3.333 2.450 1.00 0.00 H new ATOM 287 N SER A 16 21.143 -0.050 -1.765 1.00 0.00 N ATOM 288 CA SER A 16 21.180 0.960 -2.783 1.00 0.00 C ATOM 289 C SER A 16 19.840 0.983 -3.500 1.00 0.00 C ATOM 290 O SER A 16 19.242 -0.070 -3.740 1.00 0.00 O ATOM 291 CB SER A 16 22.296 0.632 -3.773 1.00 0.00 C ATOM 292 OG SER A 16 23.433 0.158 -3.047 1.00 0.00 O ATOM 0 H SER A 16 21.711 -0.873 -1.964 1.00 0.00 H new ATOM 0 HA SER A 16 21.371 1.937 -2.339 1.00 0.00 H new ATOM 0 HB2 SER A 16 21.960 -0.124 -4.483 1.00 0.00 H new ATOM 0 HB3 SER A 16 22.560 1.518 -4.351 1.00 0.00 H new ATOM 0 HG SER A 16 23.427 -0.822 -3.033 1.00 0.00 H new ATOM 298 N GLN A 17 19.394 2.149 -3.903 1.00 0.00 N ATOM 299 CA GLN A 17 18.151 2.218 -4.664 1.00 0.00 C ATOM 300 C GLN A 17 18.306 1.349 -5.900 1.00 0.00 C ATOM 301 O GLN A 17 17.344 0.751 -6.382 1.00 0.00 O ATOM 302 CB GLN A 17 17.808 3.665 -5.076 1.00 0.00 C ATOM 303 CG GLN A 17 19.084 4.480 -5.254 1.00 0.00 C ATOM 304 CD GLN A 17 18.738 5.861 -5.739 1.00 0.00 C ATOM 305 OE1 GLN A 17 19.187 6.266 -6.808 1.00 0.00 O ATOM 306 NE2 GLN A 17 17.956 6.608 -5.036 1.00 0.00 N ATOM 0 H GLN A 17 19.851 3.044 -3.728 1.00 0.00 H new ATOM 0 HA GLN A 17 17.332 1.862 -4.038 1.00 0.00 H new ATOM 0 HB2 GLN A 17 17.238 3.661 -6.005 1.00 0.00 H new ATOM 0 HB3 GLN A 17 17.176 4.127 -4.317 1.00 0.00 H new ATOM 0 HG2 GLN A 17 19.624 4.540 -4.309 1.00 0.00 H new ATOM 0 HG3 GLN A 17 19.745 3.988 -5.968 1.00 0.00 H new ATOM 0 HE21 GLN A 17 17.586 6.266 -4.149 1.00 0.00 H new ATOM 0 HE22 GLN A 17 17.708 7.540 -5.367 1.00 0.00 H new ATOM 315 N SER A 18 19.539 1.269 -6.382 1.00 0.00 N ATOM 316 CA SER A 18 19.869 0.495 -7.560 1.00 0.00 C ATOM 317 C SER A 18 19.504 -0.980 -7.379 1.00 0.00 C ATOM 318 O SER A 18 18.904 -1.586 -8.274 1.00 0.00 O ATOM 319 CB SER A 18 21.366 0.626 -7.828 1.00 0.00 C ATOM 320 OG SER A 18 21.771 1.962 -7.530 1.00 0.00 O ATOM 0 H SER A 18 20.338 1.743 -5.961 1.00 0.00 H new ATOM 0 HA SER A 18 19.295 0.878 -8.404 1.00 0.00 H new ATOM 0 HB2 SER A 18 21.923 -0.083 -7.215 1.00 0.00 H new ATOM 0 HB3 SER A 18 21.585 0.388 -8.869 1.00 0.00 H new ATOM 0 HG SER A 18 22.732 2.057 -7.697 1.00 0.00 H new ATOM 326 N GLU A 19 19.827 -1.564 -6.216 1.00 0.00 N ATOM 327 CA GLU A 19 19.455 -2.949 -5.989 1.00 0.00 C ATOM 328 C GLU A 19 17.991 -3.076 -5.591 1.00 0.00 C ATOM 329 O GLU A 19 17.280 -3.933 -6.100 1.00 0.00 O ATOM 330 CB GLU A 19 20.413 -3.688 -5.019 1.00 0.00 C ATOM 331 CG GLU A 19 20.554 -2.972 -3.656 1.00 0.00 C ATOM 332 CD GLU A 19 22.010 -2.957 -3.213 1.00 0.00 C ATOM 333 OE1 GLU A 19 22.729 -3.862 -3.571 1.00 0.00 O ATOM 334 OE2 GLU A 19 22.391 -2.045 -2.519 1.00 0.00 O ATOM 0 H GLU A 19 20.326 -1.112 -5.450 1.00 0.00 H new ATOM 0 HA GLU A 19 19.569 -3.463 -6.943 1.00 0.00 H new ATOM 0 HB2 GLU A 19 20.047 -4.702 -4.856 1.00 0.00 H new ATOM 0 HB3 GLU A 19 21.396 -3.775 -5.482 1.00 0.00 H new ATOM 0 HG2 GLU A 19 20.180 -1.951 -3.734 1.00 0.00 H new ATOM 0 HG3 GLU A 19 19.945 -3.478 -2.907 1.00 0.00 H new ATOM 341 N LEU A 20 17.517 -2.131 -4.781 1.00 0.00 N ATOM 342 CA LEU A 20 16.116 -2.122 -4.353 1.00 0.00 C ATOM 343 C LEU A 20 15.200 -1.995 -5.553 1.00 0.00 C ATOM 344 O LEU A 20 14.216 -2.731 -5.678 1.00 0.00 O ATOM 345 CB LEU A 20 15.842 -0.948 -3.399 1.00 0.00 C ATOM 346 CG LEU A 20 14.363 -0.975 -2.952 1.00 0.00 C ATOM 347 CD1 LEU A 20 14.093 -2.208 -2.090 1.00 0.00 C ATOM 348 CD2 LEU A 20 14.026 0.289 -2.159 1.00 0.00 C ATOM 0 H LEU A 20 18.078 -1.365 -4.409 1.00 0.00 H new ATOM 0 HA LEU A 20 15.922 -3.061 -3.835 1.00 0.00 H new ATOM 0 HB2 LEU A 20 16.496 -1.013 -2.529 1.00 0.00 H new ATOM 0 HB3 LEU A 20 16.065 -0.004 -3.896 1.00 0.00 H new ATOM 0 HG LEU A 20 13.735 -1.017 -3.842 1.00 0.00 H new ATOM 0 HD11 LEU A 20 13.047 -2.215 -1.782 1.00 0.00 H new ATOM 0 HD12 LEU A 20 14.307 -3.108 -2.666 1.00 0.00 H new ATOM 0 HD13 LEU A 20 14.731 -2.181 -1.207 1.00 0.00 H new ATOM 0 HD21 LEU A 20 12.981 0.257 -1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.664 0.346 -1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 20 14.193 1.166 -2.784 1.00 0.00 H new ATOM 360 N ALA A 21 15.535 -1.092 -6.462 1.00 0.00 N ATOM 361 CA ALA A 21 14.729 -0.926 -7.657 1.00 0.00 C ATOM 362 C ALA A 21 14.688 -2.242 -8.410 1.00 0.00 C ATOM 363 O ALA A 21 13.639 -2.656 -8.921 1.00 0.00 O ATOM 364 CB ALA A 21 15.297 0.185 -8.548 1.00 0.00 C ATOM 0 H ALA A 21 16.344 -0.474 -6.396 1.00 0.00 H new ATOM 0 HA ALA A 21 13.718 -0.636 -7.371 1.00 0.00 H new ATOM 0 HB1 ALA A 21 14.676 0.291 -9.438 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.305 1.125 -7.997 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.314 -0.070 -8.844 1.00 0.00 H new ATOM 370 N ALA A 22 15.809 -2.945 -8.381 1.00 0.00 N ATOM 371 CA ALA A 22 15.896 -4.265 -8.964 1.00 0.00 C ATOM 372 C ALA A 22 14.979 -5.231 -8.232 1.00 0.00 C ATOM 373 O ALA A 22 14.349 -6.079 -8.857 1.00 0.00 O ATOM 374 CB ALA A 22 17.341 -4.780 -8.935 1.00 0.00 C ATOM 0 H ALA A 22 16.675 -2.616 -7.955 1.00 0.00 H new ATOM 0 HA ALA A 22 15.576 -4.198 -10.004 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.382 -5.775 -9.379 1.00 0.00 H new ATOM 0 HB2 ALA A 22 17.980 -4.103 -9.502 1.00 0.00 H new ATOM 0 HB3 ALA A 22 17.689 -4.829 -7.903 1.00 0.00 H new ATOM 380 N LEU A 23 14.916 -5.117 -6.902 1.00 0.00 N ATOM 381 CA LEU A 23 14.069 -6.021 -6.114 1.00 0.00 C ATOM 382 C LEU A 23 12.625 -5.803 -6.527 1.00 0.00 C ATOM 383 O LEU A 23 11.871 -6.746 -6.780 1.00 0.00 O ATOM 384 CB LEU A 23 14.168 -5.694 -4.612 1.00 0.00 C ATOM 385 CG LEU A 23 15.629 -5.615 -4.144 1.00 0.00 C ATOM 386 CD1 LEU A 23 15.678 -5.281 -2.657 1.00 0.00 C ATOM 387 CD2 LEU A 23 16.373 -6.916 -4.405 1.00 0.00 C ATOM 0 H LEU A 23 15.429 -4.424 -6.357 1.00 0.00 H new ATOM 0 HA LEU A 23 14.396 -7.046 -6.289 1.00 0.00 H new ATOM 0 HB2 LEU A 23 13.670 -4.745 -4.412 1.00 0.00 H new ATOM 0 HB3 LEU A 23 13.642 -6.457 -4.038 1.00 0.00 H new ATOM 0 HG LEU A 23 16.121 -4.828 -4.715 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.716 -5.226 -2.330 1.00 0.00 H new ATOM 0 HD12 LEU A 23 15.192 -4.321 -2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 23 15.161 -6.057 -2.093 1.00 0.00 H new ATOM 0 HD21 LEU A 23 17.403 -6.822 -4.061 1.00 0.00 H new ATOM 0 HD22 LEU A 23 15.884 -7.729 -3.868 1.00 0.00 H new ATOM 0 HD23 LEU A 23 16.366 -7.131 -5.474 1.00 0.00 H new ATOM 399 N LEU A 24 12.276 -4.534 -6.653 1.00 0.00 N ATOM 400 CA LEU A 24 10.957 -4.119 -7.100 1.00 0.00 C ATOM 401 C LEU A 24 10.737 -4.502 -8.534 1.00 0.00 C ATOM 402 O LEU A 24 9.589 -4.648 -8.964 1.00 0.00 O ATOM 403 CB LEU A 24 10.769 -2.613 -6.927 1.00 0.00 C ATOM 404 CG LEU A 24 10.231 -2.303 -5.524 1.00 0.00 C ATOM 405 CD1 LEU A 24 11.104 -2.985 -4.456 1.00 0.00 C ATOM 406 CD2 LEU A 24 10.253 -0.785 -5.307 1.00 0.00 C ATOM 0 H LEU A 24 12.904 -3.757 -6.447 1.00 0.00 H new ATOM 0 HA LEU A 24 10.220 -4.633 -6.482 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.719 -2.101 -7.081 1.00 0.00 H new ATOM 0 HB3 LEU A 24 10.077 -2.237 -7.681 1.00 0.00 H new ATOM 0 HG LEU A 24 9.212 -2.680 -5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 24 10.711 -2.757 -3.465 1.00 0.00 H new ATOM 0 HD12 LEU A 24 11.093 -4.064 -4.611 1.00 0.00 H new ATOM 0 HD13 LEU A 24 12.127 -2.618 -4.534 1.00 0.00 H new ATOM 0 HD21 LEU A 24 9.872 -0.554 -4.312 1.00 0.00 H new ATOM 0 HD22 LEU A 24 11.276 -0.419 -5.398 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.627 -0.301 -6.056 1.00 0.00 H new ATOM 418 N GLU A 25 11.829 -4.510 -9.294 1.00 0.00 N ATOM 419 CA GLU A 25 11.806 -4.717 -10.739 1.00 0.00 C ATOM 420 C GLU A 25 11.440 -3.405 -11.427 1.00 0.00 C ATOM 421 O GLU A 25 10.790 -3.386 -12.482 1.00 0.00 O ATOM 422 CB GLU A 25 10.814 -5.832 -11.107 1.00 0.00 C ATOM 423 CG GLU A 25 11.302 -7.157 -10.496 1.00 0.00 C ATOM 424 CD GLU A 25 10.237 -8.224 -10.624 1.00 0.00 C ATOM 425 OE1 GLU A 25 9.107 -7.947 -10.277 1.00 0.00 O ATOM 426 OE2 GLU A 25 10.560 -9.303 -11.063 1.00 0.00 O ATOM 0 H GLU A 25 12.767 -4.371 -8.918 1.00 0.00 H new ATOM 0 HA GLU A 25 12.793 -5.031 -11.079 1.00 0.00 H new ATOM 0 HB2 GLU A 25 9.819 -5.589 -10.734 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.735 -5.923 -12.190 1.00 0.00 H new ATOM 0 HG2 GLU A 25 12.213 -7.482 -10.998 1.00 0.00 H new ATOM 0 HG3 GLU A 25 11.553 -7.009 -9.446 1.00 0.00 H new ATOM 433 N VAL A 26 11.923 -2.313 -10.844 1.00 0.00 N ATOM 434 CA VAL A 26 11.741 -0.972 -11.385 1.00 0.00 C ATOM 435 C VAL A 26 13.092 -0.260 -11.463 1.00 0.00 C ATOM 436 O VAL A 26 14.074 -0.719 -10.879 1.00 0.00 O ATOM 437 CB VAL A 26 10.770 -0.159 -10.514 1.00 0.00 C ATOM 438 CG1 VAL A 26 9.415 -0.869 -10.450 1.00 0.00 C ATOM 439 CG2 VAL A 26 11.335 -0.003 -9.097 1.00 0.00 C ATOM 0 H VAL A 26 12.456 -2.335 -9.975 1.00 0.00 H new ATOM 0 HA VAL A 26 11.316 -1.056 -12.385 1.00 0.00 H new ATOM 0 HB VAL A 26 10.642 0.829 -10.957 1.00 0.00 H new ATOM 0 HG11 VAL A 26 8.729 -0.290 -9.832 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.005 -0.963 -11.456 1.00 0.00 H new ATOM 0 HG13 VAL A 26 9.544 -1.861 -10.017 1.00 0.00 H new ATOM 0 HG21 VAL A 26 10.639 0.575 -8.489 1.00 0.00 H new ATOM 0 HG22 VAL A 26 11.476 -0.988 -8.651 1.00 0.00 H new ATOM 0 HG23 VAL A 26 12.293 0.515 -9.142 1.00 0.00 H new ATOM 449 N SER A 27 13.126 0.864 -12.150 1.00 0.00 N ATOM 450 CA SER A 27 14.338 1.672 -12.249 1.00 0.00 C ATOM 451 C SER A 27 14.509 2.512 -10.971 1.00 0.00 C ATOM 452 O SER A 27 13.552 2.688 -10.192 1.00 0.00 O ATOM 453 CB SER A 27 14.256 2.582 -13.488 1.00 0.00 C ATOM 454 OG SER A 27 15.424 3.393 -13.589 1.00 0.00 O ATOM 0 H SER A 27 12.325 1.246 -12.653 1.00 0.00 H new ATOM 0 HA SER A 27 15.204 1.018 -12.354 1.00 0.00 H new ATOM 0 HB2 SER A 27 14.149 1.974 -14.387 1.00 0.00 H new ATOM 0 HB3 SER A 27 13.371 3.215 -13.424 1.00 0.00 H new ATOM 0 HG SER A 27 15.358 3.965 -14.382 1.00 0.00 H new ATOM 460 N ARG A 28 15.704 3.083 -10.789 1.00 0.00 N ATOM 461 CA ARG A 28 15.997 3.942 -9.633 1.00 0.00 C ATOM 462 C ARG A 28 15.066 5.127 -9.606 1.00 0.00 C ATOM 463 O ARG A 28 14.732 5.636 -8.541 1.00 0.00 O ATOM 464 CB ARG A 28 17.451 4.439 -9.652 1.00 0.00 C ATOM 465 CG ARG A 28 18.399 3.286 -9.338 1.00 0.00 C ATOM 466 CD ARG A 28 19.854 3.752 -9.470 1.00 0.00 C ATOM 467 NE ARG A 28 20.143 4.833 -8.526 1.00 0.00 N ATOM 468 CZ ARG A 28 21.335 5.437 -8.491 1.00 0.00 C ATOM 469 NH1 ARG A 28 22.302 5.022 -9.269 1.00 0.00 N ATOM 470 NH2 ARG A 28 21.531 6.434 -7.677 1.00 0.00 N ATOM 0 H ARG A 28 16.489 2.966 -11.430 1.00 0.00 H new ATOM 0 HA ARG A 28 15.849 3.339 -8.737 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.688 4.860 -10.629 1.00 0.00 H new ATOM 0 HB3 ARG A 28 17.581 5.237 -8.921 1.00 0.00 H new ATOM 0 HG2 ARG A 28 18.216 2.919 -8.328 1.00 0.00 H new ATOM 0 HG3 ARG A 28 18.212 2.455 -10.018 1.00 0.00 H new ATOM 0 HD2 ARG A 28 20.527 2.914 -9.287 1.00 0.00 H new ATOM 0 HD3 ARG A 28 20.040 4.093 -10.488 1.00 0.00 H new ATOM 0 HE ARG A 28 19.415 5.133 -7.878 1.00 0.00 H new ATOM 0 HH11 ARG A 28 22.146 4.238 -9.902 1.00 0.00 H new ATOM 0 HH12 ARG A 28 23.212 5.483 -9.242 1.00 0.00 H new ATOM 0 HH21 ARG A 28 20.776 6.752 -7.069 1.00 0.00 H new ATOM 0 HH22 ARG A 28 22.439 6.897 -7.647 1.00 0.00 H new ATOM 484 N GLN A 29 14.673 5.586 -10.779 1.00 0.00 N ATOM 485 CA GLN A 29 13.812 6.753 -10.878 1.00 0.00 C ATOM 486 C GLN A 29 12.600 6.526 -10.007 1.00 0.00 C ATOM 487 O GLN A 29 12.147 7.425 -9.295 1.00 0.00 O ATOM 488 CB GLN A 29 13.340 6.931 -12.320 1.00 0.00 C ATOM 489 CG GLN A 29 14.535 7.189 -13.234 1.00 0.00 C ATOM 490 CD GLN A 29 14.065 7.303 -14.675 1.00 0.00 C ATOM 491 OE1 GLN A 29 12.877 7.525 -14.932 1.00 0.00 O ATOM 492 NE2 GLN A 29 14.903 7.125 -15.623 1.00 0.00 N ATOM 0 H GLN A 29 14.934 5.172 -11.674 1.00 0.00 H new ATOM 0 HA GLN A 29 14.362 7.639 -10.561 1.00 0.00 H new ATOM 0 HB2 GLN A 29 12.806 6.039 -12.649 1.00 0.00 H new ATOM 0 HB3 GLN A 29 12.639 7.763 -12.381 1.00 0.00 H new ATOM 0 HG2 GLN A 29 15.043 8.105 -12.934 1.00 0.00 H new ATOM 0 HG3 GLN A 29 15.258 6.379 -13.141 1.00 0.00 H new ATOM 0 HE21 GLN A 29 15.883 6.942 -15.409 1.00 0.00 H new ATOM 0 HE22 GLN A 29 14.592 7.166 -16.593 1.00 0.00 H new ATOM 501 N THR A 30 12.105 5.310 -10.038 1.00 0.00 N ATOM 502 CA THR A 30 10.970 4.937 -9.224 1.00 0.00 C ATOM 503 C THR A 30 11.319 5.109 -7.747 1.00 0.00 C ATOM 504 O THR A 30 10.645 5.833 -7.019 1.00 0.00 O ATOM 505 CB THR A 30 10.625 3.469 -9.494 1.00 0.00 C ATOM 506 OG1 THR A 30 11.213 3.072 -10.735 1.00 0.00 O ATOM 507 CG2 THR A 30 9.106 3.290 -9.565 1.00 0.00 C ATOM 0 H THR A 30 12.473 4.558 -10.621 1.00 0.00 H new ATOM 0 HA THR A 30 10.119 5.572 -9.470 1.00 0.00 H new ATOM 0 HB THR A 30 11.015 2.851 -8.685 1.00 0.00 H new ATOM 0 HG1 THR A 30 12.098 2.686 -10.569 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.872 2.243 -9.757 1.00 0.00 H new ATOM 0 HG22 THR A 30 8.659 3.594 -8.618 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.704 3.905 -10.370 1.00 0.00 H new ATOM 515 N ILE A 31 12.436 4.517 -7.342 1.00 0.00 N ATOM 516 CA ILE A 31 12.899 4.628 -5.971 1.00 0.00 C ATOM 517 C ILE A 31 13.221 6.071 -5.650 1.00 0.00 C ATOM 518 O ILE A 31 12.721 6.618 -4.685 1.00 0.00 O ATOM 519 CB ILE A 31 14.147 3.755 -5.764 1.00 0.00 C ATOM 520 CG1 ILE A 31 13.852 2.302 -6.178 1.00 0.00 C ATOM 521 CG2 ILE A 31 14.549 3.780 -4.288 1.00 0.00 C ATOM 522 CD1 ILE A 31 12.727 1.721 -5.312 1.00 0.00 C ATOM 0 H ILE A 31 13.036 3.956 -7.946 1.00 0.00 H new ATOM 0 HA ILE A 31 12.110 4.282 -5.303 1.00 0.00 H new ATOM 0 HB ILE A 31 14.957 