USER MOD reduce.3.24.130724 H: found=0, std=0, add=1196, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1198 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 3 LYS NZ :NH3+ -126:sc= -1.29 (180deg=-3.28!) USER MOD Single : A 8 GLN :FLIP amide:sc= -1.48 F(o=-2!,f=-1.5) USER MOD Single : A 11 LYS NZ :NH3+ -150:sc= -0.0418 (180deg=-0.464) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0424 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0.0226 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -4.78! C(o=-4.8!,f=-18!) USER MOD Single : A 20 LYS NZ :NH3+ 160:sc=-0.00811 (180deg=-0.29) USER MOD Single : A 23 LYS NZ :NH3+ 162:sc= -0.117 (180deg=-0.673) USER MOD Single : A 30 SER OG : rot 37:sc= 0.605 USER MOD Single : A 33 HIS : no HD1:sc= -3.46 K(o=-3.5,f=-10!) USER MOD Single : A 36 ASN : amide:sc= -0.639 X(o=-0.64,f=-0.75) USER MOD Single : A 37 THR OG1 : rot 167:sc= 0.491 USER MOD Single : A 42 LYS NZ :NH3+ -114:sc= -0.295 (180deg=-1.19) USER MOD Single : A 44 SER OG : rot 180:sc= -0.284 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -0.0916 X(o=-0.092,f=-0.035) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 151:sc= -0.0461 (180deg=-0.347) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.535 F(o=-2.6!,f=-0.54) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : B 3 LYS NZ :NH3+ -123:sc= -1.25 (180deg=-3.28!) USER MOD Single : B 8 GLN :FLIP amide:sc= -1.46 F(o=-2.1!,f=-1.5) USER MOD Single : B 11 LYS NZ :NH3+ -151:sc= -0.0558 (180deg=-0.445) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0.0274 USER MOD Single : B 13 TYR OH : rot 180:sc= 0 USER MOD Single : B 14 SER OG : rot 180:sc= 0.0436 USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 HIS : no HD1:sc= -5.14! C(o=-5.1!,f=-18!) USER MOD Single : B 20 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.209) USER MOD Single : B 23 LYS NZ :NH3+ 158:sc= -0.0916 (180deg=-0.694) USER MOD Single : B 30 SER OG : rot 43:sc= 0.648 USER MOD Single : B 33 HIS : no HD1:sc= -3.37 K(o=-3.4,f=-9.7!) USER MOD Single : B 36 ASN : amide:sc= -0.577 X(o=-0.58,f=-0.69) USER MOD Single : B 37 THR OG1 : rot 168:sc= 0.472 USER MOD Single : B 42 LYS NZ :NH3+ -115:sc= -0.279 (180deg=-1.2) USER MOD Single : B 44 SER OG : rot 180:sc= -0.28 USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 ASN : amide:sc= -0.0928 X(o=-0.093,f=-0.04) USER MOD Single : B 59 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 67 LYS NZ :NH3+ 151:sc= -0.0509 (180deg=-0.342) USER MOD Single : B 71 ASN :FLIP amide:sc= -0.523 F(o=-2.5!,f=-0.52) USER MOD Single : B 72 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 24.036 -7.097 -5.507 1.00 0.00 N ATOM 2 CA ALA A 2 23.372 -6.618 -4.260 1.00 0.00 C ATOM 3 C ALA A 2 24.425 -6.050 -3.304 1.00 0.00 C ATOM 4 O ALA A 2 25.356 -6.731 -2.927 1.00 0.00 O ATOM 5 CB ALA A 2 22.628 -7.763 -3.566 1.00 0.00 C ATOM 0 HA ALA A 2 22.654 -5.843 -4.528 1.00 0.00 H new ATOM 0 HB1 ALA A 2 22.152 -7.391 -2.659 1.00 0.00 H new ATOM 0 HB2 ALA A 2 21.868 -8.163 -4.237 1.00 0.00 H new ATOM 0 HB3 ALA A 2 23.334 -8.552 -3.307 1.00 0.00 H new ATOM 13 N LYS A 3 24.252 -4.809 -2.931 1.00 0.00 N ATOM 14 CA LYS A 3 25.237 -4.180 -2.001 1.00 0.00 C ATOM 15 C LYS A 3 24.569 -3.048 -1.214 1.00 0.00 C ATOM 16 O LYS A 3 24.693 -2.972 -0.007 1.00 0.00 O ATOM 17 CB LYS A 3 26.402 -3.614 -2.813 1.00 0.00 C ATOM 18 CG LYS A 3 25.946 -3.393 -4.257 1.00 0.00 C ATOM 19 CD LYS A 3 27.012 -2.591 -5.008 1.00 0.00 C ATOM 20 CE LYS A 3 28.334 -3.359 -4.987 1.00 0.00 C ATOM 21 NZ LYS A 3 29.116 -3.017 -3.765 1.00 0.00 N ATOM 0 H LYS A 3 23.481 -4.209 -3.226 1.00 0.00 H new ATOM 0 HA LYS A 3 25.601 -4.932 -1.301 1.00 0.00 H new ATOM 0 HB2 LYS A 3 26.742 -2.674 -2.378 1.00 0.00 H new ATOM 0 HB3 LYS A 3 27.248 -4.301 -2.787 1.00 0.00 H new ATOM 0 HG2 LYS A 3 25.782 -4.352 -4.749 1.00 0.00 H new ATOM 0 HG3 LYS A 3 24.995 -2.860 -4.273 1.00 0.00 H new ATOM 0 HD2 LYS A 3 26.695 -2.418 -6.037 1.00 0.00 H new ATOM 0 HD3 LYS A 3 27.140 -1.612 -4.545 1.00 0.00 H new ATOM 0 HE2 LYS A 3 28.139 -4.431 -5.013 1.00 0.00 H new ATOM 0 HE3 LYS A 3 28.915 -3.119 -5.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 30.068 -2.702 -4.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 28.635 -2.255 -3.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 29.192 -3.856 -3.155 1.00 0.00 H new ATOM 35 N GLU A 4 23.873 -2.193 -1.924 1.00 0.00 N ATOM 36 CA GLU A 4 23.183 -1.046 -1.251 1.00 0.00 C ATOM 37 C GLU A 4 21.683 -1.074 -1.565 1.00 0.00 C ATOM 38 O GLU A 4 21.209 -0.347 -2.414 1.00 0.00 O ATOM 39 CB GLU A 4 23.785 0.264 -1.759 1.00 0.00 C ATOM 40 CG GLU A 4 25.275 0.302 