4.148 -6.378 1.00 0.00 H new ATOM 0 HG12 ILE A 31 13.566 2.267 -7.229 1.00 0.00 H new ATOM 0 HG13 ILE A 31 14.752 1.696 -6.072 1.00 0.00 H new ATOM 0 HG21 ILE A 31 15.434 3.161 -4.141 1.00 0.00 H new ATOM 0 HG22 ILE A 31 14.769 4.805 -3.988 1.00 0.00 H new ATOM 0 HG23 ILE A 31 13.731 3.392 -3.681 1.00 0.00 H new ATOM 0 HD11 ILE A 31 12.528 0.693 -5.615 1.00 0.00 H new ATOM 0 HD12 ILE A 31 13.028 1.739 -4.265 1.00 0.00 H new ATOM 0 HD13 ILE A 31 11.824 2.318 -5.440 1.00 0.00 H new ATOM 534 N ASN A 32 13.960 6.717 -6.527 1.00 0.00 N ATOM 535 CA ASN A 32 14.307 8.110 -6.320 1.00 0.00 C ATOM 536 C ASN A 32 13.055 8.955 -6.255 1.00 0.00 C ATOM 537 O ASN A 32 12.898 9.779 -5.353 1.00 0.00 O ATOM 538 CB ASN A 32 15.230 8.616 -7.432 1.00 0.00 C ATOM 539 CG ASN A 32 16.658 8.210 -7.129 1.00 0.00 C ATOM 540 OD1 ASN A 32 17.236 8.690 -6.146 1.00 0.00 O ATOM 541 ND2 ASN A 32 17.267 7.338 -7.880 1.00 0.00 N ATOM 0 H ASN A 32 14.330 6.306 -7.384 1.00 0.00 H new ATOM 0 HA ASN A 32 14.840 8.191 -5.373 1.00 0.00 H new ATOM 0 HB2 ASN A 32 14.920 8.204 -8.392 1.00 0.00 H new ATOM 0 HB3 ASN A 32 15.159 9.701 -7.513 1.00 0.00 H new ATOM 0 HD21 ASN A 32 18.220 7.051 -7.658 1.00 0.00 H new ATOM 0 HD22 ASN A 32 16.791 6.942 -8.690 1.00 0.00 H new ATOM 548 N GLY A 33 12.114 8.666 -7.133 1.00 0.00 N ATOM 549 CA GLY A 33 10.838 9.345 -7.095 1.00 0.00 C ATOM 550 C GLY A 33 10.162 9.081 -5.769 1.00 0.00 C ATOM 551 O GLY A 33 9.683 10.007 -5.109 1.00 0.00 O ATOM 0 H GLY A 33 12.209 7.972 -7.874 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.981 10.417 -7.235 1.00 0.00 H new ATOM 0 HA3 GLY A 33 10.206 8.998 -7.912 1.00 0.00 H new ATOM 555 N ILE A 34 10.177 7.819 -5.352 1.00 0.00 N ATOM 556 CA ILE A 34 9.616 7.434 -4.067 1.00 0.00 C ATOM 557 C ILE A 34 10.392 8.084 -2.931 1.00 0.00 C ATOM 558 O ILE A 34 9.801 8.618 -1.991 1.00 0.00 O ATOM 559 CB ILE A 34 9.664 5.900 -3.921 1.00 0.00 C ATOM 560 CG1 ILE A 34 8.714 5.242 -4.924 1.00 0.00 C ATOM 561 CG2 ILE A 34 9.247 5.486 -2.507 1.00 0.00 C ATOM 562 CD1 ILE A 34 8.998 3.739 -4.971 1.00 0.00 C ATOM 0 H ILE A 34 10.573 7.047 -5.888 1.00 0.00 H new ATOM 0 HA ILE A 34 8.581 7.772 -4.020 1.00 0.00 H new ATOM 0 HB ILE A 34 10.686 5.574 -4.113 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.679 5.420 -4.634 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.848 5.681 -5.913 1.00 0.00 H new ATOM 0 HG21 ILE A 34 9.286 4.400 -2.419 1.00 0.00 H new ATOM 0 HG22 ILE A 34 9.927 5.933 -1.782 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.231 5.830 -2.312 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.324 3.264 -5.684 1.00 0.00 H new ATOM 0 HD12 ILE A 34 10.030 3.573 -5.281 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.842 3.308 -3.982 1.00 0.00 H new ATOM 574 N GLU A 35 11.712 8.034 -3.014 1.00 0.00 N ATOM 575 CA GLU A 35 12.550 8.569 -1.955 1.00 0.00 C ATOM 576 C GLU A 35 12.355 10.061 -1.854 1.00 0.00 C ATOM 577 O GLU A 35 12.272 10.618 -0.766 1.00 0.00 O ATOM 578 CB GLU A 35 14.024 8.313 -2.257 1.00 0.00 C ATOM 579 CG GLU A 35 14.366 6.825 -2.201 1.00 0.00 C ATOM 580 CD GLU A 35 15.846 6.639 -2.522 1.00 0.00 C ATOM 581 OE1 GLU A 35 16.493 7.612 -2.878 1.00 0.00 O ATOM 582 OE2 GLU A 35 16.325 5.543 -2.399 1.00 0.00 O ATOM 0 H GLU A 35 12.223 7.631 -3.799 1.00 0.00 H new ATOM 0 HA GLU A 35 12.269 8.078 -1.023 1.00 0.00 H new ATOM 0 HB2 GLU A 35 14.266 8.704 -3.245 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.641 8.855 -1.540 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.143 6.425 -1.212 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.754 6.272 -2.914 1.00 0.00 H new ATOM 589 N LYS A 36 12.316 10.701 -2.995 1.00 0.00 N ATOM 590 CA LYS A 36 12.167 12.133 -3.051 1.00 0.00 C ATOM 591 C LYS A 36 10.698 12.509 -3.038 1.00 0.00 C ATOM 592 O LYS A 36 10.347 13.692 -3.035 1.00 0.00 O ATOM 593 CB LYS A 36 12.908 12.702 -4.276 1.00 0.00 C ATOM 594 CG LYS A 36 14.434 12.670 -3.999 1.00 0.00 C ATOM 595 CD LYS A 36 15.003 11.261 -4.267 1.00 0.00 C ATOM 596 CE LYS A 36 16.484 11.201 -3.846 1.00 0.00 C ATOM 597 NZ LYS A 36 17.022 9.812 -4.027 1.00 0.00 N ATOM 0 H LYS A 36 12.386 10.248 -3.906 1.00 0.00 H new ATOM 0 HA LYS A 36 12.622 12.579 -2.166 1.00 0.00 H new ATOM 0 HB2 LYS A 36 12.674 12.115 -5.164 1.00 0.00 H new ATOM 0 HB3 LYS A 36 12.582 13.723 -4.473 1.00 0.00 H new ATOM 0 HG2 LYS A 36 14.940 13.399 -4.632 1.00 0.00 H new ATOM 0 HG3 LYS A 36 14.628 12.956 -2.965 1.00 0.00 H new ATOM 0 HD2 LYS A 36 14.429 10.517 -3.714 1.00 0.00 H new ATOM 0 HD3 LYS A 36 14.907 11.016 -5.325 1.00 0.00 H new ATOM 0 HE2 LYS A 36 17.067 11.904 -4.441 1.00 0.00 H new ATOM 0 HE3 LYS A 36 16.585 11.504 -2.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 18.030 9.794 -3.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 16.498 9.154 -3.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 16.911 9.524 -5.020 1.00 0.00 H new ATOM 611 N ASN A 37 9.844 11.491 -2.988 1.00 0.00 N ATOM 612 CA ASN A 37 8.397 11.682 -2.924 1.00 0.00 C ATOM 613 C ASN A 37 7.891 12.498 -4.093 1.00 0.00 C ATOM 614 O ASN A 37 6.917 13.243 -3.969 1.00 0.00 O ATOM 615 CB ASN A 37 7.984 12.334 -1.595 1.00 0.00 C ATOM 616 CG ASN A 37 8.085 11.324 -0.460 1.00 0.00 C ATOM 617 OD1 ASN A 37 7.259 10.408 -0.371 1.00 0.00 O ATOM 618 ND2 ASN A 37 9.048 11.422 0.409 1.00 0.00 N ATOM 0 H ASN A 37 10.133 10.513 -2.991 1.00 0.00 H new ATOM 0 HA ASN A 37 7.938 10.695 -2.981 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.625 13.191 -1.387 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.963 12.710 -1.668 1.00 0.00 H new ATOM 0 HD21 ASN A 37 9.123 10.742 1.166 1.00 0.00 H new ATOM 0 HD22 ASN A 37 9.728 12.178 0.333 1.00 0.00 H new ATOM 625 N LYS A 38 8.521 12.326 -5.241 1.00 0.00 N ATOM 626 CA LYS A 38 8.066 12.995 -6.452 1.00 0.00 C ATOM 627 C LYS A 38 6.688 12.466 -6.803 1.00 0.00 C ATOM 628 O LYS A 38 5.782 13.216 -7.155 1.00 0.00 O ATOM 629 CB LYS A 38 9.034 12.730 -7.609 1.00 0.00 C ATOM 630 CG LYS A 38 10.391 13.382 -7.308 1.00 0.00 C ATOM 631 CD LYS A 38 11.347 13.115 -8.475 1.00 0.00 C ATOM 632 CE LYS A 38 12.751 13.633 -8.133 1.00 0.00 C ATOM 633 NZ LYS A 38 12.684 15.069 -7.740 1.00 0.00 N ATOM 0 H LYS A 38 9.343 11.734 -5.363 1.00 0.00 H new ATOM 0 HA LYS A 38 8.026 14.071 -6.282 1.00 0.00 H new ATOM 0 HB2 LYS A 38 9.159 11.657 -7.753 1.00 0.00 H new ATOM 0 HB3 LYS A 38 8.625 13.130 -8.537 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.268 14.455 -7.161 1.00 0.00 H new ATOM 0 HG3 LYS A 38 10.805 12.979 -6.384 1.00 0.00 H new ATOM 0 HD2 LYS A 38 11.386 12.046 -8.686 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.979 13.605 -9.377 1.00 0.00 H new ATOM 0 HE2 LYS A 38 13.176 13.045 -7.320 1.00 0.00 H new ATOM 0 HE3 LYS A 38 13.411 13.513 -8.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 13.635 15.487 -7.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 12.048 15.577 -8.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 12.322 15.146 -6.768 1.00 0.00 H new ATOM 647 N TYR A 39 6.540 11.167 -6.634 1.00 0.00 N ATOM 648 CA TYR A 39 5.285 10.470 -6.846 1.00 0.00 C ATOM 649 C TYR A 39 5.191 9.274 -5.917 1.00 0.00 C ATOM 650 O TYR A 39 6.204 8.817 -5.387 1.00 0.00 O ATOM 651 CB TYR A 39 5.130 10.052 -8.317 1.00 0.00 C ATOM 652 CG TYR A 39 6.404 9.400 -8.823 1.00 0.00 C ATOM 653 CD1 TYR A 39 6.604 8.019 -8.684 1.00 0.00 C ATOM 654 CD2 TYR A 39 7.380 10.186 -9.451 1.00 0.00 C ATOM 655 CE1 TYR A 39 7.779 7.431 -9.175 1.00 0.00 C ATOM 656 CE2 TYR A 39 8.552 9.598 -9.935 1.00 0.00 C ATOM 657 CZ TYR A 39 8.752 8.222 -9.800 1.00 0.00 C ATOM 658 OH TYR A 39 9.907 7.644 -10.291 1.00 0.00 O ATOM 0 H TYR A 39 7.301 10.555 -6.340 1.00 0.00 H new ATOM 0 HA TYR A 39 4.464 11.148 -6.614 1.00 0.00 H new ATOM 0 HB2 TYR A 39 4.295 9.359 -8.418 1.00 0.00 H new ATOM 0 HB3 TYR A 39 4.895 10.925 -8.926 1.00 0.00 H new ATOM 0 HD1 TYR A 39 5.855 7.410 -8.200 1.00 0.00 H new ATOM 0 HD2 TYR A 39 7.226 11.249 -9.561 1.00 0.00 H new ATOM 0 HE1 TYR A 39 7.934 6.367 -9.071 1.00 0.00 H new ATOM 0 HE2 TYR A 39 9.304 10.208 -10.414 1.00 0.00 H new ATOM 0 HH TYR A 39 10.683 8.008 -9.815 1.00 0.00 H new ATOM 668 N ASN A 40 3.975 8.790 -5.680 1.00 0.00 N ATOM 669 CA ASN A 40 3.783 7.659 -4.768 1.00 0.00 C ATOM 670 C ASN A 40 3.818 6.350 -5.529 1.00 0.00 C ATOM 671 O ASN A 40 3.170 6.219 -6.569 1.00 0.00 O ATOM 672 CB ASN A 40 2.463 7.768 -4.003 1.00 0.00 C ATOM 673 CG ASN A 40 2.554 8.851 -2.937 1.00 0.00 C ATOM 674 OD1 ASN A 40 1.876 9.872 -3.036 1.00 0.00 O ATOM 675 ND2 ASN A 40 3.351 8.695 -1.919 1.00 0.00 N ATOM 0 H ASN A 40 3.118 9.154 -6.098 1.00 0.00 H new ATOM 0 HA ASN A 40 4.601 7.684 -4.048 1.00 0.00 H new ATOM 0 HB2 ASN A 40 1.653 7.997 -4.695 1.00 0.00 H new ATOM 0 HB3 ASN A 40 2.225 6.811 -3.539 1.00 0.00 H new ATOM 0 HD21 ASN A 40 3.413 9.420 -1.204 1.00 0.00 H new ATOM 0 HD22 ASN A 40 3.913 7.848 -1.837 1.00 0.00 H new ATOM 682 N PRO A 41 4.523 5.374 -5.016 1.00 0.00 N ATOM 683 CA PRO A 41 4.622 4.039 -5.670 1.00 0.00 C ATOM 684 C PRO A 41 3.303 3.289 -5.602 1.00 0.00 C ATOM 685 O PRO A 41 2.500 3.510 -4.688 1.00 0.00 O ATOM 686 CB PRO A 41 5.668 3.318 -4.829 1.00 0.00 C ATOM 687 CG PRO A 41 5.508 3.887 -3.460 1.00 0.00 C ATOM 688 CD PRO A 41 5.088 5.348 -3.647 1.00 0.00 C ATOM 0 HA PRO A 41 4.876 4.111 -6.728 1.00 0.00 H new ATOM 0 HB2 PRO A 41 5.505 2.240 -4.832 1.00 0.00 H new ATOM 0 HB3 PRO A 41 6.673 3.489 -5.214 1.00 0.00 H new ATOM 0 HG2 PRO A 41 4.756 3.336 -2.895 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.440 3.819 -2.900 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.351 5.652 -2.903 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.937 6.025 -3.550 1.00 0.00 H new ATOM 696 N SER A 42 3.089 2.400 -6.549 1.00 0.00 N ATOM 697 CA SER A 42 1.888 1.594 -6.569 1.00 0.00 C ATOM 698 C SER A 42 1.867 0.685 -5.341 1.00 0.00 C ATOM 699 O SER A 42 2.898 0.493 -4.682 1.00 0.00 O ATOM 700 CB SER A 42 1.842 0.760 -7.852 1.00 0.00 C ATOM 701 OG SER A 42 2.259 1.566 -8.960 1.00 0.00 O ATOM 0 H SER A 42 3.734 2.217 -7.318 1.00 0.00 H new ATOM 0 HA SER A 42 1.012 2.243 -6.546 1.00 0.00 H new ATOM 0 HB2 SER A 42 2.492 -0.110 -7.756 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.832 0.387 -8.020 1.00 0.00 H new ATOM 0 HG SER A 42 2.231 1.032 -9.781 1.00 0.00 H new ATOM 707 N LEU A 43 0.707 0.129 -5.028 1.00 0.00 N ATOM 708 CA LEU A 43 0.569 -0.707 -3.840 1.00 0.00 C ATOM 709 C LEU A 43 1.498 -1.902 -3.941 1.00 0.00 C ATOM 710 O LEU A 43 2.191 -2.254 -2.982 1.00 0.00 O ATOM 711 CB LEU A 43 -0.884 -1.196 -3.714 1.00 0.00 C ATOM 712 CG LEU A 43 -1.042 -2.083 -2.470 1.00 0.00 C ATOM 713 CD1 LEU A 43 -0.678 -1.292 -1.216 1.00 0.00 C ATOM 714 CD2 LEU A 43 -2.489 -2.574 -2.365 1.00 0.00 C ATOM 0 H LEU A 43 -0.148 0.239 -5.574 1.00 0.00 H new ATOM 0 HA LEU A 43 0.831 -0.120 -2.960 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.558 -0.342 -3.648 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -1.165 -1.756 -4.606 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.375 -2.940 -2.559 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -0.793 -1.928 -0.338 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.356 -0.954 -1.286 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -1.337 -0.428 -1.127 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.597 -3.203 -1.481 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -3.159 -1.718 -2.285 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.743 -3.151 -3.254 1.00 0.00 H new ATOM 726 N GLN A 44 1.525 -2.500 -5.107 1.00 0.00 N ATOM 727 CA GLN A 44 2.360 -3.653 -5.359 1.00 0.00 C ATOM 728 C GLN A 44 3.820 -3.294 -5.147 1.00 0.00 C ATOM 729 O GLN A 44 4.536 -3.988 -4.427 1.00 0.00 O ATOM 730 CB GLN A 44 2.126 -4.118 -6.803 1.00 0.00 C ATOM 731 CG GLN A 44 2.966 -5.352 -7.134 1.00 0.00 C ATOM 732 CD GLN A 44 2.592 -5.848 -8.526 1.00 0.00 C ATOM 733 OE1 GLN A 44 1.488 -5.570 -9.009 1.00 0.00 O ATOM 734 NE2 GLN A 44 3.433 -6.551 -9.204 1.00 0.00 N ATOM 0 H GLN A 44 0.969 -2.203 -5.909 1.00 0.00 H new ATOM 0 HA GLN A 44 2.105 -4.458 -4.669 1.00 0.00 H new ATOM 0 HB2 GLN A 44 1.070 -4.345 -6.947 1.00 0.00 H new ATOM 0 HB3 GLN A 44 2.375 -3.311 -7.492 1.00 0.00 H new ATOM 0 HG2 GLN A 44 4.027 -5.107 -7.094 1.00 0.00 H new ATOM 0 HG3 GLN A 44 2.792 -6.135 -6.396 1.00 0.00 H new ATOM 0 HE21 GLN A 44 4.344 -6.780 -8.806 1.00 0.00 H new ATOM 0 HE22 GLN A 44 3.188 -6.878 -10.139 1.00 0.00 H new ATOM 743 N LEU A 45 4.233 -2.157 -5.680 1.00 0.00 N ATOM 744 CA LEU A 45 5.597 -1.705 -5.470 1.00 0.00 C ATOM 745 C LEU A 45 5.838 -1.439 -3.997 1.00 0.00 C ATOM 746 O LEU A 45 6.834 -1.889 -3.434 1.00 0.00 O ATOM 747 CB LEU A 45 5.890 -0.447 -6.295 1.00 0.00 C ATOM 748 CG LEU A 45 5.886 -0.800 -7.789 1.00 0.00 C ATOM 749 CD1 LEU A 45 6.062 0.467 -8.624 1.00 0.00 C ATOM 750 CD2 LEU A 45 7.025 -1.778 -8.099 1.00 0.00 C ATOM 0 H LEU A 45 3.656 -1.540 -6.251 1.00 0.00 H new ATOM 0 HA LEU A 45 6.274 -2.492 -5.802 1.00 0.00 H new ATOM 0 HB2 LEU A 45 5.141 0.318 -6.089 1.00 0.00 H new ATOM 0 HB3 LEU A 45 6.857 -0.031 -6.012 1.00 0.00 H new ATOM 0 HG LEU A 45 4.933 -1.267 -8.037 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.058 0.208 -9.683 1.00 0.00 H new ATOM 0 HD12 LEU A 45 5.244 1.156 -8.416 1.00 0.00 H new ATOM 0 HD13 LEU A 45 7.010 0.941 -8.370 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.015 -2.023 -9.161 1.00 0.00 H new ATOM 0 HD22 LEU A 45 7.979 -1.318 -7.842 1.00 0.00 H new ATOM 0 HD23 LEU A 45 6.892 -2.689 -7.515 1.00 0.00 H new ATOM 762 N ALA A 46 4.872 -0.799 -3.352 1.00 0.00 N ATOM 763 CA ALA A 46 4.970 -0.540 -1.923 1.00 0.00 C ATOM 764 C ALA A 46 5.077 -1.848 -1.157 1.00 0.00 C ATOM 765 O ALA A 46 5.966 -2.019 -0.315 1.00 0.00 O ATOM 766 CB ALA A 46 3.759 0.264 -1.435 1.00 0.00 C ATOM 0 H ALA A 46 4.019 -0.453 -3.791 1.00 0.00 H new ATOM 0 HA ALA A 46 5.869 0.048 -1.741 1.00 0.00 H new ATOM 0 HB1 ALA A 46 3.851 0.447 -0.364 1.00 0.00 H new ATOM 0 HB2 ALA A 46 3.717 1.216 -1.964 1.00 0.00 H new ATOM 0 HB3 ALA A 46 2.846 -0.299 -1.629 1.00 0.00 H new ATOM 772 N LEU A 47 4.204 -2.791 -1.484 1.00 0.00 N ATOM 773 CA LEU A 47 4.237 -4.096 -0.840 1.00 0.00 C ATOM 774 C LEU A 47 5.538 -4.816 -1.137 1.00 0.00 C ATOM 775 O LEU A 47 6.151 -5.401 -0.240 1.00 0.00 O ATOM 776 CB LEU A 47 3.061 -4.960 -1.278 1.00 0.00 C ATOM 777 CG LEU A 47 1.741 -4.419 -0.708 1.00 0.00 C ATOM 778 CD1 LEU A 47 0.570 -5.143 -1.372 1.00 0.00 C ATOM 779 CD2 LEU A 47 1.684 -4.685 0.802 1.00 0.00 C ATOM 0 H LEU A 47 3.471 -2.679 -2.184 1.00 0.00 H new ATOM 0 HA LEU A 47 4.163 -3.927 0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.009 -4.985 -2.366 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.213 -5.986 -0.942 1.00 0.00 H new ATOM 0 HG LEU A 47 1.681 -3.348 -0.900 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -0.369 -4.762 -0.970 1.00 0.00 H new ATOM 0 HD12 LEU A 47 0.600 -4.972 -2.448 1.00 0.00 H new ATOM 0 HD13 LEU A 47 0.643 -6.212 -1.172 1.00 0.00 H new ATOM 0 HD21 LEU A 47 0.747 -4.300 1.204 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.744 -5.758 0.985 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.521 -4.186 1.291 1.00 0.00 H new ATOM 791 N LYS A 48 5.994 -4.737 -2.383 1.00 0.00 N ATOM 792 CA LYS A 48 7.249 -5.367 -2.736 1.00 0.00 C ATOM 793 C LYS A 48 8.364 -4.755 -1.905 1.00 0.00 C ATOM 794 O LYS A 48 9.194 -5.470 -1.337 1.00 0.00 O ATOM 795 CB LYS A 48 7.555 -5.182 -4.230 1.00 0.00 C ATOM 796 CG LYS A 48 6.600 -6.057 -5.049 1.00 0.00 C ATOM 797 CD LYS A 48 6.783 -5.803 -6.559 1.00 0.00 C ATOM 798 CE LYS A 48 7.922 -6.673 -7.129 1.00 0.00 C ATOM 799 NZ LYS A 48 8.043 -6.433 -8.594 1.00 0.00 N ATOM 0 H LYS A 48 5.521 -4.253 -3.146 1.00 0.00 H new ATOM 0 HA LYS A 48 7.175 -6.435 -2.533 1.00 0.00 H new ATOM 0 HB2 LYS A 48 7.440 -4.135 -4.511 1.00 0.00 H new ATOM 0 HB3 LYS A 48 8.589 -5.456 -4.439 1.00 0.00 H new ATOM 0 HG2 LYS A 48 6.783 -7.108 -4.828 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.570 -5.846 -4.762 1.00 0.00 H new ATOM 0 HD2 LYS A 48 5.854 -6.024 -7.084 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.004 -4.749 -6.731 1.00 0.00 H new ATOM 0 HE2 LYS A 48 8.862 -6.433 -6.631 1.00 0.00 H new ATOM 0 HE3 LYS A 48 7.720 -7.727 -6.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 8.311 -7.318 -9.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 7.131 -6.101 -8.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 8.772 -5.712 -8.769 1.00 0.00 H new ATOM 813 N ILE A 49 8.320 -3.430 -1.753 1.00 0.00 N ATOM 814 CA ILE A 49 9.296 -2.730 -0.928 1.00 0.00 C ATOM 815 C ILE A 49 9.173 -3.188 0.519 1.00 0.00 C ATOM 816 O ILE A 49 10.180 -3.504 1.170 1.00 0.00 O ATOM 817 CB ILE A 49 9.065 -1.207 -1.006 1.00 0.00 C ATOM 818 CG1 ILE A 49 9.385 -0.703 -2.409 1.00 0.00 C ATOM 819 CG2 ILE A 49 9.988 -0.489 -0.019 1.00 0.00 C ATOM 820 CD1 ILE A 49 8.901 0.741 -2.557 1.00 0.00 C ATOM 0 H ILE A 49 7.622 -2.827 -2.189 1.00 0.00 H new ATOM 0 HA ILE A 49 10.295 -2.959 -1.298 1.00 0.00 H new ATOM 0 HB ILE A 49 8.022 -1.004 -0.763 1.00 0.00 H new ATOM 0 HG12 ILE A 49 10.458 -0.758 -2.590 1.00 0.00 H new ATOM 0 HG13 ILE A 49 8.903 -1.337 -3.153 1.00 0.00 H new ATOM 0 HG21 ILE A 49 9.819 0.586 -0.079 1.00 0.00 H new ATOM 0 HG22 ILE A 49 9.776 -0.833 0.993 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.027 -0.708 -0.267 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.130 1.101 -3.560 1.00 0.00 H new ATOM 0 HD12 ILE A 49 7.824 0.782 -2.394 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.404 1.370 -1.822 1.00 0.00 H new ATOM 832 N ALA A 50 7.937 -3.276 1.004 1.00 0.00 N ATOM 833 CA ALA A 50 7.699 -3.732 2.366 1.00 0.00 C ATOM 834 C ALA A 50 8.284 -5.112 2.544 1.00 0.00 C ATOM 835 O ALA A 50 9.080 -5.356 3.462 1.00 0.00 O ATOM 836 CB ALA A 50 6.196 -3.760 2.671 1.00 0.00 C ATOM 0 H ALA A 50 7.095 -3.040 0.479 1.00 0.00 H new ATOM 0 HA ALA A 50 8.178 -3.040 3.058 1.00 0.00 H new ATOM 0 HB1 ALA A 50 6.039 -4.103 3.693 1.00 0.00 H new ATOM 0 HB2 ALA A 50 5.783 -2.758 2.557 1.00 0.00 H new ATOM 0 HB3 ALA A 50 5.697 -4.439 1.979 1.00 0.00 H new ATOM 842 N TYR A 51 7.952 -5.992 1.616 1.00 0.00 N ATOM 843 CA TYR A 51 8.486 -7.337 1.630 1.00 0.00 C ATOM 844 C TYR A 51 10.003 -7.332 1.485 1.00 0.00 C ATOM 845 O TYR A 51 10.707 -8.007 2.234 1.00 0.00 O ATOM 846 CB TYR A 51 7.868 -8.168 0.496 1.00 0.00 C ATOM 847 CG TYR A 51 8.514 -9.531 0.478 1.00 0.00 C ATOM 848 CD1 TYR A 51 8.033 -10.541 1.312 1.00 0.00 C ATOM 849 CD2 TYR A 51 9.603 -9.778 -0.365 1.00 0.00 C ATOM 850 CE1 TYR A 51 8.637 -11.796 1.303 1.00 0.00 C ATOM 851 CE2 TYR A 51 10.209 -11.031 -0.372 1.00 0.00 C ATOM 852 CZ TYR A 51 9.727 -12.041 0.463 1.00 0.00 C ATOM 853 OH TYR A 51 10.328 -13.279 0.461 1.00 0.00 O ATOM 0 H TYR A 51 7.315 -5.797 0.844 1.00 0.00 H new ATOM 0 HA TYR A 51 8.231 -7.783 2.591 1.00 0.00 H new ATOM 0 HB2 TYR A 51 6.792 -8.263 0.642 1.00 0.00 H new ATOM 0 HB3 TYR A 51 8.017 -7.668 -0.461 1.00 0.00 H new ATOM 0 HD1 TYR A 51 7.193 -10.350 1.964 1.00 0.00 H new ATOM 0 HD2 TYR A 51 9.974 -8.996 -1.011 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.263 -12.580 1.945 1.00 0.00 H new ATOM 0 HE2 TYR A 51 11.050 -11.222 -1.022 1.00 0.00 H new ATOM 0 HH TYR A 51 11.069 -13.282 -0.180 1.00 0.00 H new ATOM 863 N TYR A 52 10.503 -6.616 0.490 1.00 0.00 N ATOM 864 CA TYR A 52 11.935 -6.617 0.217 1.00 0.00 C ATOM 865 C TYR A 52 12.752 -5.991 1.327 1.00 0.00 C ATOM 866 O TYR A 52 13.867 -6.440 1.610 1.00 0.00 O ATOM 867 CB TYR A 52 12.272 -6.011 -1.151 1.00 0.00 C ATOM 868 CG TYR A 52 11.976 -7.037 -2.225 1.00 0.00 C ATOM 869 CD1 TYR A 52 12.720 -8.222 -2.277 1.00 0.00 C ATOM 870 CD2 TYR A 52 10.953 -6.818 -3.150 1.00 0.00 C ATOM 871 CE1 TYR A 52 12.445 -9.179 -3.254 1.00 0.00 C ATOM 872 CE2 TYR A 52 10.675 -7.777 -4.125 1.00 0.00 C ATOM 873 CZ TYR A 52 11.422 -8.960 -4.179 1.00 0.00 C ATOM 874 OH TYR A 52 11.146 -9.910 -5.142 1.00 0.00 O ATOM 0 H TYR A 52 9.948 -6.033 -0.136 1.00 0.00 H new ATOM 0 HA TYR A 52 12.224 -7.667 0.180 1.00 0.00 H new ATOM 0 HB2 TYR A 52 11.685 -5.108 -1.319 1.00 0.00 H new ATOM 0 HB3 TYR A 52 13.322 -5.719 -1.186 1.00 0.00 H new ATOM 0 HD1 TYR A 52 13.508 -8.395 -1.559 1.00 0.00 H new ATOM 0 HD2 TYR A 52 10.376 -5.906 -3.111 1.00 0.00 H new ATOM 0 HE1 TYR A 52 13.024 -10.090 -3.295 1.00 0.00 H new ATOM 0 HE2 TYR A 52 9.883 -7.606 -4.839 1.00 0.00 H new ATOM 0 HH TYR A 52 10.405 -9.601 -5.704 1.00 0.00 H new ATOM 884 N LEU A 53 12.244 -4.930 1.927 1.00 0.00 N ATOM 885 CA LEU A 53 12.996 -4.257 2.978 1.00 0.00 C ATOM 886 C LEU A 53 12.717 -4.872 4.339 1.00 0.00 C ATOM 887 O LEU A 53 13.339 -4.488 5.345 1.00 0.00 O ATOM 888 CB LEU A 53 12.724 -2.754 2.996 1.00 0.00 C ATOM 889 CG LEU A 53 13.107 -2.139 1.638 1.00 0.00 C ATOM 890 CD1 LEU A 53 12.878 -0.637 1.677 1.00 0.00 C ATOM 891 CD2 LEU A 53 14.578 -2.429 1.296 1.00 0.00 C ATOM 0 H LEU A 53 11.335 -4.520 1.714 1.00 0.00 H new ATOM 0 HA LEU A 53 14.053 -4.398 2.754 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.671 -2.568 3.206 1.00 0.00 H new ATOM 0 HB3 LEU A 53 13.296 -2.281 3.794 1.00 0.00 H new ATOM 0 HG LEU A 53 12.481 -2.589 0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 53 13.150 -0.202 0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 53 11.827 -0.434 1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 53 13.493 -0.195 2.461 1.00 0.00 H new ATOM 0 HD21 LEU A 53 14.822 -1.983 0.332 1.00 0.00 H new ATOM 0 HD22 LEU A 53 15.221 -2.003 2.066 1.00 0.00 H new ATOM 0 HD23 LEU A 53 14.735 -3.507 1.248 1.00 0.00 H new ATOM 903 N ASN A 54 11.828 -5.860 4.367 1.00 0.00 N ATOM 904 CA ASN A 54 11.518 -6.579 5.599 1.00 0.00 C ATOM 905 C ASN A 54 10.992 -5.641 6.680 1.00 0.00 C ATOM 906 O ASN A 54 11.424 -5.696 7.837 1.00 0.00 O ATOM 907 CB ASN A 54 12.758 -7.334 6.100 1.00 0.00 C ATOM 908 CG ASN A 54 12.387 -8.286 7.227 1.00 0.00 C ATOM 909 OD1 ASN A 54 11.236 -8.708 7.335 1.00 0.00 O ATOM 910 ND2 ASN A 54 13.295 -8.650 8.076 1.00 0.00 N ATOM 0 H ASN A 54 11.309 -6.182 3.550 1.00 0.00 H new ATOM 0 HA ASN A 54 10.730 -7.298 5.376 1.00 0.00 H new ATOM 0 HB2 ASN A 54 13.207 -7.892 5.278 1.00 0.00 H new ATOM 0 HB3 ASN A 54 13.507 -6.623 6.449 1.00 0.00 H new ATOM 0 HD21 ASN A 54 13.057 -9.287 8.836 1.00 0.00 H new ATOM 0 HD22 ASN A 54 14.248 -8.299 7.985 1.00 0.00 H new ATOM 917 N THR A 55 10.057 -4.788 6.305 1.00 0.00 N ATOM 918 CA THR A 55 9.438 -3.866 7.244 1.00 0.00 C ATOM 919 C THR A 55 7.983 -3.638 6.843 1.00 0.00 C ATOM 920 O THR A 55 7.611 -3.900 5.695 1.00 0.00 O ATOM 921 CB THR A 55 10.224 -2.536 7.290 1.00 0.00 C ATOM 922 OG1 THR A 55 9.907 -1.804 8.480 1.00 0.00 O ATOM 923 CG2 THR A 55 9.906 -1.689 6.062 1.00 0.00 C ATOM 0 H THR A 55 9.706 -4.713 5.350 1.00 0.00 H new ATOM 0 HA THR A 55 9.460 -4.295 8.246 1.00 0.00 H new ATOM 0 HB THR A 55 11.289 -2.769 7.295 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.751 -0.863 8.254 1.00 0.00 H new ATOM 0 HG21 THR A 55 10.467 -0.756 6.109 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.185 -2.235 5.161 1.00 0.00 H new ATOM 0 HG23 THR A 55 8.839 -1.470 6.038 1.00 0.00 H new ATOM 931 N PRO A 56 7.153 -3.196 7.752 1.00 0.00 N ATOM 932 CA PRO A 56 5.731 -2.972 7.428 1.00 0.00 C ATOM 933 C PRO A 56 5.573 -1.914 6.340 1.00 0.00 C ATOM 934 O PRO A 56 6.281 -0.904 6.333 1.00 0.00 O ATOM 935 CB PRO A 56 5.116 -2.483 8.751 1.00 0.00 C ATOM 936 CG PRO A 56 6.135 -2.757 9.825 1.00 0.00 C ATOM 937 CD PRO A 56 7.310 -3.499 9.177 1.00 0.00 C ATOM 0 HA PRO A 56 5.249 -3.871 7.045 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.883 -1.419 8.700 1.00 0.00 H new ATOM 0 HB3 PRO A 56 4.182 -3.005 8.961 1.00 0.00 H new ATOM 0 HG2 PRO A 56 6.474 -1.825 10.277 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.697 -3.357 10.623 1.00 0.00 H new ATOM 0 HD2 PRO A 56 8.268 -3.148 9.560 1.00 0.00 H new ATOM 0 HD3 PRO A 56 7.264 -4.571 9.368 1.00 0.00 H new ATOM 945 N LEU A 57 4.598 -2.102 5.480 1.00 0.00 N ATOM 946 CA LEU A 57 4.318 -1.130 4.437 1.00 0.00 C ATOM 947 C LEU A 57 3.930 0.194 5.078 1.00 0.00 C ATOM 948 O LEU A 57 4.389 1.262 4.662 1.00 0.00 O ATOM 949 CB LEU A 57 3.198 -1.634 3.518 1.00 0.00 C ATOM 950 CG LEU A 57 2.961 -0.631 2.378 1.00 0.00 C ATOM 951 CD1 LEU A 57 2.376 -1.362 1.170 1.00 0.00 C ATOM 952 CD2 LEU A 57 1.975 0.450 2.835 1.00 0.00 C ATOM 0 H LEU A 57 3.984 -2.916 5.478 1.00 0.00 H new ATOM 0 HA LEU A 57 5.211 -0.987 3.828 1.00 0.00 H new ATOM 0 HB2 LEU A 57 3.464 -2.608 3.107 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.280 -1.770 4.090 1.00 0.00 H new ATOM 0 HG LEU A 57 3.910 -0.168 2.106 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.208 -0.651 0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 57 3.073 -2.131 0.838 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.430 -1.826 1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.810 1.159 2.023 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.028 -0.014 3.109 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.385 0.975 3.698 1.00 0.00 H new ATOM 964 N GLU A 58 3.141 0.098 6.143 1.00 0.00 N ATOM 965 CA GLU A 58 2.692 1.260 6.895 1.00 0.00 C ATOM 966 C GLU A 58 3.891 2.025 7.431 1.00 0.00 C ATOM 967 O GLU A 58 3.894 3.253 7.456 1.00 0.00 O ATOM 968 CB GLU A 58 1.850 0.793 8.087 1.00 0.00 C ATOM 969 CG GLU A 58 0.522 0.194 7.612 1.00 0.00 C ATOM 970 CD GLU A 58 -0.230 -0.371 8.802 1.00 0.00 C ATOM 971 OE1 GLU A 58 0.356 -1.143 9.531 1.00 0.00 O ATOM 972 OE2 GLU A 58 -1.376 -0.037 8.964 1.00 0.00 O ATOM 0 H GLU A 58 2.795 -0.790 6.508 1.00 0.00 H new ATOM 0 HA GLU A 58 2.106 1.902 6.238 1.00 0.00 H new ATOM 0 HB2 GLU A 58 2.404 0.051 8.661 1.00 0.00 H new ATOM 0 HB3 GLU A 58 1.657 1.633 8.754 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -0.078 0.958 7.118 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.706 -0.591 6.878 1.00 0.00 H new ATOM 979 N ASP A 59 4.901 1.285 7.868 1.00 0.00 N ATOM 980 CA ASP A 59 6.114 1.873 8.416 1.00 0.00 C ATOM 981 C ASP A 59 6.840 2.682 7.362 1.00 0.00 C ATOM 982 O ASP A 59 7.392 3.752 7.655 1.00 0.00 O ATOM 983 CB ASP A 59 7.034 0.768 8.958 1.00 0.00 C ATOM 984 CG ASP A 59 8.354 1.348 9.419 1.00 0.00 C ATOM 985 OD1 ASP A 59 8.338 2.190 10.285 1.00 0.00 O ATOM 986 OD2 ASP A 59 9.371 0.928 8.909 1.00 0.00 O ATOM 0 H ASP A 59 4.902 0.265 7.853 1.00 0.00 H new ATOM 0 HA ASP A 59 5.837 2.540 9.232 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.546 0.257 9.788 1.00 0.00 H new ATOM 0 HB3 ASP A 59 7.210 0.022 8.183 1.00 0.00 H new ATOM 991 N ILE A 60 6.780 2.206 6.131 1.00 0.00 N ATOM 992 CA ILE A 60 7.403 2.904 5.023 1.00 0.00 C ATOM 993 C ILE A 60 6.481 3.996 4.517 1.00 0.00 C ATOM 994 O ILE A 60 6.891 5.155 4.381 1.00 0.00 O ATOM 995 CB ILE A 60 7.698 1.918 3.881 1.00 0.00 C ATOM 996 CG1 ILE A 60 8.633 0.819 4.378 1.00 0.00 C ATOM 997 CG2 ILE A 60 8.373 2.652 2.716 1.00 0.00 C ATOM 998 CD1 ILE A 60 8.746 -0.273 3.318 1.00 0.00 C ATOM 0 H ILE A 60 6.306 1.340 5.875 1.00 0.00 H new ATOM 0 HA ILE A 60 8.337 3.348 5.368 1.00 0.00 H new ATOM 0 HB ILE A 60 6.758 1.481 3.544 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.617 1.235 4.593 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.254 0.398 5.309 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.578 1.946 1.911 1.00 0.00 H new ATOM 0 HG22 ILE A 60 7.712 3.438 2.349 1.00 0.00 H new ATOM 0 HG23 ILE A 60 9.309 3.095 3.058 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.414 -1.058 3.674 1.00 0.00 H new ATOM 0 HD12 ILE A 60 7.760 -0.696 3.125 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.145 0.153 2.398 1.00 0.00 H new ATOM 1010 N PHE A 61 5.242 3.616 4.233 1.00 0.00 N ATOM 1011 CA PHE A 61 4.250 4.550 3.731 1.00 0.00 C ATOM 1012 C PHE A 61 3.079 4.620 4.685 1.00 0.00 C ATOM 1013 O PHE A 61 2.279 3.686 4.753 1.00 0.00 O ATOM 1014 CB PHE A 61 3.739 4.103 2.353 1.00 0.00 C ATOM 1015 CG PHE A 61 4.895 3.917 1.398 1.00 0.00 C ATOM 1016 CD1 PHE A 61 5.534 5.029 0.832 1.00 0.00 C ATOM 1017 CD2 PHE A 61 5.328 2.623 1.077 1.00 0.00 C ATOM 1018 CE1 PHE A 61 6.606 4.842 -0.050 1.00 0.00 C ATOM 1019 CE2 PHE A 61 6.395 2.438 0.195 1.00 0.00 C ATOM 1020 CZ PHE A 61 7.037 3.544 -0.368 1.00 0.00 C ATOM 0 H PHE A 61 4.901 2.661 4.344 1.00 0.00 H new ATOM 0 HA PHE A 61 4.718 5.530 3.643 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.184 3.170 2.449 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.047 4.846 1.956 1.00 0.00 H new ATOM 0 HD1 PHE A 61 5.201 6.027 1.075 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.835 1.767 1.513 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.101 5.697 -0.486 1.00 0.00 H new ATOM 0 HE2 PHE A 61 6.724 1.439 -0.052 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.864 3.401 -1.047 1.00 0.00 H new ATOM 1030 N GLN A 62 2.926 5.739 5.368 1.00 0.00 N ATOM 1031 CA GLN A 62 1.781 5.917 6.254 1.00 0.00 C ATOM 1032 C GLN A 62 0.866 7.009 5.730 1.00 0.00 C ATOM 1033 O GLN A 62 1.300 8.146 5.504 1.00 0.00 O ATOM 1034 CB GLN A 62 2.233 6.242 7.690 1.00 0.00 C ATOM 1035 CG GLN A 62 3.328 7.311 7.661 1.00 0.00 C ATOM 1036 CD GLN A 62 4.690 6.717 8.006 1.00 0.00 C ATOM 1037 OE1 GLN A 62 5.561 7.434 8.489 1.00 0.00 O ATOM 1038 NE2 GLN A 62 4.937 5.460 7.783 1.00 0.00 N ATOM 0 H GLN A 62 3.568 6.531 5.331 1.00 0.00 H new ATOM 0 HA GLN A 62 1.228 4.978 6.277 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.385 6.594 8.277 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.605 5.340 8.176 1.00 0.00 H new ATOM 0 HG2 GLN A 62 3.368 7.768 6.672 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.085 8.104 8.368 1.00 0.00 H new ATOM 0 HE21 GLN A 62 4.215 4.862 7.382 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.853 5.072 8.009 1.00 0.00 H new ATOM 1047 N TRP A 63 -0.404 6.672 5.572 1.00 0.00 N ATOM 1048 CA TRP A 63 -1.409 7.627 5.137 1.00 0.00 C ATOM 1049 C TRP A 63 -1.829 8.471 6.309 1.00 0.00 C ATOM 1050 O TRP A 63 -2.386 7.961 7.284 1.00 0.00 O ATOM 1051 CB TRP A 63 -2.616 6.881 4.562 1.00 0.00 C ATOM 1052 CG TRP A 63 -3.709 7.816 4.155 1.00 0.00 C ATOM 1053 CD1 TRP A 63 -3.790 8.447 2.970 1.00 0.00 C ATOM 1054 CD2 TRP A 63 -4.884 8.218 4.909 1.00 0.00 C ATOM 1055 NE1 TRP A 63 -4.947 9.202 2.953 1.00 0.00 N ATOM 1056 CE2 TRP A 63 -5.648 9.097 4.120 1.00 0.00 C ATOM 1057 CE3 TRP A 63 -5.359 7.903 6.182 1.00 0.00 C ATOM 1058 CZ2 TRP A 63 -6.837 9.653 4.579 1.00 0.00 C ATOM 1059 CZ3 TRP A 63 -6.558 8.461 6.646 1.00 0.00 C ATOM 1060 CH2 TRP A 63 -7.293 9.335 5.848 1.00 0.00 C ATOM 0 H TRP A 63 -0.765 5.733 5.741 1.00 0.00 H new ATOM 0 HA TRP A 63 -0.994 8.271 4.361 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -2.302 6.293 3.700 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -2.996 6.180 5.305 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -3.072 8.376 2.167 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -5.243 9.772 2.161 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -4.801 7.227 6.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.401 10.327 3.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -6.916 8.211 7.634 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -8.214 9.763 6.217 1.00 0.00 H new ATOM 1071 N GLN A 64 -1.528 9.742 6.237 1.00 0.00 N ATOM 1072 CA GLN A 64 -1.863 10.650 7.300 1.00 0.00 C ATOM 1073 C GLN A 64 -2.896 11.639 6.816 1.00 0.00 C ATOM 1074 O GLN A 64 -2.702 12.294 5.791 1.00 0.00 O ATOM 1075 CB GLN A 64 -0.611 11.378 7.785 1.00 0.00 C ATOM 1076 CG GLN A 64 0.402 10.353 8.319 1.00 0.00 C ATOM 1077 CD GLN A 64 1.471 11.051 9.147 1.00 0.00 C ATOM 1078 OE1 GLN A 64 1.545 12.347 9.151 1.00 0.00 O flip ATOM 1079 NE2 GLN A 64 2.270 10.387 9.812 1.00 0.00 N flip ATOM 0 H GLN A 64 -1.048 10.173 5.447 1.00 0.00 H new ATOM 0 HA GLN A 64 -2.278 10.087 8.136 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -0.170 11.950 6.968 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -0.872 12.090 8.568 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -0.110 9.608 8.927 1.00 0.00 H new ATOM 0 HG3 GLN A 64 0.865 9.822 7.488 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.213 9.369 9.810 1.00 0.00 H new ATOM 0 HE22 GLN A 64 2.988 10.856 10.364 1.00 0.00 H new ATOM 1136 N ILE B 68 -1.373 -9.672 -5.182 1.00 0.00 N ATOM 1137 CA ILE B 68 -1.812 -9.114 -3.917 1.00 0.00 C ATOM 1138 C ILE B 68 -3.170 -9.682 -3.561 1.00 0.00 C ATOM 1139 O ILE B 68 -4.127 -9.565 -4.335 1.00 0.00 O ATOM 1140 CB ILE B 68 -1.895 -7.584 -4.000 1.00 0.00 C ATOM 1141 CG1 ILE B 68 -0.529 -7.001 -4.366 1.00 0.00 C ATOM 1142 CG2 ILE B 68 -2.335 -7.006 -2.649 1.00 0.00 C ATOM 1143 CD1 ILE B 68 -0.689 -5.505 -4.645 1.00 0.00 C ATOM 0 HA ILE B 68 -1.089 -9.379 -3.146 1.00 0.00 H new ATOM 0 HB ILE B 68 -2.623 -7.320 -4.767 1.00 0.00 H new ATOM 0 HG12 ILE B 68 0.179 -7.159 -3.553 1.00 0.00 H new ATOM 0 HG13 ILE B 68 -0.125 -7.507 -5.243 1.00 0.00 H new ATOM 0 HG21 ILE B 68 -2.391 -5.920 -2.719 1.00 0.00 H new ATOM 0 HG22 ILE B 68 -3.315 -7.403 -2.385 1.00 0.00 H new ATOM 0 HG23 ILE B 68 -1.612 -7.284 -1.882 1.00 0.00 H new ATOM 0 HD11 ILE B 68 0.279 -5.078 -4.907 1.00 0.00 H new ATOM 0 HD12 ILE B 68 -1.385 -5.361 -5.472 1.00 0.00 H new ATOM 0 HD13 ILE B 68 -1.076 -5.008 -3.755 1.00 0.00 H new ATOM 1155 N ILE B 69 -3.260 -10.263 -2.387 1.00 0.00 N ATOM 1156 CA ILE B 69 -4.502 -10.827 -1.913 1.00 0.00 C ATOM 1157 C ILE B 69 -5.258 -9.791 -1.083 1.00 0.00 C ATOM 1158 O ILE B 69 -4.704 -9.214 -0.141 1.00 0.00 O ATOM 1159 CB ILE B 69 -4.197 -12.084 -1.093 1.00 0.00 C ATOM 1160 CG1 ILE B 69 -3.498 -13.103 -1.995 1.00 0.00 C ATOM 1161 CG2 ILE B 69 -5.494 -12.697 -0.548 1.00 0.00 C ATOM 1162 CD1 ILE B 69 -2.885 -14.201 -1.139 1.00 0.00 C ATOM 0 H ILE B 69 -2.479 -10.358 -1.737 1.00 0.00 H new ATOM 0 HA ILE B 69 -5.135 -11.105 -2.755 1.00 0.00 H new ATOM 0 HB ILE B 69 -3.556 -11.817 -0.253 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -4.212 -13.531 -2.699 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -2.724 -12.612 -2.585 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -5.259 -13.589 0.032 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -5.999 -11.972 0.090 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -6.146 -12.966 -1.379 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -2.387 -14.927 -1.781 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -2.159 -13.765 -0.453 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -3.670 -14.699 -0.569 1.00 0.00 H new ATOM 1174 N ASN B 70 -6.494 -9.518 -1.481 1.00 0.00 N ATOM 1175 CA ASN B 70 -7.333 -8.520 -0.817 1.00 0.00 C ATOM 1176 C ASN B 70 -8.251 -9.156 0.209 1.00 0.00 C ATOM 1177 O ASN B 70 -9.195 -9.854 -0.156 1.00 0.00 O ATOM 1178 CB ASN B 70 -8.192 -7.783 -1.839 1.00 0.00 C ATOM 1179 CG ASN B 70 -9.130 -6.824 -1.125 1.00 0.00 C ATOM 1180 OD1 ASN B 70 -8.919 -6.499 0.041 1.00 0.00 O ATOM 1181 ND2 ASN B 70 -10.163 -6.375 -1.743 1.00 0.00 N ATOM 0 H ASN B 70 -6.945 -9.979 -2.271 1.00 0.00 H new ATOM 0 HA ASN B 70 -6.663 -7.824 -0.313 1.00 0.00 H new ATOM 0 HB2 ASN B 70 -7.556 -7.235 -2.534 1.00 0.00 H new ATOM 0 HB3 ASN B 70 -8.767 -8.498 -2.428 1.00 0.00 H new ATOM 0 HD21 ASN B 70 -10.810 -5.747 -1.266 1.00 0.00 H new ATOM 0 HD22 ASN B 70 -10.336 -6.646 -2.711 1.00 0.00 H new ATOM 1188 N ASN B 71 -8.035 -8.849 1.473 1.00 0.00 N ATOM 1189 CA ASN B 71 -8.906 -9.347 2.538 1.00 0.00 C ATOM 1190 C ASN B 71 -9.946 -8.305 2.909 1.00 0.00 C ATOM 1191 O ASN B 71 -10.616 -8.427 3.937 1.00 0.00 O ATOM 1192 CB ASN B 71 -8.101 -9.680 3.790 1.00 0.00 C ATOM 1193 CG ASN B 71 -7.099 -10.772 3.509 1.00 0.00 C ATOM 1194 OD1 ASN B 71 -7.459 -11.832 3.007 1.00 0.00 O ATOM 1195 ND2 ASN B 71 -5.859 -10.575 3.794 1.00 0.00 N ATOM 0 H ASN B 71 -7.268 -8.259 1.795 1.00 0.00 H new ATOM 0 HA ASN B 71 -9.394 -10.247 2.163 1.00 0.00 H new ATOM 0 HB2 ASN B 71 -7.584 -8.788 4.143 1.00 0.00 H new ATOM 0 HB3 ASN B 71 -8.774 -9.995 4.587 1.00 0.00 H new ATOM 0 HD21 ASN B 71 -5.170 -11.302 3.603 1.00 0.00 H new ATOM 0 HD22 ASN B 71 -5.566 -9.692 4.211 1.00 0.00 H new ATOM 1202 N LEU B 72 -10.032 -7.239 2.131 1.00 0.00 N ATOM 1203 CA LEU B 72 -10.886 -6.121 2.506 1.00 0.00 C ATOM 1204 C LEU B 72 -12.322 -6.554 2.651 1.00 0.00 C ATOM 1205 O LEU B 72 -12.951 -6.273 3.664 1.00 0.00 O ATOM 1206 CB LEU B 72 -10.795 -5.004 1.461 1.00 0.00 C ATOM 1207 CG LEU B 72 -11.759 -3.866 1.823 1.00 0.00 C ATOM 1208 CD1 LEU B 72 -11.447 -3.338 3.222 1.00 0.00 C ATOM 1209 CD2 LEU B 72 -11.622 -2.733 0.802 1.00 0.00 C ATOM 0 H LEU B 72 -9.531 -7.123 1.250 1.00 0.00 H new ATOM 0 HA LEU B 72 -10.536 -5.749 3.469 1.00 0.00 H new ATOM 0 HB2 LEU B 72 -9.774 -4.625 1.410 1.00 0.00 H new ATOM 0 HB3 LEU B 72 -11.038 -5.398 0.474 1.00 0.00 H new ATOM 0 HG LEU B 72 -12.780 -4.247 1.808 1.00 0.00 H new ATOM 0 HD11 LEU B 72 -12.137 -2.531 3.469 1.00 0.00 H new ATOM 0 HD12 LEU B 72 -11.557 -4.144 3.948 1.00 0.00 H new ATOM 0 HD13 LEU B 72 -10.424 -2.962 3.249 1.00 0.00 H new ATOM 0 HD21 LEU B 72 -12.307 -1.926 1.060 1.00 0.00 H new ATOM 0 HD22 LEU B 72 -10.599 -2.357 0.810 1.00 0.00 H new ATOM 0 HD23 LEU B 72 -11.862 -3.109 -0.193 1.00 0.00 H new ATOM 1221 N LYS B 73 -12.826 -7.301 1.695 1.00 0.00 N ATOM 1222 CA LYS B 73 -14.191 -7.776 1.805 1.00 0.00 C ATOM 1223 C LYS B 73 -14.349 -8.663 3.014 1.00 0.00 C ATOM 1224 O LYS B 73 -15.323 -8.553 3.760 1.00 0.00 O ATOM 1225 CB LYS B 73 -14.650 -8.490 0.523 1.00 0.00 C ATOM 1226 CG LYS B 73 -13.743 -9.691 0.172 1.00 0.00 C ATOM 1227 CD LYS B 73 -14.153 -10.221 -1.218 1.00 0.00 C ATOM 1228 CE LYS B 73 -13.105 -11.211 -1.761 1.00 0.00 C ATOM 1229 NZ LYS B 73 -13.047 -12.428 -0.910 1.00 0.00 N ATOM 0 H LYS B 73 -12.329 -7.588 0.852 1.00 0.00 H new ATOM 0 HA LYS B 73 -14.836 -6.907 1.934 1.00 0.00 H new ATOM 0 HB2 LYS B 73 -15.676 -8.835 0.648 1.00 0.00 H new ATOM 0 HB3 LYS B 73 -14.651 -7.782 -0.306 1.00 0.00 H new ATOM 0 HG2 LYS B 73 -12.696 -9.387 0.168 1.00 0.00 H new ATOM 0 HG3 LYS B 73 -13.845 -10.475 0.922 1.00 0.00 H new ATOM 0 HD2 LYS B 73 -15.124 -10.713 -1.152 1.00 0.00 H new ATOM 0 HD3 LYS B 73 -14.265 -9.387 -1.911 1.00 0.00 H new ATOM 0 HE2 LYS B 73 -13.355 -11.488 -2.785 1.00 0.00 H new ATOM 0 HE3 LYS B 73 -12.126 -10.733 -1.790 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 -12.373 -13.106 -1.319 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 -12.738 -12.167 0.048 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 -13.990 -12.864 -0.863 1.00 0.00 H new ATOM 1243 N LEU B 74 -13.403 -9.558 3.197 1.00 0.00 N ATOM 1244 CA LEU B 74 -13.464 -10.486 4.303 1.00 0.00 C ATOM 1245 C LEU B 74 -13.374 -9.713 5.619 1.00 0.00 C ATOM 1246 O LEU B 74 -14.114 -9.982 6.577 1.00 0.00 O ATOM 1247 CB LEU B 74 -12.287 -11.457 4.212 1.00 0.00 C ATOM 1248 CG LEU B 74 -12.334 -12.225 2.880 1.00 0.00 C ATOM 1249 CD1 LEU B 74 -11.157 -13.192 2.801 1.00 0.00 C ATOM 1250 CD2 LEU B 74 -13.654 -12.984 2.730 1.00 0.00 C ATOM 0 H LEU B 74 -12.585 -9.662 2.596 1.00 0.00 H new ATOM 0 HA LEU B 74 -14.403 -11.038 4.264 1.00 0.00 H new ATOM 0 HB2 LEU B 74 -11.348 -10.910 4.292 1.00 0.00 H new ATOM 0 HB3 LEU B 74 -12.319 -12.158 5.046 1.00 0.00 H new ATOM 0 HG LEU B 74 -12.265 -11.506 2.064 1.00 0.00 H new ATOM 0 HD11 LEU B 74 -11.194 -13.734 1.856 1.00 0.00 H new ATOM 0 HD12 LEU B 74 -10.223 -12.634 2.863 1.00 0.00 H new ATOM 0 HD13 LEU B 74 -11.212 -13.900 3.628 1.00 0.00 H new ATOM 0 HD21 LEU B 74 -13.661 -13.518 1.780 1.00 0.00 H new ATOM 0 HD22 LEU B 74 -13.759 -13.697 3.548 1.00 0.00 H new ATOM 0 HD23 LEU B 74 -14.484 -12.278 2.755 1.00 0.00 H new ATOM 1262 N ILE B 75 -12.455 -8.756 5.662 1.00 0.00 N ATOM 1263 CA ILE B 75 -12.287 -7.897 6.822 1.00 0.00 C ATOM 1264 C ILE B 75 -13.469 -6.938 6.988 1.00 0.00 C ATOM 1265 O ILE B 75 -13.956 -6.720 8.094 1.00 0.00 O ATOM 1266 CB ILE B 75 -10.965 -7.123 6.723 1.00 0.00 C ATOM 1267 CG1 ILE B 75 -9.795 -8.109 6.829 1.00 0.00 C ATOM 1268 CG2 ILE B 75 -10.867 -6.109 7.874 1.00 0.00 C ATOM 1269 CD1 ILE B 75 -8.497 -7.400 6.451 1.00 0.00 C ATOM 0 H ILE B 75 -11.810 -8.556 4.897 1.00 0.00 H new ATOM 0 HA ILE B 75 -12.256 -8.531 7.708 1.00 0.00 H new ATOM 0 HB ILE B 75 -10.928 -6.596 5.769 1.00 0.00 H new ATOM 0 HG12 ILE B 75 -9.726 -8.500 7.844 1.00 0.00 H new ATOM 0 HG13 ILE B 75 -9.962 -8.961 6.170 1.00 0.00 H new ATOM 0 HG21 ILE B 75 -9.927 -5.563 7.799 1.00 0.00 H new ATOM 0 HG22 ILE B 75 -11.700 -5.408 7.813 1.00 0.00 H new ATOM 0 HG23 ILE B 75 -10.905 -6.636 8.827 1.00 0.00 H new ATOM 0 HD11 ILE B 75 -7.665 -8.100 6.526 1.00 0.00 H new ATOM 0 HD12 ILE B 75 -8.569 -7.030 5.428 1.00 0.00 H new ATOM 0 HD13 ILE B 75 -8.329 -6.563 7.129 1.00 0.00 H new ATOM 1281 N ARG B 76 -13.891 -6.329 5.888 1.00 0.00 N ATOM 1282 CA ARG B 76 -14.930 -5.305 5.935 1.00 0.00 C ATOM 1283 C ARG B 76 -16.224 -5.860 6.495 1.00 0.00 C ATOM 1284 O ARG B 76 -16.899 -5.205 7.298 1.00 0.00 O ATOM 1285 CB ARG B 76 -15.170 -4.701 4.539 1.00 0.00 C ATOM 1286 CG ARG B 76 -16.211 -3.579 4.634 1.00 0.00 C ATOM 1287 CD ARG B 76 -16.468 -2.976 3.239 1.00 0.00 C ATOM 1288 NE ARG B 76 -16.682 -4.029 2.244 1.00 0.00 N ATOM 1289 CZ ARG B 76 -17.695 -4.893 2.295 1.00 0.00 C ATOM 1290 NH1 ARG B 76 -18.597 -4.796 3.223 1.00 0.00 N ATOM 1291 NH2 ARG B 76 -17.806 -5.813 1.381 1.00 0.00 N ATOM 0 H ARG B 76 -13.532 -6.525 4.954 1.00 0.00 H new ATOM 0 HA ARG B 76 -14.582 -4.515 6.600 1.00 0.00 H new ATOM 0 HB2 ARG B 76 -14.236 -4.310 4.136 1.00 0.00 H new ATOM 0 HB3 ARG B 76 -15.515 -5.474 3.852 1.00 0.00 H new ATOM 0 HG2 ARG B 76 -17.141 -3.969 5.047 1.00 0.00 H new ATOM 0 HG3 ARG B 76 -15.860 -2.804 5.315 1.00 0.00 H new ATOM 0 HD2 ARG B 76 -17.340 -2.323 3.276 1.00 0.00 H new ATOM 0 HD3 ARG B 76 -15.620 -2.359 2.944 1.00 0.00 H new ATOM 0 HE ARG B 76 -16.021 -4.105 1.471 1.00 0.00 H new ATOM 0 HH11 ARG B 76 -18.534 -4.054 3.920 1.00 0.00 H new ATOM 0 HH12 ARG B 76 -19.369 -5.461 3.255 1.00 0.00 H new ATOM 0 HH21 ARG B 76 -17.119 -5.871 0.629 1.00 0.00 H new ATOM 0 HH22 ARG B 76 -18.580 -6.476 1.416 1.00 0.00 H new ATOM 1305 N GLU B 77 -16.590 -7.043 6.061 1.00 0.00 N ATOM 1306 CA GLU B 77 -17.826 -7.631 6.517 1.00 0.00 C ATOM 1307 C GLU B 77 -17.800 -7.864 8.024 1.00 0.00 C ATOM 1308 O GLU B 77 -18.830 -7.755 8.689 1.00 0.00 O ATOM 1309 CB GLU B 77 -18.160 -8.910 5.757 1.00 0.00 C ATOM 1310 CG GLU B 77 -18.411 -8.571 4.269 1.00 0.00 C ATOM 1311 CD GLU B 77 -19.618 -7.648 4.087 1.00 0.00 C ATOM 1312 OE1 GLU B 77 -20.433 -7.559 4.977 1.00 0.00 O ATOM 1313 OE2 GLU B 77 -19.711 -7.045 3.038 1.00 0.00 O ATOM 0 H GLU B 77 -16.058 -7.611 5.402 1.00 0.00 H new ATOM 0 HA GLU B 77 -18.624 -6.919 6.305 1.00 0.00 H new ATOM 0 HB2 GLU B 77 -17.341 -9.624 5.846 1.00 0.00 H new ATOM 0 HB3 GLU B 77 -19.043 -9.383 6.188 1.00 0.00 H new ATOM 0 HG2 GLU B 77 -17.524 -8.095 3.851 1.00 0.00 H new ATOM 0 HG3 GLU B 77 -18.572 -9.492 3.709 1.00 0.00 H new ATOM 1320 N LYS B 78 -16.606 -8.083 8.585 1.00 0.00 N ATOM 1321 CA LYS B 78 -16.484 -8.195 10.037 1.00 0.00 C ATOM 1322 C LYS B 78 -16.921 -6.868 10.627 1.00 0.00 C ATOM 1323 O LYS B 78 -17.710 -6.800 11.592 1.00 0.00 O ATOM 1324 CB LYS B 78 -15.020 -8.410 10.411 1.00 0.00 C ATOM 1325 CG LYS B 78 -14.517 -9.723 9.852 1.00 0.00 C ATOM 1326 CD LYS B 78 -13.045 -9.858 10.233 1.00 0.00 C ATOM 1327 CE LYS B 78 -12.331 -10.826 9.293 1.00 0.00 C ATOM 1328 NZ LYS B 78 -13.292 -11.500 8.379 1.00 0.00 N ATOM 0 H LYS B 78 -15.732 -8.184 8.069 1.00 0.00 H new ATOM 0 HA LYS B 78 -17.086 -9.026 10.405 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -14.416 -7.589 10.026 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -14.911 -8.404 11.496 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -15.094 -10.556 10.254 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -14.635 -9.747 8.769 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -12.563 -8.881 10.192 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -12.961 -10.212 11.260 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -11.587 -10.286 8.708 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -11.795 -11.574 9.877 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -12.797 -12.236 7.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -14.054 -11.936 8.937 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -13.698 -10.801 7.725 1.00 0.00 H new ATOM 1342 N LYS B 79 -16.454 -5.813 9.968 1.00 0.00 N ATOM 1343 CA LYS B 79 -16.798 -4.451 10.311 1.00 0.00 C ATOM 1344 C LYS B 79 -18.271 -4.218 10.034 1.00 0.00 C ATOM 1345 O LYS B 79 -18.914 -3.367 10.665 1.00 0.00 O ATOM 1346 CB LYS B 79 -15.936 -3.460 9.516 1.00 0.00 C ATOM 1347 CG LYS B 79 -14.444 -3.878 9.554 1.00 0.00 C ATOM 1348 CD LYS B 79 -14.046 -4.386 10.950 1.00 0.00 C ATOM 1349 CE LYS B 79 -13.908 -3.199 11.909 1.00 0.00 C ATOM 1350 NZ LYS B 79 -13.619 -3.686 13.275 1.00 0.00 N ATOM 0 H LYS B 79 -15.819 -5.888 9.173 1.00 0.00 H new ATOM 0 HA LYS B 79 -16.604 -4.290 11.371 1.00 0.00 H new ATOM 0 HB2 LYS B 79 -16.281 -3.418 8.483 1.00 0.00 H new ATOM 0 HB3 LYS B 79 -16.049 -2.458 9.931 1.00 0.00 H new ATOM 0 HG2 LYS B 79 -14.263 -4.658 8.815 1.00 0.00 H new ATOM 0 HG3 LYS B 79 -13.818 -3.028 9.281 1.00 0.00 H new ATOM 0 HD2 LYS B 79 -14.798 -5.082 11.323 1.00 0.00 H new ATOM 0 HD3 LYS B 79 -13.105 -4.933 10.894 1.00 0.00 H new ATOM 0 HE2 LYS B 79 -13.108 -2.539 11.572 1.00 0.00 H new ATOM 0 HE3 LYS B 79 -14.827 -2.612 11.910 1.00 0.00 H new ATOM 0 HZ1 LYS B 79 -13.527 -2.876 13.920 1.00 0.00 H new ATOM 0 HZ2 LYS B 79 -14.396 -4.298 13.597 1.00 0.00 H new ATOM 0 HZ3 LYS B 79 -12.731 -4.227 13.270 1.00 0.00 H new ATOM 1364 N LYS B 80 -18.784 -4.939 9.041 1.00 0.00 N ATOM 1365 CA LYS B 80 -20.179 -4.825 8.611 1.00 0.00 C ATOM 1366 C LYS B 80 -20.357 -3.515 7.867 1.00 0.00 C ATOM 1367 O LYS B 80 -21.482 -3.022 7.681 1.00 0.00 O ATOM 1368 CB LYS B 80 -21.122 -4.889 9.819 1.00 0.00 C ATOM 1369 CG LYS B 80 -20.675 -6.035 10.737 1.00 0.00 C ATOM 1370 CD LYS B 80 -21.492 -6.027 12.022 1.00 0.00 C ATOM 1371 CE LYS B 80 -20.862 -7.007 13.021 1.00 0.00 C ATOM 1372 NZ LYS B 80 -19.480 -6.542 13.362 1.00 0.00 N ATOM 0 H LYS B 80 -18.244 -5.622 8.509 1.00 0.00 H new ATOM 0 HA LYS B 80 -20.426 -5.656 7.951 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -21.105 -3.943 10.361 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -22.148 -5.049 9.488 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -20.797 -6.990 10.225 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -19.615 -5.932 10.970 1.00 0.00 H new ATOM 0 HD2 LYS B 80 -21.518 -5.023 12.445 1.00 0.00 H new ATOM 0 HD3 LYS B 80 -22.523 -6.312 11.814 1.00 0.00 H new ATOM 0 HE2 LYS B 80 -21.471 -7.067 13.923 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -20.826 -8.009 12.593 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 -19.205 -6.922 14.290 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 -18.812 -6.877 12.639 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 -19.462 -5.503 13.395 1.00 0.00 H new ATOM 1386 N ILE B 81 -19.233 -2.975 7.426 1.00 0.00 N ATOM 1387 CA ILE B 81 -19.187 -1.747 6.667 1.00 0.00 C ATOM 1388 C ILE B 81 -19.551 -1.986 5.224 1.00 0.00 C ATOM 1389 O ILE B 81 -19.020 -2.885 4.572 1.00 0.00 O ATOM 1390 CB ILE B 81 -17.791 -1.076 6.809 1.00 0.00 C ATOM 1391 CG1 ILE B 81 -17.778 -0.124 8.001 1.00 0.00 C ATOM 1392 CG2 ILE B 81 -17.391 -0.315 5.553 1.00 0.00 C ATOM 1393 CD1 ILE B 81 -18.301 -0.828 9.239 1.00 0.00 C ATOM 0 H ILE B 81 -18.315 -3.388 7.591 1.00 0.00 H new ATOM 0 HA ILE B 81 -19.930 -1.060 7.072 1.00 0.00 H new ATOM 0 HB ILE B 81 -17.068 -1.876 6.965 1.00 0.00 H new ATOM 0 HG12 ILE B 81 -16.764 0.234 8.179 1.00 0.00 H new ATOM 0 HG13 ILE B 81 -18.392 0.750 7.784 1.00 0.00 H new ATOM 0 HG21 ILE B 81 -16.410 0.137 5.698 1.00 0.00 H new ATOM 0 HG22 ILE B 81 -17.353 -1.002 4.708 1.00 0.00 H new ATOM 0 HG23 ILE B 81 -18.124 0.466 5.352 1.00 0.00 H new ATOM 0 HD11 ILE B 81 -18.287 -0.138 10.083 1.00 0.00 H new ATOM 0 HD12 ILE B 81 -19.323 -1.164 9.062 1.00 0.00 H new ATOM 0 HD13 ILE B 81 -17.670 -1.688 9.463 1.00 0.00 H new ATOM 1405 N SER B 82 -20.419 -1.148 4.719 1.00 0.00 N ATOM 1406 CA SER B 82 -20.827 -1.201 3.342 1.00 0.00 C ATOM 1407 C SER B 82 -19.647 -0.826 2.460 1.00 0.00 C ATOM 1408 O SER B 82 -18.822 0.010 2.841 1.00 0.00 O ATOM 1409 CB SER B 82 -21.968 -0.207 3.123 1.00 0.00 C ATOM 1410 OG SER B 82 -22.912 -0.335 4.189 1.00 0.00 O ATOM 0 H SER B 82 -20.865 -0.405 5.257 1.00 0.00 H new ATOM 0 HA SER B 82 -21.165 -2.206 3.089 1.00 0.00 H new ATOM 0 HB2 SER B 82 -21.578 0.810 3.086 1.00 0.00 H new ATOM 0 HB3 SER B 82 -22.454 -0.397 2.166 1.00 0.00 H new ATOM 0 HG SER B 82 -22.656 0.259 4.926 1.00 0.00 H new ATOM 1416 N GLN B 83 -19.591 -1.369 1.263 1.00 0.00 N ATOM 1417 CA GLN B 83 -18.521 -0.988 0.359 1.00 0.00 C ATOM 1418 C GLN B 83 -18.589 0.518 0.154 1.00 0.00 C ATOM 1419 O GLN B 83 -17.571 1.203 0.100 1.00 0.00 O ATOM 1420 CB GLN B 83 -18.687 -1.679 -1.003 1.00 0.00 C ATOM 1421 CG GLN B 83 -18.458 -3.182 -0.898 1.00 0.00 C ATOM 1422 CD GLN B 83 -18.680 -3.816 -2.271 1.00 0.00 C ATOM 1423 OE1 GLN B 83 -19.616 -3.437 -2.986 1.00 0.00 O ATOM 1424 NE2 GLN B 83 -17.879 -4.740 -2.692 1.00 0.00 N ATOM 0 H GLN B 83 -20.251 -2.056 0.898 1.00 0.00 H new ATOM 0 HA GLN B 83 -17.564 -1.286 0.788 1.00 0.00 H new ATOM 0 HB2 GLN B 83 -19.688 -1.489 -1.389 1.00 0.00 H new ATOM 0 HB3 GLN B 83 -17.983 -1.252 -1.717 1.00 0.00 H new ATOM 0 HG2 GLN B 83 -17.446 -3.385 -0.549 1.00 0.00 H new ATOM 0 HG3 GLN B 83 -19.140 -3.617 -0.168 1.00 0.00 H new ATOM 0 HE21 GLN B 83 -17.107 -5.053 -2.103 1.00 0.00 H new ATOM 0 HE22 GLN B 83 -18.019 -5.156 -3.613 1.00 0.00 H new ATOM 1433 N SER B 84 -19.810 1.013 0.027 1.00 0.00 N ATOM 1434 CA SER B 84 -20.066 2.417 -0.219 1.00 0.00 C ATOM 1435 C SER B 84 -19.576 3.310 0.919 1.00 0.00 C ATOM 1436 O SER B 84 -18.947 4.344 0.669 1.00 0.00 O ATOM 1437 CB SER B 84 -21.561 2.610 -0.429 1.00 0.00 C ATOM 1438 OG SER B 84 -22.256 1.619 0.334 1.00 0.00 O ATOM 0 H SER B 84 -20.655 0.445 0.093 1.00 0.00 H new ATOM 0 HA SER B 84 -19.511 2.713 -1.109 1.00 0.00 H new ATOM 0 HB2 SER B 84 -21.862 3.610 -0.116 1.00 0.00 H new ATOM 0 HB3 SER B 84 -21.810 2.519 -1.486 1.00 0.00 H new ATOM 0 HG SER B 84 -23.222 1.730 0.212 1.00 0.00 H new ATOM 1444 N GLU B 85 -19.856 2.926 2.167 1.00 0.00 N ATOM 1445 CA GLU B 85 -19.444 3.758 3.283 1.00 0.00 C ATOM 1446 C GLU B 85 -17.932 3.793 3.393 1.00 0.00 C ATOM 1447 O GLU B 85 -17.339 4.865 3.436 1.00 0.00 O ATOM 1448 CB GLU B 85 -20.149 3.360 4.608 1.00 0.00 C ATOM 1449 CG GLU B 85 -19.645 2.023 5.160 1.00 0.00 C ATOM 1450 CD GLU B 85 -20.528 1.581 6.314 1.00 0.00 C ATOM 1451 OE1 GLU B 85 -20.358 2.097 7.398 1.00 0.00 O ATOM 1452 OE2 GLU B 85 -21.381 0.741 6.093 1.00 0.00 O ATOM 0 H GLU B 85 -20.351 2.070 2.419 1.00 0.00 H new ATOM 0 HA GLU B 85 -19.772 4.778 3.084 1.00 0.00 H new ATOM 0 HB2 GLU B 85 -19.987 4.141 5.351 1.00 0.00 H new ATOM 0 HB3 GLU B 85 -21.224 3.298 4.440 1.00 0.00 H new ATOM 0 HG2 GLU B 85 -19.652 1.268 4.374 1.00 0.00 H new ATOM 0 HG3 GLU B 85 -18.613 2.123 5.496 1.00 0.00 H new ATOM 1459 N LEU B 86 -17.313 2.627 3.225 1.00 0.00 N ATOM 1460 CA LEU B 86 -15.858 2.516 3.174 1.00 0.00 C ATOM 1461 C LEU B 86 -15.334 3.320 1.994 1.00 0.00 C ATOM 1462 O LEU B 86 -14.382 4.096 2.127 1.00 0.00 O ATOM 1463 CB LEU B 86 -15.449 1.046 2.985 1.00 0.00 C ATOM 1464 CG LEU B 86 -13.912 0.918 2.949 1.00 0.00 C ATOM 1465 CD1 LEU B 86 -13.320 1.226 4.331 1.00 0.00 C ATOM 1466 CD2 LEU B 86 -13.520 -0.497 2.522 1.00 0.00 C ATOM 0 H LEU B 86 -17.802 1.738 3.121 1.00 0.00 H new ATOM 0 HA LEU B 86 -15.441 2.896 4.107 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -15.852 0.442 3.798 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -15.875 0.659 2.059 1.00 0.00 H new ATOM 0 HG LEU B 86 -13.516 1.635 2.229 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -12.235 1.132 4.291 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -13.586 2.242 4.622 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -13.719 0.523 5.062 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -12.434 -0.582 2.498 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -13.925 -1.217 3.233 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -13.922 -0.702 1.530 1.00 0.00 H new ATOM 1478 N ALA B 87 -15.994 3.175 0.848 1.00 0.00 N ATOM 1479 CA ALA B 87 -15.604 3.927 -0.337 1.00 0.00 C ATOM 1480 C ALA B 87 -15.718 5.411 -0.050 1.00 0.00 C ATOM 1481 O ALA B 87 -14.837 6.202 -0.417 1.00 0.00 O ATOM 1482 CB ALA B 87 -16.490 3.557 -1.529 1.00 0.00 C ATOM 0 H ALA B 87 -16.791 2.552 0.717 1.00 0.00 H new ATOM 0 HA ALA B 87 -14.572 3.680 -0.588 1.00 0.00 H new ATOM 0 HB1 ALA B 87 -16.182 4.130 -2.403 1.00 0.00 H new ATOM 0 HB2 ALA B 87 -16.391 2.492 -1.740 1.00 0.00 H new ATOM 0 HB3 ALA B 87 -17.530 3.785 -1.294 1.00 0.00 H new ATOM 1488 N ALA B 88 -16.746 5.769 0.705 1.00 0.00 N ATOM 1489 CA ALA B 88 -16.923 7.140 1.138 1.00 0.00 C ATOM 1490 C ALA B 88 -15.748 7.563 1.993 1.00 0.00 C ATOM 1491 O ALA B 88 -15.261 8.686 1.877 1.00 0.00 O ATOM 1492 CB ALA B 88 -18.224 7.301 1.936 1.00 0.00 C ATOM 0 H ALA B 88 -17.469 5.126 1.029 1.00 0.00 H new ATOM 0 HA ALA B 88 -16.980 7.773 0.253 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -18.333 8.339 2.249 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -19.071 7.020 1.311 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -18.193 6.658 2.816 1.00 0.00 H new ATOM 1498 N LEU B 89 -15.267 6.650 2.842 1.00 0.00 N ATOM 1499 CA LEU B 89 -14.129 6.971 3.701 1.00 0.00 C ATOM 1500 C LEU B 89 -12.933 7.262 2.806 1.00 0.00 C ATOM 1501 O LEU B 89 -12.223 8.256 2.976 1.00 0.00 O ATOM 1502 CB LEU B 89 -13.762 5.774 4.593 1.00 0.00 C ATOM 1503 CG LEU B 89 -14.995 5.201 5.302 1.00 0.00 C ATOM 1504 CD1 LEU B 89 -14.586 4.041 6.205 1.00 0.00 C ATOM 1505 CD2 LEU B 89 -15.736 6.259 6.111 1.00 0.00 C ATOM 0 H LEU B 89 -15.638 5.706 2.951 1.00 0.00 H new ATOM 0 HA LEU B 89 -14.389 7.823 4.330 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -13.296 4.997 3.987 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -13.026 6.084 5.335 1.00 0.00 H new ATOM 0 HG LEU B 89 -15.678 4.842 4.532 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -15.468 3.640 6.705 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -14.122 3.259 5.605 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -13.875 4.394 6.952 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -16.602 5.807 6.595 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -15.070 6.670 6.869 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -16.067 7.058 5.448 1.00 0.00 H new ATOM 1517 N LEU B 90 -12.786 6.427 1.792 1.00 0.00 N ATOM 1518 CA LEU B 90 -11.741 6.568 0.789 1.00 0.00 C ATOM 1519 C LEU B 90 -11.937 7.803 -0.049 1.00 0.00 C ATOM 1520 O LEU B 90 -10.976 8.301 -0.653 1.00 0.00 O ATOM 1521 CB LEU B 90 -11.660 5.328 -0.102 1.00 0.00 C ATOM 1522 CG LEU B 90 -10.699 4.288 0.503 1.00 0.00 C ATOM 1523 CD1 LEU B 90 -10.850 4.229 2.030 1.00 0.00 C ATOM 1524 CD2 LEU B 90 -11.007 2.913 -0.096 1.00 0.00 C ATOM 0 H LEU B 90 -13.395 5.623 1.639 1.00 0.00 H new ATOM 0 HA LEU B 90 -10.797 6.672 1.324 1.00 0.00 H new ATOM 0 HB2 LEU B 90 -12.652 4.891 -0.217 1.00 0.00 H new ATOM 0 HB3 LEU B 90 -11.319 5.611 -1.098 1.00 0.00 H new ATOM 0 HG LEU B 90 -9.674 4.578 0.270 1.00 0.00 H new ATOM 0 HD11 LEU B 90 -10.161 3.488 2.435 1.00 0.00 H new ATOM 0 HD12 LEU B 90 -10.623 5.206 2.456 1.00 0.00 H new ATOM 0 HD13 LEU B 90 -11.873 3.951 2.284 1.00 0.00 H new ATOM 0 HD21 LEU B 90 -10.330 2.171 0.328 1.00 0.00 H new ATOM 0 HD22 LEU B 90 -12.036 2.638 0.134 1.00 0.00 H new ATOM 0 HD23 LEU B 90 -10.874 2.949 -1.177 1.00 0.00 H new ATOM 1536 N GLU B 91 -13.191 8.219 -0.166 1.00 0.00 N ATOM 1537 CA GLU B 91 -13.603 9.308 -1.050 1.00 0.00 C ATOM 1538 C GLU B 91 -13.771 8.775 -2.466 1.00 0.00 C ATOM 1539 O GLU B 91 -13.611 9.513 -3.443 1.00 0.00 O ATOM 1540 CB GLU B 91 -12.552 10.427 -1.077 1.00 0.00 C ATOM 1541 CG GLU B 91 -12.232 10.918 0.335 1.00 0.00 C ATOM 1542 CD GLU B 91 -11.149 11.960 0.246 1.00 0.00 C ATOM 1543 OE1 GLU B 91 -11.396 12.982 -0.352 1.00 0.00 O ATOM 1544 OE2 GLU B 91 -10.071 11.711 0.744 1.00 0.00 O ATOM 0 H GLU B 91 -13.963 7.806 0.356 1.00 0.00 H new ATOM 0 HA GLU B 91 -14.543 9.710 -0.673 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -11.642 10.063 -1.554 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -12.917 11.258 -1.680 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -13.124 11.338 0.801 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -11.907 10.087 0.960 1.00 0.00 H new ATOM 1551 N VAL B 92 -14.136 7.509 -2.567 1.00 0.00 N ATOM 1552 CA VAL B 92 -14.363 6.867 -3.852 1.00 0.00 C ATOM 1553 C VAL B 92 -15.724 6.187 -3.867 1.00 0.00 C ATOM 1554 O VAL B 92 -16.351 6.009 -2.820 1.00 0.00 O ATOM 1555 CB VAL B 92 -13.249 5.849 -4.163 1.00 0.00 C ATOM 1556 CG1 VAL B 92 -11.905 6.571 -4.304 1.00 0.00 C ATOM 1557 CG2 VAL B 92 -13.150 4.811 -3.038 1.00 0.00 C ATOM 0 H VAL B 92 -14.283 6.898 -1.764 1.00 0.00 H new ATOM 0 HA VAL B 92 -14.345 7.634 -4.626 1.00 0.00 H new ATOM 0 HB VAL B 92 -13.492 5.344 -5.098 1.00 0.00 H new ATOM 0 HG11 VAL B 92 -11.123 5.844 -4.524 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -11.965 7.296 -5.116 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -11.670 7.087 -3.373 1.00 0.00 H new ATOM 0 HG21 VAL B 92 -12.359 4.097 -3.270 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -12.921 5.314 -2.098 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -14.099 4.283 -2.945 1.00 0.00 H new ATOM 1567 N SER B 93 -16.199 5.858 -5.050 1.00 0.00 N ATOM 1568 CA SER B 93 -17.494 5.219 -5.209 1.00 0.00 C ATOM 1569 C SER B 93 -17.412 3.749 -4.791 1.00 0.00 C ATOM 1570 O SER B 93 -16.309 3.206 -4.624 1.00 0.00 O ATOM 1571 CB SER B 93 -17.928 5.337 -6.657 1.00 0.00 C ATOM 1572 OG SER B 93 -17.594 6.638 -7.127 1.00 0.00 O ATOM 0 H SER B 93 -15.703 6.024 -5.926 1.00 0.00 H new ATOM 0 HA SER B 93 -18.228 5.712 -4.571 1.00 0.00 H new ATOM 0 HB2 SER B 93 -17.434 4.578 -7.263 1.00 0.00 H new ATOM 0 HB3 SER B 93 -19.001 5.167 -6.745 1.00 0.00 H new ATOM 0 HG SER B 93 -17.868 6.728 -8.064 1.00 0.00 H new ATOM 1578 N ARG B 94 -18.557 3.118 -4.582 1.00 0.00 N ATOM 1579 CA ARG B 94 -18.582 1.742 -4.111 1.00 0.00 C ATOM 1580 C ARG B 94 -17.851 0.862 -5.117 1.00 0.00 C ATOM 1581 O ARG B 94 -17.109 -0.052 -4.745 1.00 0.00 O ATOM 1582 CB ARG B 94 -20.025 1.243 -3.993 1.00 0.00 C ATOM 1583 CG ARG B 94 -20.055 0.014 -3.079 1.00 0.00 C ATOM 1584 CD ARG B 94 -21.421 -0.671 -3.158 1.00 0.00 C ATOM 1585 NE ARG B 94 -21.333 -1.818 -4.060 1.00 0.00 N ATOM 1586 CZ ARG B 94 -22.205 -2.026 -5.051 1.00 0.00 C ATOM 1587 NH1 ARG B 94 -23.275 -1.281 -5.154 1.00 0.00 N ATOM 1588 NH2 ARG B 94 -22.000 -2.999 -5.890 1.00 0.00 N ATOM 0 H ARG B 94 -19.477 3.534 -4.730 1.00 0.00 H new ATOM 0 HA ARG B 94 -18.102 1.696 -3.133 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -20.663 2.029 -3.588 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -20.417 0.989 -4.978 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -19.272 -0.685 -3.372 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -19.848 0.311 -2.051 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -21.736 -0.996 -2.166 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -22.173 0.032 -3.516 1.00 0.00 H new ATOM 0 HE ARG B 94 -20.575 -2.487 -3.927 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -23.446 -0.538 -4.476 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -23.938 -1.443 -5.912 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -21.179 -3.596 -5.788 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -22.660 -3.165 -6.649 1.00 0.00 H new ATOM 1602 N GLN B 95 -18.115 1.101 -6.392 1.00 0.00 N ATOM 1603 CA GLN B 95 -17.541 0.294 -7.462 1.00 0.00 C ATOM 1604 C GLN B 95 -16.043 0.151 -7.292 1.00 0.00 C ATOM 1605 O GLN B 95 -15.474 -0.902 -7.587 1.00 0.00 O ATOM 1606 CB GLN B 95 -17.872 0.883 -8.844 1.00 0.00 C ATOM 1607 CG GLN B 95 -17.695 2.407 -8.835 1.00 0.00 C ATOM 1608 CD GLN B 95 -19.010 3.079 -8.464 1.00 0.00 C ATOM 1609 OE1 GLN B 95 -19.498 2.906 -7.344 1.00 0.00 O ATOM 1610 NE2 GLN B 95 -19.622 3.816 -9.328 1.00 0.00 N ATOM 0 H GLN B 95 -18.726 1.851 -6.714 1.00 0.00 H new ATOM 0 HA GLN B 95 -17.989 -0.698 -7.400 1.00 0.00 H new ATOM 0 HB2 GLN B 95 -17.223 0.440 -9.600 1.00 0.00 H new ATOM 0 HB3 GLN B 95 -18.897 0.632 -9.117 1.00 0.00 H new ATOM 0 HG2 GLN B 95 -16.919 2.688 -8.122 1.00 0.00 H new ATOM 0 HG3 GLN B 95 -17.366 2.749 -9.816 1.00 0.00 H new ATOM 0 HE21 GLN B 95 -19.218 3.959 -10.254 1.00 0.00 H new ATOM 0 HE22 GLN B 95 -20.510 4.256 -9.085 1.00 0.00 H new ATOM 1619 N THR B 96 -15.411 1.183 -6.767 1.00 0.00 N ATOM 1620 CA THR B 96 -13.984 1.140 -6.538 1.00 0.00 C ATOM 1621 C THR B 96 -13.657 -0.035 -5.626 1.00 0.00 C ATOM 1622 O THR B 96 -12.813 -0.876 -5.948 1.00 0.00 O ATOM 1623 CB THR B 96 -13.535 2.450 -5.880 1.00 0.00 C ATOM 1624 OG1 THR B 96 -14.513 3.463 -6.128 1.00 0.00 O ATOM 1625 CG2 THR B 96 -12.188 2.884 -6.465 1.00 0.00 C ATOM 0 H THR B 96 -15.862 2.056 -6.493 1.00 0.00 H new ATOM 0 HA THR B 96 -13.461 1.017 -7.487 1.00 0.00 H new ATOM 0 HB THR B 96 -13.429 2.300 -4.806 1.00 0.00 H new ATOM 0 HG1 THR B 96 -15.074 3.577 -5.333 1.00 0.00 H new ATOM 0 HG21 THR B 96 -11.871 3.815 -5.996 1.00 0.00 H new ATOM 0 HG22 THR B 96 -11.443 2.111 -6.276 1.00 0.00 H new ATOM 0 HG23 THR B 96 -12.290 3.035 -7.540 1.00 0.00 H new ATOM 1633 N ILE B 97 -14.420 -0.135 -4.556 1.00 0.00 N ATOM 1634 CA ILE B 97 -14.311 -1.225 -3.610 1.00 0.00 C ATOM 1635 C ILE B 97 -14.707 -2.542 -4.275 1.00 0.00 C ATOM 1636 O ILE B 97 -14.081 -3.573 -4.048 1.00 0.00 O ATOM 1637 CB ILE B 97 -15.217 -0.935 -2.399 1.00 0.00 C ATOM 1638 CG1 ILE B 97 -14.875 0.444 -1.809 1.00 0.00 C ATOM 1639 CG2 ILE B 97 -15.007 -1.998 -1.325 1.00 0.00 C ATOM 1640 CD1 ILE B 97 -13.411 0.487 -1.361 1.00 0.00 C ATOM 0 H ILE B 97 -15.141 0.546 -4.317 1.00 0.00 H new ATOM 0 HA ILE B 97 -13.279 -1.314 -3.272 1.00 0.00 H new ATOM 0 HB ILE B 97 -16.256 -0.947 -2.729 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -15.057 1.220 -2.553 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -15.527 0.656 -0.962 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -15.651 -1.786 -0.472 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -15.254 -2.979 -1.731 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -13.965 -1.990 -1.004 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -13.186 1.470 -0.946 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -13.241 -0.275 -0.601 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -12.763 0.297 -2.217 1.00 0.00 H new ATOM 1652 N ASN B 98 -15.781 -2.509 -5.056 1.00 0.00 N ATOM 1653 CA ASN B 98 -16.325 -3.736 -5.647 1.00 0.00 C ATOM 1654 C ASN B 98 -15.248 -4.452 -6.449 1.00 0.00 C ATOM 1655 O ASN B 98 -15.044 -5.659 -6.300 1.00 0.00 O ATOM 1656 CB ASN B 98 -17.465 -3.386 -6.618 1.00 0.00 C ATOM 1657 CG ASN B 98 -18.740 -3.006 -5.876 1.00 0.00 C ATOM 1658 OD1 ASN B 98 -19.678 -3.806 -5.778 1.00 0.00 O ATOM 1659 ND2 ASN B 98 -18.830 -1.836 -5.335 1.00 0.00 N ATOM 0 H ASN B 98 -16.291 -1.659 -5.295 1.00 0.00 H new ATOM 0 HA ASN B 98 -16.686 -4.372 -4.838 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -17.157 -2.560 -7.259 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -17.663 -4.237 -7.269 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -19.674 -1.572 -4.827 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -18.057 -1.176 -5.416 1.00 0.00 H new ATOM 1666 N GLY B 99 -14.518 -3.696 -7.253 1.00 0.00 N ATOM 1667 CA GLY B 99 -13.432 -4.261 -8.039 1.00 0.00 C ATOM 1668 C GLY B 99 -12.315 -4.730 -7.135 1.00 0.00 C ATOM 1669 O GLY B 99 -11.759 -5.822 -7.323 1.00 0.00 O ATOM 0 H GLY B 99 -14.656 -2.693 -7.379 1.00 0.00 H new ATOM 0 HA2 GLY B 99 -13.802 -5.096 -8.634 1.00 0.00 H new ATOM 0 HA3 GLY B 99 -13.054 -3.515 -8.738 1.00 0.00 H new ATOM 1673 N ILE B 100 -12.010 -3.919 -6.130 1.00 0.00 N ATOM 1674 CA ILE B 100 -10.973 -4.244 -5.170 1.00 0.00 C ATOM 1675 C ILE B 100 -11.353 -5.503 -4.397 1.00 0.00 C ATOM 1676 O ILE B 100 -10.538 -6.415 -4.220 1.00 0.00 O ATOM 1677 CB ILE B 100 -10.784 -3.058 -4.200 1.00 0.00 C ATOM 1678 CG1 ILE B 100 -10.188 -1.864 -4.954 1.00 0.00 C ATOM 1679 CG2 ILE B 100 -9.845 -3.447 -3.059 1.00 0.00 C ATOM 1680 CD1 ILE B 100 -10.265 -0.609 -4.078 1.00 0.00 C ATOM 0 H ILE B 100 -12.472 -3.026 -5.961 1.00 0.00 H new ATOM 0 HA ILE B 100 -10.037 -4.430 -5.696 1.00 0.00 H new ATOM 0 HB ILE B 100 -11.756 -2.789 -3.788 1.00 0.00 H new ATOM 0 HG12 ILE B 100 -9.151 -2.070 -5.220 1.00 0.00 H new ATOM 0 HG13 ILE B 100 -10.730 -1.703 -5.886 1.00 0.00 H new ATOM 0 HG21 ILE B 100 -9.722 -2.600 -2.384 1.00 0.00 H new ATOM 0 HG22 ILE B 100 -10.268 -4.289 -2.511 1.00 0.00 H new ATOM 0 HG23 ILE B 100 -8.874 -3.730 -3.467 1.00 0.00 H new ATOM 0 HD11 ILE B 100 -9.840 0.238 -4.617 1.00 0.00 H new ATOM 0 HD12 ILE B 100 -11.306 -0.399 -3.834 1.00 0.00 H new ATOM 0 HD13 ILE B 100 -9.703 -0.772 -3.158 1.00 0.00 H new ATOM 1692 N GLU B 101 -12.598 -5.566 -3.961 1.00 0.00 N ATOM 1693 CA GLU B 101 -13.072 -6.713 -3.221 1.00 0.00 C ATOM 1694 C GLU B 101 -13.114 -7.954 -4.086 1.00 0.00 C ATOM 1695 O GLU B 101 -12.729 -9.038 -3.649 1.00 0.00 O ATOM 1696 CB GLU B 101 -14.414 -6.434 -2.549 1.00 0.00 C ATOM 1697 CG GLU B 101 -14.184 -5.374 -1.453 1.00 0.00 C ATOM 1698 CD GLU B 101 -15.401 -5.198 -0.561 1.00 0.00 C ATOM 1699 OE1 GLU B 101 -16.398 -5.867 -0.775 1.00 0.00 O ATOM 1700 OE2 GLU B 101 -15.318 -4.411 0.338 1.00 0.00 O ATOM 0 H GLU B 101 -13.295 -4.836 -4.108 1.00 0.00 H new ATOM 0 HA GLU B 101 -12.355 -6.907 -2.424 1.00 0.00 H new ATOM 0 HB2 GLU B 101 -15.139 -6.076 -3.280 1.00 0.00 H new ATOM 0 HB3 GLU B 101 -14.821 -7.348 -2.116 1.00 0.00 H new ATOM 0 HG2 GLU B 101 -13.328 -5.664 -0.844 1.00 0.00 H new ATOM 0 HG3 GLU B 101 -13.936 -4.420 -1.919 1.00 0.00 H new ATOM 1707 N LYS B 102 -13.486 -7.779 -5.338 1.00 0.00 N ATOM 1708 CA LYS B 102 -13.477 -8.884 -6.286 1.00 0.00 C ATOM 1709 C LYS B 102 -12.067 -9.136 -6.794 1.00 0.00 C ATOM 1710 O LYS B 102 -11.842 -10.025 -7.624 1.00 0.00 O ATOM 1711 CB LYS B 102 -14.450 -8.627 -7.441 1.00 0.00 C ATOM 1712 CG LYS B 102 -15.812 -9.215 -7.066 1.00 0.00 C ATOM 1713 CD LYS B 102 -16.526 -8.290 -6.076 1.00 0.00 C ATOM 1714 CE LYS B 102 -17.765 -9.006 -5.535 1.00 0.00 C ATOM 1715 NZ LYS B 102 -18.460 -8.142 -4.551 1.00 0.00 N ATOM 0 H LYS B 102 -13.798 -6.888 -5.725 1.00 0.00 H new ATOM 0 HA LYS B 102 -13.815 -9.782 -5.770 1.00 0.00 H new ATOM 0 HB2 LYS B 102 -14.538 -7.557 -7.631 1.00 0.00 H new ATOM 0 HB3 LYS B 102 -14.079 -9.085 -8.358 1.00 0.00 H new ATOM 0 HG2 LYS B 102 -16.421 -9.343 -7.961 1.00 0.00 H new ATOM 0 HG3 LYS B 102 -15.682 -10.203 -6.625 1.00 0.00 H new ATOM 0 HD2 LYS B 102 -15.857 -8.025 -5.258 1.00 0.00 H new ATOM 0 HD3 LYS B 102 -16.812 -7.360 -6.568 1.00 0.00 H new ATOM 0 HE2 LYS B 102 -18.439 -9.253 -6.355 1.00 0.00 H new ATOM 0 HE3 LYS B 102 -17.476 -9.946 -5.066 1.00 0.00 H new ATOM 0 HZ1 LYS B 102 -19.300 -8.636 -4.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 102 -17.817 -7.928 -3.762 1.00 0.00 H new ATOM 0 HZ3 LYS B 102 -18.751 -7.256 -5.011 1.00 0.00 H new ATOM 1729 N ASN B 103 -11.122 -8.356 -6.285 1.00 0.00 N ATOM 1730 CA ASN B 103 -9.711 -8.487 -6.643 1.00 0.00 C ATOM 1731 C ASN B 103 -9.487 -8.326 -8.130 1.00 0.00 C ATOM 1732 O ASN B 103 -8.501 -8.846 -8.675 1.00 0.00 O ATOM 1733 CB ASN B 103 -9.143 -9.837 -6.167 1.00 0.00 C ATOM 1734 CG ASN B 103 -8.869 -9.795 -4.673 1.00 0.00 C ATOM 1735 OD1 ASN B 103 -7.866 -9.225 -4.247 1.00 0.00 O ATOM 1736 ND2 ASN B 103 -9.705 -10.343 -3.847 1.00 0.00 N ATOM 0 H ASN B 103 -11.310 -7.613 -5.612 1.00 0.00 H new ATOM 0 HA ASN B 103 -9.180 -7.682 -6.135 1.00 0.00 H new ATOM 0 HB2 ASN B 103 -9.849 -10.636 -6.392 1.00 0.00 H new ATOM 0 HB3 ASN B 103 -8.223 -10.063 -6.706 1.00 0.00 H new ATOM 0 HD21 ASN B 103 -9.531 -10.302 -2.843 1.00 0.00 H new ATOM 0 HD22 ASN B 103 -10.537 -10.815 -4.201 1.00 0.00 H new ATOM 1743 N LYS B 104 -10.315 -7.503 -8.768 1.00 0.00 N ATOM 1744 CA LYS B 104 -10.082 -7.168 -10.165 1.00 0.00 C ATOM 1745 C LYS B 104 -8.785 -6.391 -10.271 1.00 0.00 C ATOM 1746 O LYS B 104 -7.960 -6.635 -11.153 1.00 0.00 O ATOM 1747 CB LYS B 104 -11.233 -6.339 -10.748 1.00 0.00 C ATOM 1748 CG LYS B 104 -12.507 -7.193 -10.850 1.00 0.00 C ATOM 1749 CD LYS B 104 -13.630 -6.343 -11.469 1.00 0.00 C ATOM 1750 CE LYS B 104 -14.941 -7.144 -11.505 1.00 0.00 C ATOM 1751 NZ LYS B 104 -14.803 -8.275 -12.452 1.00 0.00 N ATOM 0 H LYS B 104 -11.136 -7.065 -8.349 1.00 0.00 H new ATOM 0 HA LYS B 104 -10.020 -8.093 -10.738 1.00 0.00 H new ATOM 0 HB2 LYS B 104 -11.419 -5.469 -10.118 1.00 0.00 H new ATOM 0 HB3 LYS B 104 -10.958 -5.965 -11.734 1.00 0.00 H new ATOM 0 HG2 LYS B 104 -12.321 -8.075 -11.463 1.00 0.00 H new ATOM 0 HG3 LYS B 104 -12.803 -7.547 -9.863 1.00 0.00 H new ATOM 0 HD2 LYS B 104 -13.768 -5.431 -10.889 1.00 0.00 H new ATOM 0 HD3 LYS B 104 -13.352 -6.040 -12.478 1.00 0.00 H new ATOM 0 HE2 LYS B 104 -15.179 -7.517 -10.509 1.00 0.00 H new ATOM 0 HE3 LYS B 104 -15.765 -6.499 -11.810 1.00 0.00 H new ATOM 0 HZ1 LYS B 104 -15.742 -8.671 -12.659 1.00 0.00 H new ATOM 0 HZ2 LYS B 104 -14.368 -7.938 -13.334 1.00 0.00 H new ATOM 0 HZ3 LYS B 104 -14.202 -9.011 -12.029 1.00 0.00 H new ATOM 1765 N TYR B 105 -8.595 -5.492 -9.319 1.00 0.00 N ATOM 1766 CA TYR B 105 -7.392 -4.686 -9.209 1.00 0.00 C ATOM 1767 C TYR B 105 -7.180 -4.307 -7.750 1.00 0.00 C ATOM 1768 O TYR B 105 -8.115 -4.390 -6.945 1.00 0.00 O ATOM 1769 CB TYR B 105 -7.511 -3.426 -10.069 1.00 0.00 C ATOM 1770 CG TYR B 105 -8.649 -2.576 -9.563 1.00 0.00 C ATOM 1771 CD1 TYR B 105 -9.953 -2.790 -10.029 1.00 0.00 C ATOM 1772 CD2 TYR B 105 -8.400 -1.577 -8.620 1.00 0.00 C ATOM 1773 CE1 TYR B 105 -11.000 -2.000 -9.550 1.00 0.00 C ATOM 1774 CE2 TYR B 105 -9.444 -0.792 -8.139 1.00 0.00 C ATOM 1775 CZ TYR B 105 -10.742 -1.002 -8.604 1.00 0.00 C ATOM 1776 OH TYR B 105 -11.773 -0.227 -8.126 1.00 0.00 O ATOM 0 H TYR B 105 -9.283 -5.300 -8.591 1.00 0.00 H new ATOM 0 HA TYR B 105 -6.538 -5.262 -9.566 1.00 0.00 H new ATOM 0 HB2 TYR B 105 -6.579 -2.861 -10.036 1.00 0.00 H new ATOM 0 HB3 TYR B 105 -7.682 -3.699 -11.110 1.00 0.00 H new ATOM 0 HD1 TYR B 105 -10.148 -3.564 -10.757 1.00 0.00 H new ATOM 0 HD2 TYR B 105 -7.394 -1.413 -8.263 1.00 0.00 H new ATOM 0 HE1 TYR B 105 -12.006 -2.159 -9.909 1.00 0.00 H new ATOM 0 HE2 TYR B 105 -9.249 -0.022 -7.407 1.00 0.00 H new ATOM 0 HH TYR B 105 -12.407 -0.792 -7.636 1.00 0.00 H new ATOM 1786 N ASN B 106 -5.976 -3.880 -7.403 1.00 0.00 N ATOM 1787 CA ASN B 106 -5.694 -3.465 -6.029 1.00 0.00 C ATOM 1788 C ASN B 106 -5.810 -1.954 -5.895 1.00 0.00 C ATOM 1789 O ASN B 106 -5.540 -1.221 -6.847 1.00 0.00 O ATOM 1790 CB ASN B 106 -4.306 -3.925 -5.581 1.00 0.00 C ATOM 1791 CG ASN B 106 -4.287 -5.441 -5.433 1.00 0.00 C ATOM 1792 OD1 ASN B 106 -3.820 -6.143 -6.325 1.00 0.00 O ATOM 1793 ND2 ASN B 106 -4.766 -5.993 -4.362 1.00 0.00 N ATOM 0 H ASN B 106 -5.184 -3.810 -8.042 1.00 0.00 H new ATOM 0 HA ASN B 106 -6.433 -3.938 -5.383 1.00 0.00 H new ATOM 0 HB2 ASN B 106 -3.557 -3.612 -6.308 1.00 0.00 H new ATOM 0 HB3 ASN B 106 -4.046 -3.455 -4.633 1.00 0.00 H new ATOM 0 HD21 ASN B 106 -4.754 -7.008 -4.262 1.00 0.00 H new ATOM 0 HD22 ASN B 106 -5.155 -5.412 -3.619 1.00 0.00 H new ATOM 1800 N PRO B 107 -6.212 -1.477 -4.743 1.00 0.00 N ATOM 1801 CA PRO B 107 -6.393 -0.008 -4.505 1.00 0.00 C ATOM 1802 C PRO B 107 -5.093 0.747 -4.677 1.00 0.00 C ATOM 1803 O PRO B 107 -4.016 0.201 -4.418 1.00 0.00 O ATOM 1804 CB PRO B 107 -6.835 0.083 -3.035 1.00 0.00 C ATOM 1805 CG PRO B 107 -7.236 -1.298 -2.659 1.00 0.00 C ATOM 1806 CD PRO B 107 -6.351 -2.221 -3.480 1.00 0.00 C ATOM 0 HA PRO B 107 -7.105 0.426 -5.208 1.00 0.00 H new ATOM 0 HB2 PRO B 107 -6.024 0.443 -2.402 1.00 0.00 H new ATOM 0 HB3 PRO B 107 -7.665 0.780 -2.916 1.00 0.00 H new ATOM 0 HG2 PRO B 107 -7.097 -1.469 -1.592 1.00 0.00 H new ATOM 0 HG3 PRO B 107 -8.290 -1.472 -2.875 1.00 0.00 H new ATOM 0 HD2 PRO B 107 -5.387 -2.393 -3.001 1.00 0.00 H new ATOM 0 HD3 PRO B 107 -6.811 -3.198 -3.631 1.00 0.00 H new ATOM 1814 N SER B 108 -5.196 2.023 -5.016 1.00 0.00 N ATOM 1815 CA SER B 108 -4.021 2.873 -5.055 1.00 0.00 C ATOM 1816 C SER B 108 -3.393 2.883 -3.658 1.00 0.00 C ATOM 1817 O SER B 108 -4.062 2.529 -2.674 1.00 0.00 O ATOM 1818 CB SER B 108 -4.402 4.301 -5.456 1.00 0.00 C ATOM 1819 OG SER B 108 -5.333 4.281 -6.551 1.00 0.00 O ATOM 0 H SER B 108 -6.070 2.486 -5.265 1.00 0.00 H new ATOM 0 HA SER B 108 -3.315 2.489 -5.792 1.00 0.00 H new ATOM 0 HB2 SER B 108 -4.843 4.820 -4.605 1.00 0.00 H new ATOM 0 HB3 SER B 108 -3.508 4.857 -5.740 1.00 0.00 H new ATOM 0 HG SER B 108 -5.569 5.200 -6.796 1.00 0.00 H new ATOM 1825 N LEU B 109 -2.128 3.260 -3.560 1.00 0.00 N ATOM 1826 CA LEU B 109 -1.432 3.217 -2.277 1.00 0.00 C ATOM 1827 C LEU B 109 -2.136 4.109 -1.266 1.00 0.00 C ATOM 1828 O LEU B 109 -2.396 3.698 -0.129 1.00 0.00 O ATOM 1829 CB LEU B 109 0.034 3.659 -2.453 1.00 0.00 C ATOM 1830 CG LEU B 109 0.772 3.636 -1.098 1.00 0.00 C ATOM 1831 CD1 LEU B 109 0.723 2.227 -0.494 1.00 0.00 C ATOM 1832 CD2 LEU B 109 2.236 4.052 -1.299 1.00 0.00 C ATOM 0 H LEU B 109 -1.565 3.596 -4.341 1.00 0.00 H new ATOM 0 HA LEU B 109 -1.445 2.193 -1.905 1.00 0.00 H new ATOM 0 HB2 LEU B 109 0.537 2.998 -3.159 1.00 0.00 H new ATOM 0 HB3 LEU B 109 0.069 4.663 -2.876 1.00 0.00 H new ATOM 0 HG LEU B 109 0.283 4.334 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU B 109 1.247 2.222 0.462 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -0.315 1.933 -0.340 1.00 0.00 H new ATOM 0 HD13 LEU B 109 1.203 1.523 -1.174 1.00 0.00 H new ATOM 0 HD21 LEU B 109 2.754 4.035 -0.340 1.00 0.00 H new ATOM 0 HD22 LEU B 109 2.720 3.358 -1.986 1.00 0.00 H new ATOM 0 HD23 LEU B 109 2.274 5.059 -1.714 1.00 0.00 H new ATOM 1844 N GLN B 110 -2.517 5.293 -1.701 1.00 0.00 N ATOM 1845 CA GLN B 110 -3.248 6.208 -0.839 1.00 0.00 C ATOM 1846 C GLN B 110 -4.577 5.587 -0.432 1.00 0.00 C ATOM 1847 O GLN B 110 -4.942 5.588 0.747 1.00 0.00 O ATOM 1848 CB GLN B 110 -3.487 7.539 -1.580 1.00 0.00 C ATOM 1849 CG GLN B 110 -4.214 8.537 -0.671 1.00 0.00 C ATOM 1850 CD GLN B 110 -4.351 9.889 -1.372 1.00 0.00 C ATOM 1851 OE1 GLN B 110 -3.656 10.159 -2.355 1.00 0.00 O ATOM 1852 NE2 GLN B 110 -5.202 10.752 -0.929 1.00 0.00 N ATOM 0 H GLN B 110 -2.335 5.646 -2.641 1.00 0.00 H new ATOM 0 HA GLN B 110 -2.662 6.402 0.060 1.00 0.00 H new ATOM 0 HB2 GLN B 110 -2.534 7.959 -1.902 1.00 0.00 H new ATOM 0 HB3 GLN B 110 -4.077 7.361 -2.479 1.00 0.00 H new ATOM 0 HG2 GLN B 110 -5.200 8.152 -0.412 1.00 0.00 H new ATOM 0 HG3 GLN B 110 -3.664 8.657 0.262 1.00 0.00 H new ATOM 0 HE21 GLN B 110 -5.777 10.530 -0.116 1.00 0.00 H new ATOM 0 HE22 GLN B 110 -5.299 11.656 -1.391 1.00 0.00 H new ATOM 1861 N LEU B 111 -5.278 5.015 -1.399 1.00 0.00 N ATOM 1862 CA LEU B 111 -6.546 4.360 -1.117 1.00 0.00 C ATOM 1863 C LEU B 111 -6.350 3.157 -0.207 1.00 0.00 C ATOM 1864 O LEU B 111 -7.091 2.969 0.760 1.00 0.00 O ATOM 1865 CB LEU B 111 -7.237 3.935 -2.415 1.00 0.00 C ATOM 1866 CG LEU B 111 -7.689 5.181 -3.195 1.00 0.00 C ATOM 1867 CD1 LEU B 111 -8.240 4.766 -4.558 1.00 0.00 C ATOM 1868 CD2 LEU B 111 -8.781 5.918 -2.410 1.00 0.00 C ATOM 0 H LEU B 111 -4.993 4.991 -2.378 1.00 0.00 H new ATOM 0 HA LEU B 111 -7.184 5.078 -0.602 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.555 3.341 -3.023 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -8.096 3.303 -2.191 1.00 0.00 H new ATOM 0 HG LEU B 111 -6.833 5.842 -3.334 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -8.559 5.652 -5.107 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -7.464 4.250 -5.122 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -9.091 4.100 -4.419 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -9.097 6.800 -2.967 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -9.634 5.256 -2.264 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -8.389 6.223 -1.440 1.00 0.00 H new ATOM 1880 N ALA B 112 -5.323 2.372 -0.493 1.00 0.00 N ATOM 1881 CA ALA B 112 -5.027 1.198 0.313 1.00 0.00 C ATOM 1882 C ALA B 112 -4.747 1.610 1.743 1.00 0.00 C ATOM 1883 O ALA B 112 -5.285 1.030 2.690 1.00 0.00 O ATOM 1884 CB ALA B 112 -3.823 0.448 -0.263 1.00 0.00 C ATOM 0 H ALA B 112 -4.684 2.525 -1.273 1.00 0.00 H new ATOM 0 HA ALA B 112 -5.892 0.534 0.297 1.00 0.00 H new ATOM 0 HB1 ALA B 112 -3.613 -0.428 0.350 1.00 0.00 H new ATOM 0 HB2 ALA B 112 -4.045 0.133 -1.283 1.00 0.00 H new ATOM 0 HB3 ALA B 112 -2.953 1.105 -0.267 1.00 0.00 H new ATOM 1890 N LEU B 113 -3.930 2.639 1.892 1.00 0.00 N ATOM 1891 CA LEU B 113 -3.600 3.155 3.205 1.00 0.00 C ATOM 1892 C LEU B 113 -4.829 3.717 3.917 1.00 0.00 C ATOM 1893 O LEU B 113 -5.022 3.464 5.113 1.00 0.00 O ATOM 1894 CB LEU B 113 -2.482 4.181 3.135 1.00 0.00 C ATOM 1895 CG LEU B 113 -1.154 3.494 2.766 1.00 0.00 C ATOM 1896 CD1 LEU B 113 -0.109 4.554 2.431 1.00 0.00 C ATOM 1897 CD2 LEU B 113 -0.651 2.677 3.961 1.00 0.00 C ATOM 0 H LEU B 113 -3.484 3.132 1.118 1.00 0.00 H new ATOM 0 HA LEU B 113 -3.238 2.316 3.799 1.00 0.00 H new ATOM 0 HB2 LEU B 113 -2.724 4.943 2.395 1.00 0.00 H new ATOM 0 HB3 LEU B 113 -2.383 4.689 4.095 1.00 0.00 H new ATOM 0 HG LEU B 113 -1.316 2.842 1.908 1.00 0.00 H new ATOM 0 HD11 LEU B 113 0.831 4.068 2.170 1.00 0.00 H new ATOM 0 HD12 LEU B 113 -0.455 5.152 1.588 1.00 0.00 H new ATOM 0 HD13 LEU B 113 0.044 5.200 3.296 1.00 0.00 H new ATOM 0 HD21 LEU B 113 0.289 2.191 3.700 1.00 0.00 H new ATOM 0 HD22 LEU B 113 -0.493 3.338 4.813 1.00 0.00 H new ATOM 0 HD23 LEU B 113 -1.391 1.920 4.221 1.00 0.00 H new ATOM 1909 N LYS B 114 -5.706 4.412 3.181 1.00 0.00 N ATOM 1910 CA LYS B 114 -6.928 4.904 3.810 1.00 0.00 C ATOM 1911 C LYS B 114 -7.729 3.742 4.372 1.00 0.00 C ATOM 1912 O LYS B 114 -8.266 3.819 5.476 1.00 0.00 O ATOM 1913 CB LYS B 114 -7.842 5.614 2.814 1.00 0.00 C ATOM 1914 CG LYS B 114 -7.321 6.987 2.422 1.00 0.00 C ATOM 1915 CD LYS B 114 -8.342 7.587 1.435 1.00 0.00 C ATOM 1916 CE LYS B 114 -7.965 9.010 1.060 1.00 0.00 C ATOM 1917 NZ LYS B 114 -8.984 9.583 0.126 1.00 0.00 N ATOM 0 H LYS B 114 -5.597 4.637 2.192 1.00 0.00 H new ATOM 0 HA LYS B 114 -6.613 5.599 4.588 1.00 0.00 H new ATOM 0 HB2 LYS B 114 -7.946 5.000 1.920 1.00 0.00 H new ATOM 0 HB3 LYS B 114 -8.837 5.717 3.248 1.00 0.00 H new ATOM 0 HG2 LYS B 114 -7.212 7.624 3.300 1.00 0.00 H new ATOM 0 HG3 LYS B 114 -6.337 6.909 1.960 1.00 0.00 H new ATOM 0 HD2 LYS B 114 -8.390 6.971 0.537 1.00 0.00 H new ATOM 0 HD3 LYS B 114 -9.336 7.576 1.883 1.00 0.00 H new ATOM 0 HE2 LYS B 114 -7.897 9.625 1.957 1.00 0.00 H new ATOM 0 HE3 LYS B 114 -6.982 9.022 0.590 1.00 0.00 H new ATOM 0 HZ1 LYS B 114 -8.584 9.639 -0.832 1.00 0.00 H new ATOM 0 HZ2 LYS B 114 -9.826 8.973 0.114 1.00 0.00 H new ATOM 0 HZ3 LYS B 114 -9.251 10.536 0.446 1.00 0.00 H new ATOM 1931 N ILE B 115 -7.829 2.671 3.595 1.00 0.00 N ATOM 1932 CA ILE B 115 -8.621 1.521 4.008 1.00 0.00 C ATOM 1933 C ILE B 115 -8.022 0.940 5.273 1.00 0.00 C ATOM 1934 O ILE B 115 -8.730 0.695 6.259 1.00 0.00 O ATOM 1935 CB ILE B 115 -8.627 0.458 2.894 1.00 0.00 C ATOM 1936 CG1 ILE B 115 -9.390 0.994 1.683 1.00 0.00 C ATOM 1937 CG2 ILE B 115 -9.327 -0.810 3.386 1.00 0.00 C ATOM 1938 CD1 ILE B 115 -9.174 0.059 0.491 1.00 0.00 C ATOM 0 H ILE B 115 -7.377 2.575 2.686 1.00 0.00 H new ATOM 0 HA ILE B 115 -9.648 1.833 4.197 1.00 0.00 H new ATOM 0 HB ILE B 115 -7.597 0.229 2.621 1.00 0.00 H new ATOM 0 HG12 ILE B 115 -10.453 1.068 1.913 1.00 0.00 H new ATOM 0 HG13 ILE B 115 -9.046 1.999 1.438 1.00 0.00 H new ATOM 0 HG21 ILE B 115 -9.327 -1.557 2.592 1.00 0.00 H new ATOM 0 HG22 ILE B 115 -8.799 -1.204 4.254 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -10.355 -0.574 3.662 1.00 0.00 H new ATOM 0 HD11 ILE B 115 -9.718 0.440 -0.373 1.00 0.00 H new ATOM 0 HD12 ILE B 115 -8.111 0.007 0.257 1.00 0.00 H new ATOM 0 HD13 ILE B 115 -9.540 -0.937 0.739 1.00 0.00 H new ATOM 1950 N ALA B 116 -6.706 0.823 5.276 1.00 0.00 N ATOM 1951 CA ALA B 116 -6.005 0.356 6.450 1.00 0.00 C ATOM 1952 C ALA B 116 -6.316 1.268 7.622 1.00 0.00 C ATOM 1953 O ALA B 116 -6.734 0.804 8.693 1.00 0.00 O ATOM 1954 CB ALA B 116 -4.494 0.303 6.192 1.00 0.00 C ATOM 0 H ALA B 116 -6.107 1.045 4.481 1.00 0.00 H new ATOM 0 HA ALA B 116 -6.340 -0.654 6.686 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -3.984 -0.051 7.088 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -4.290 -0.377 5.365 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -4.133 1.300 5.939 1.00 0.00 H new ATOM 1960 N TYR B 117 -6.193 2.568 7.392 1.00 0.00 N ATOM 1961 CA TYR B 117 -6.523 3.547 8.418 1.00 0.00 C ATOM 1962 C TYR B 117 -7.981 3.461 8.836 1.00 0.00 C ATOM 1963 O TYR B 117 -8.291 3.396 10.029 1.00 0.00 O ATOM 1964 CB TYR B 117 -6.235 4.967 7.904 1.00 0.00 C ATOM 1965 CG TYR B 117 -6.961 5.963 8.780 1.00 0.00 C ATOM 1966 CD1 TYR B 117 -6.407 6.396 9.987 1.00 0.00 C ATOM 1967 CD2 TYR B 117 -8.214 6.436 8.378 1.00 0.00 C ATOM 1968 CE1 TYR B 117 -7.111 7.306 10.786 1.00 0.00 C ATOM 1969 CE2 TYR B 117 -8.913 7.334 9.173 1.00 0.00 C ATOM 1970 CZ TYR B 117 -8.369 7.773 10.374 1.00 0.00 C ATOM 1971 OH TYR B 117 -9.075 8.658 11.158 1.00 0.00 O ATOM 0 H TYR B 117 -5.870 2.967 6.511 1.00 0.00 H new ATOM 0 HA TYR B 117 -5.903 3.326 9.286 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -5.163 5.163 7.919 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -6.562 5.067 6.869 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -5.441 6.031 10.303 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -8.640 6.101 7.444 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -6.686 7.648 11.718 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -9.882 7.692 8.857 1.00 0.00 H new ATOM 0 HH TYR B 117 -9.924 8.877 10.721 1.00 0.00 H new ATOM 1981 N TYR B 118 -8.874 3.509 7.867 1.00 0.00 N ATOM 1982 CA TYR B 118 -10.291 3.559 8.172 1.00 0.00 C ATOM 1983 C TYR B 118 -10.742 2.338 8.928 1.00 0.00 C ATOM 1984 O TYR B 118 -11.527 2.441 9.867 1.00 0.00 O ATOM 1985 CB TYR B 118 -11.140 3.776 6.921 1.00 0.00 C ATOM 1986 CG TYR B 118 -11.108 5.244 6.544 1.00 0.00 C ATOM 1987 CD1 TYR B 118 -11.699 6.195 7.386 1.00 0.00 C ATOM 1988 CD2 TYR B 118 -10.479 5.655 5.367 1.00 0.00 C ATOM 1989 CE1 TYR B 118 -11.664 7.549 7.047 1.00 0.00 C ATOM 1990 CE2 TYR B 118 -10.441 7.011 5.031 1.00 0.00 C ATOM 1991 CZ TYR B 118 -11.035 7.958 5.870 1.00 0.00 C ATOM 1992 OH TYR B 118 -10.995 9.294 5.539 1.00 0.00 O ATOM 0 H TYR B 118 -8.648 3.514 6.872 1.00 0.00 H new ATOM 0 HA TYR B 118 -10.440 4.423 8.819 1.00 0.00 H new ATOM 0 HB2 TYR B 118 -10.760 3.169 6.099 1.00 0.00 H new ATOM 0 HB3 TYR B 118 -12.166 3.458 7.104 1.00 0.00 H new ATOM 0 HD1 TYR B 118 -12.183 5.880 8.299 1.00 0.00 H new ATOM 0 HD2 TYR B 118 -10.022 4.925 4.716 1.00 0.00 H new ATOM 0 HE1 TYR B 118 -12.124 8.280 7.696 1.00 0.00 H new ATOM 0 HE2 TYR B 118 -9.952 7.328 4.122 1.00 0.00 H new ATOM 0 HH TYR B 118 -11.389 9.423 4.651 1.00 0.00 H new ATOM 2002 N LEU B 119 -10.238 1.192 8.543 1.00 0.00 N ATOM 2003 CA LEU B 119 -10.607 -0.033 9.219 1.00 0.00 C ATOM 2004 C LEU B 119 -9.710 -0.275 10.425 1.00 0.00 C ATOM 2005 O LEU B 119 -9.845 -1.289 11.111 1.00 0.00 O ATOM 2006 CB LEU B 119 -10.542 -1.225 8.257 1.00 0.00 C ATOM 2007 CG LEU B 119 -11.526 -1.009 7.094 1.00 0.00 C ATOM 2008 CD1 LEU B 119 -11.419 -2.173 6.113 1.00 0.00 C ATOM 2009 CD2 LEU B 119 -12.967 -0.921 7.620 1.00 0.00 C ATOM 0 H LEU B 119 -9.578 1.078 7.774 1.00 0.00 H new ATOM 0 HA LEU B 119 -11.634 0.071 9.569 1.00 0.00 H new ATOM 0 HB2 LEU B 119 -9.529 -1.339 7.872 1.00 0.00 H new ATOM 0 HB3 LEU B 119 -10.787 -2.146 8.787 1.00 0.00 H new ATOM 0 HG LEU B 119 -11.274 -0.075 6.591 1.00 0.00 H new ATOM 0 HD11 LEU B 119 -12.116 -2.020 5.289 1.00 0.00 H new ATOM 0 HD12 LEU B 119 -10.403 -2.228 5.723 1.00 0.00 H new ATOM 0 HD13 LEU B 119 -11.662 -3.104 6.625 1.00 0.00 H new ATOM 0 HD21 LEU B 119 -13.650 -0.768 6.785 1.00 0.00 H new ATOM 0 HD22 LEU B 119 -13.224 -1.847 8.134 1.00 0.00 H new ATOM 0 HD23 LEU B 119 -13.050 -0.085 8.315 1.00 0.00 H new ATOM 2021 N ASN B 120 -8.739 0.609 10.635 1.00 0.00 N ATOM 2022 CA ASN B 120 -7.773 0.432 11.722 1.00 0.00 C ATOM 2023 C ASN B 120 -7.121 -0.927 11.580 1.00 0.00 C ATOM 2024 O ASN B 120 -6.889 -1.639 12.562 1.00 0.00 O ATOM 2025 CB ASN B 120 -8.451 0.542 13.100 1.00 0.00 C ATOM 2026 CG ASN B 120 -8.925 1.965 13.375 1.00 0.00 C ATOM 2027 OD1 ASN B 120 -9.403 2.251 14.480 1.00 0.00 O ATOM 2028 ND2 ASN B 120 -8.841 2.877 12.451 1.00 0.00 N ATOM 0 H ASN B 120 -8.598 1.449 10.074 1.00 0.00 H new ATOM 0 HA ASN B 120 -7.024 1.221 11.656 1.00 0.00 H new ATOM 0 HB2 ASN B 120 -9.299 -0.141 13.145 1.00 0.00 H new ATOM 0 HB3 ASN B 120 -7.752 0.233 13.877 1.00 0.00 H new ATOM 0 HD21 ASN B 120 -9.169 3.825 12.638 1.00 0.00 H new ATOM 0 HD22 ASN B 120 -8.447 2.644 11.539 1.00 0.00 H new ATOM 2035 N THR B 121 -6.922 -1.322 10.349 1.00 0.00 N ATOM 2036 CA THR B 121 -6.382 -2.624 10.035 1.00 0.00 C ATOM 2037 C THR B 121 -5.124 -2.459 9.196 1.00 0.00 C ATOM 2038 O THR B 121 -5.044 -1.536 8.388 1.00 0.00 O ATOM 2039 CB THR B 121 -7.436 -3.423 9.268 1.00 0.00 C ATOM 2040 OG1 THR B 121 -8.711 -3.245 9.887 1.00 0.00 O ATOM 2041 CG2 THR B 121 -7.076 -4.906 9.273 1.00 0.00 C ATOM 0 H THR B 121 -7.130 -0.749 9.531 1.00 0.00 H new ATOM 0 HA THR B 121 -6.123 -3.157 10.950 1.00 0.00 H new ATOM 0 HB THR B 121 -7.472 -3.067 8.238 1.00 0.00 H new ATOM 0 HG1 THR B 121 -8.659 -2.515 10.539 1.00 0.00 H new ATOM 0 HG21 THR B 121 -7.833 -5.466 8.724 1.00 0.00 H new ATOM 0 HG22 THR B 121 -6.105 -5.046 8.798 1.00 0.00 H new ATOM 0 HG23 THR B 121 -7.032 -5.266 10.301 1.00 0.00 H new ATOM 2049 N PRO B 122 -4.127 -3.286 9.389 1.00 0.00 N ATOM 2050 CA PRO B 122 -2.865 -3.128 8.608 1.00 0.00 C ATOM 2051 C PRO B 122 -3.136 -3.246 7.114 1.00 0.00 C ATOM 2052 O PRO B 122 -3.935 -4.084 6.683 1.00 0.00 O ATOM 2053 CB PRO B 122 -1.982 -4.285 9.094 1.00 0.00 C ATOM 2054 CG PRO B 122 -2.525 -4.628 10.438 1.00 0.00 C ATOM 2055 CD PRO B 122 -4.030 -4.423 10.328 1.00 0.00 C ATOM 0 HA PRO B 122 -2.399 -2.154 8.755 1.00 0.00 H new ATOM 0 HB2 PRO B 122 -2.034 -5.136 8.416 1.00 0.00 H new ATOM 0 HB3 PRO B 122 -0.935 -3.988 9.153 1.00 0.00 H new ATOM 0 HG2 PRO B 122 -2.287 -5.657 10.707 1.00 0.00 H new ATOM 0 HG3 PRO B 122 -2.096 -3.989 11.210 1.00 0.00 H new ATOM 0 HD2 PRO B 122 -4.534 -5.310 9.945 1.00 0.00 H new ATOM 0 HD3 PRO B 122 -4.480 -4.192 11.293 1.00 0.00 H new ATOM 2063 N LEU B 123 -2.458 -2.434 6.331 1.00 0.00 N ATOM 2064 CA LEU B 123 -2.641 -2.450 4.889 1.00 0.00 C ATOM 2065 C LEU B 123 -2.260 -3.806 4.339 1.00 0.00 C ATOM 2066 O LEU B 123 -2.976 -4.390 3.523 1.00 0.00 O ATOM 2067 CB LEU B 123 -1.771 -1.360 4.243 1.00 0.00 C ATOM 2068 CG LEU B 123 -1.897 -1.415 2.712 1.00 0.00 C ATOM 2069 CD1 LEU B 123 -1.588 -0.037 2.127 1.00 0.00 C ATOM 2070 CD2 LEU B 123 -0.898 -2.439 2.149 1.00 0.00 C ATOM 0 H LEU B 123 -1.775 -1.754 6.665 1.00 0.00 H new ATOM 0 HA LEU B 123 -3.688 -2.254 4.658 1.00 0.00 H new ATOM 0 HB2 LEU B 123 -2.077 -0.379 4.605 1.00 0.00 H new ATOM 0 HB3 LEU B 123 -0.729 -1.496 4.534 1.00 0.00 H new ATOM 0 HG LEU B 123 -2.912 -1.710 2.444 1.00 0.00 H new ATOM 0 HD11 LEU B 123 -1.677 -0.074 1.041 1.00 0.00 H new ATOM 0 HD12 LEU B 123 -2.293 0.693 2.524 1.00 0.00 H new ATOM 0 HD13 LEU B 123 -0.573 0.254 2.398 1.00 0.00 H new ATOM 0 HD21 LEU B 123 -0.989 -2.477 1.063 1.00 0.00 H new ATOM 0 HD22 LEU B 123 0.116 -2.144 2.418 1.00 0.00 H new ATOM 0 HD23 LEU B 123 -1.112 -3.423 2.565 1.00 0.00 H new ATOM 2082 N GLU B 124 -1.150 -4.310 4.827 1.00 0.00 N ATOM 2083 CA GLU B 124 -0.631 -5.594 4.420 1.00 0.00 C ATOM 2084 C GLU B 124 -1.575 -6.705 4.845 1.00 0.00 C ATOM 2085 O GLU B 124 -1.746 -7.703 4.136 1.00 0.00 O ATOM 2086 CB GLU B 124 0.743 -5.783 5.043 1.00 0.00 C ATOM 2087 CG GLU B 124 1.697 -4.767 4.415 1.00 0.00 C ATOM 2088 CD GLU B 124 3.022 -4.809 5.114 1.00 0.00 C ATOM 2089 OE1 GLU B 124 3.156 -4.121 6.105 1.00 0.00 O ATOM 2090 OE2 GLU B 124 3.881 -5.534 4.673 1.00 0.00 O ATOM 0 H GLU B 124 -0.577 -3.835 5.524 1.00 0.00 H new ATOM 0 HA GLU B 124 -0.544 -5.632 3.334 1.00 0.00 H new ATOM 0 HB2 GLU B 124 0.694 -5.641 6.123 1.00 0.00 H new ATOM 0 HB3 GLU B 124 1.102 -6.798 4.871 1.00 0.00 H new ATOM 0 HG2 GLU B 124 1.828 -4.986 3.355 1.00 0.00 H new ATOM 0 HG3 GLU B 124 1.272 -3.766 4.484 1.00 0.00 H new ATOM 2097 N ASP B 125 -2.190 -6.529 6.008 1.00 0.00 N ATOM 2098 CA ASP B 125 -3.157 -7.501 6.503 1.00 0.00 C ATOM 2099 C ASP B 125 -4.365 -7.545 5.578 1.00 0.00 C ATOM 2100 O ASP B 125 -4.957 -8.609 5.344 1.00 0.00 O ATOM 2101 CB ASP B 125 -3.614 -7.130 7.919 1.00 0.00 C ATOM 2102 CG ASP B 125 -4.569 -8.179 8.447 1.00 0.00 C ATOM 2103 OD1 ASP B 125 -4.135 -9.286 8.659 1.00 0.00 O ATOM 2104 OD2 ASP B 125 -5.719 -7.863 8.647 1.00 0.00 O ATOM 0 H ASP B 125 -2.038 -5.729 6.622 1.00 0.00 H new ATOM 0 HA ASP B 125 -2.680 -8.481 6.530 1.00 0.00 H new ATOM 0 HB2 ASP B 125 -2.750 -7.048 8.579 1.00 0.00 H new ATOM 0 HB3 ASP B 125 -4.101 -6.155 7.909 1.00 0.00 H new ATOM 2109 N ILE B 126 -4.714 -6.388 5.036 1.00 0.00 N ATOM 2110 CA ILE B 126 -5.838 -6.289 4.121 1.00 0.00 C ATOM 2111 C ILE B 126 -5.392 -6.663 2.714 1.00 0.00 C ATOM 2112 O ILE B 126 -6.029 -7.487 2.050 1.00 0.00 O ATOM 2113 CB ILE B 126 -6.392 -4.857 4.122 1.00 0.00 C ATOM 2114 CG1 ILE B 126 -6.932 -4.506 5.513 1.00 0.00 C ATOM 2115 CG2 ILE B 126 -7.541 -4.752 3.115 1.00 0.00 C ATOM 2116 CD1 ILE B 126 -7.259 -3.017 5.566 1.00 0.00 C ATOM 0 H ILE B 126 -4.235 -5.506 5.215 1.00 0.00 H new ATOM 0 HA ILE B 126 -6.620 -6.975 4.446 1.00 0.00 H new ATOM 0 HB ILE B 126 -5.590 -4.170 3.852 1.00 0.00 H new ATOM 0 HG12 ILE B 126 -7.824 -5.094 5.728 1.00 0.00 H new ATOM 0 HG13 ILE B 126 -6.194 -4.755 6.276 1.00 0.00 H new ATOM 0 HG21 ILE B 126 -7.934 -3.735 3.116 1.00 0.00 H new ATOM 0 HG22 ILE B 126 -7.175 -4.999 2.118 1.00 0.00 H new ATOM 0 HG23 ILE B 126 -8.333 -5.447 3.393 1.00 0.00 H new ATOM 0 HD11 ILE B 126 -7.643 -2.764 6.554 1.00 0.00 H new ATOM 0 HD12 ILE B 126 -6.356 -2.439 5.369 1.00 0.00 H new ATOM 0 HD13 ILE B 126 -8.011 -2.783 4.813 1.00 0.00 H new ATOM 2128 N PHE B 127 -4.290 -6.067 2.274 1.00 0.00 N ATOM 2129 CA PHE B 127 -3.734 -6.350 0.961 1.00 0.00 C ATOM 2130 C PHE B 127 -2.349 -6.940 1.122 1.00 0.00 C ATOM 2131 O PHE B 127 -1.381 -6.212 1.343 1.00 0.00 O ATOM 2132 CB PHE B 127 -3.645 -5.062 0.128 1.00 0.00 C ATOM 2133 CG PHE B 127 -5.003 -4.408 0.053 1.00 0.00 C ATOM 2134 CD1 PHE B 127 -5.950 -4.861 -0.872 1.00 0.00 C ATOM 2135 CD2 PHE B 127 -5.317 -3.354 0.919 1.00 0.00 C ATOM 2136 CE1 PHE B 127 -7.210 -4.257 -0.932 1.00 0.00 C ATOM 2137 CE2 PHE B 127 -6.576 -2.753 0.859 1.00 0.00 C ATOM 2138 CZ PHE B 127 -7.523 -3.202 -0.066 1.00 0.00 C ATOM 0 H PHE B 127 -3.763 -5.380 2.813 1.00 0.00 H new ATOM 0 HA PHE B 127 -4.384 -7.058 0.447 1.00 0.00 H new ATOM 0 HB2 PHE B 127 -2.925 -4.377 0.576 1.00 0.00 H new ATOM 0 HB3 PHE B 127 -3.285 -5.291 -0.875 1.00 0.00 H new ATOM 0 HD1 PHE B 127 -5.708 -5.676 -1.539 1.00 0.00 H new ATOM 0 HD2 PHE B 127 -4.586 -3.006 1.633 1.00 0.00 H new ATOM 0 HE1 PHE B 127 -7.942 -4.604 -1.646 1.00 0.00 H new ATOM 0 HE2 PHE B 127 -6.818 -1.940 1.528 1.00 0.00 H new ATOM 0 HZ PHE B 127 -8.496 -2.735 -0.113 1.00 0.00 H new ATOM 2148 N GLN B 128 -2.243 -8.247 0.988 1.00 0.00 N ATOM 2149 CA GLN B 128 -0.947 -8.912 1.124 1.00 0.00 C ATOM 2150 C GLN B 128 -0.366 -9.269 -0.225 1.00 0.00 C ATOM 2151 O GLN B 128 -1.040 -9.875 -1.064 1.00 0.00 O ATOM 2152 CB GLN B 128 -1.016 -10.156 2.029 1.00 0.00 C ATOM 2153 CG GLN B 128 -2.329 -10.912 1.819 1.00 0.00 C ATOM 2154 CD GLN B 128 -3.153 -10.896 3.096 1.00 0.00 C ATOM 2155 OE1 GLN B 128 -3.838 -11.873 3.395 1.00 0.00 O ATOM 2156 NE2 GLN B 128 -3.145 -9.848 3.863 1.00 0.00 N ATOM 0 H GLN B 128 -3.025 -8.871 0.787 1.00 0.00 H new ATOM 0 HA GLN B 128 -0.283 -8.195 1.607 1.00 0.00 H new ATOM 0 HB2 GLN B 128 -0.174 -10.814 1.814 1.00 0.00 H new ATOM 0 HB3 GLN B 128 -0.927 -9.856 3.073 1.00 0.00 H new ATOM 0 HG2 GLN B 128 -2.894 -10.455 1.007 1.00 0.00 H new ATOM 0 HG3 GLN B 128 -2.122 -11.941 1.524 1.00 0.00 H new ATOM 0 HE21 GLN B 128 -2.577 -9.038 3.614 1.00 0.00 H new ATOM 0 HE22 GLN B 128 -3.707 -9.835 4.714 1.00 0.00 H new ATOM 2165 N TRP B 129 0.880 -8.885 -0.424 1.00 0.00 N ATOM 2166 CA TRP B 129 1.607 -9.139 -1.654 1.00 0.00 C ATOM 2167 C TRP B 129 2.237 -10.513 -1.608 1.00 0.00 C ATOM 2168 O TRP B 129 3.150 -10.757 -0.816 1.00 0.00 O ATOM 2169 CB TRP B 129 2.687 -8.068 -1.806 1.00 0.00 C ATOM 2170 CG TRP B 129 3.501 -8.272 -3.040 1.00 0.00 C ATOM 2171 CD1 TRP B 129 3.106 -7.964 -4.289 1.00 0.00 C ATOM 2172 CD2 TRP B 129 4.854 -8.797 -3.158 1.00 0.00 C ATOM 2173 NE1 TRP B 129 4.130 -8.273 -5.156 1.00 0.00 N ATOM 2174 CE2 TRP B 129 5.216 -8.795 -4.513 1.00 0.00 C ATOM 2175 CE3 TRP B 129 5.785 -9.278 -2.232 1.00 0.00 C ATOM 2176 CZ2 TRP B 129 6.461 -9.249 -4.945 1.00 0.00 C ATOM 2177 CZ3 TRP B 129 7.043 -9.734 -2.661 1.00 0.00 C ATOM 2178 CH2 TRP B 129 7.378 -9.719 -4.015 1.00 0.00 C ATOM 0 H TRP B 129 1.425 -8.380 0.275 1.00 0.00 H new ATOM 0 HA TRP B 129 0.927 -9.103 -2.505 1.00 0.00 H new ATOM 0 HB2 TRP B 129 2.220 -7.083 -1.837 1.00 0.00 H new ATOM 0 HB3 TRP B 129 3.340 -8.084 -0.933 1.00 0.00 H new ATOM 0 HD1 TRP B 129 2.149 -7.546 -4.564 1.00 0.00 H new ATOM 0 HE1 TRP B 129 4.083 -8.128 -6.165 1.00 0.00 H new ATOM 0 HE3 TRP B 129 5.536 -9.299 -1.181 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 6.710 -9.235 -5.996 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 7.756 -10.099 -1.937 1.00 0.00 H new ATOM 0 HH2 TRP B 129 8.346 -10.071 -4.338 1.00 0.00 H new ATOM 2189 N GLN B 130 1.760 -11.407 -2.453 1.00 0.00 N ATOM 2190 CA GLN B 130 2.294 -12.750 -2.509 1.00 0.00 C ATOM 2191 C GLN B 130 3.113 -12.944 -3.778 1.00 0.00 C ATOM 2192 O GLN B 130 2.553 -13.087 -4.871 1.00 0.00 O ATOM 2193 CB GLN B 130 1.161 -13.778 -2.455 1.00 0.00 C ATOM 2194 CG GLN B 130 0.509 -13.757 -1.063 1.00 0.00 C ATOM 2195 CD GLN B 130 0.091 -15.165 -0.645 1.00 0.00 C ATOM 2196 OE1 GLN B 130 -0.004 -16.105 -1.535 1.00 0.00 O flip ATOM 2197 NE2 GLN B 130 -0.163 -15.412 0.534 1.00 0.00 N flip ATOM 0 H GLN B 130 1.002 -11.225 -3.111 1.00 0.00 H new ATOM 0 HA GLN B 130 2.943 -12.897 -1.646 1.00 0.00 H new ATOM 0 HB2 GLN B 130 0.417 -13.554 -3.219 1.00 0.00 H new ATOM 0 HB3 GLN B 130 1.549 -14.773 -2.670 1.00 0.00 H new ATOM 0 HG2 GLN B 130 1.208 -13.348 -0.334 1.00 0.00 H new ATOM 0 HG3 GLN B 130 -0.361 -13.101 -1.073 1.00 0.00 H new ATOM 0 HE21 GLN B 130 -0.090 -14.676 1.237 1.00 0.00 H new ATOM 0 HE22 GLN B 130 -0.447 -16.353 0.808 1.00 0.00 H new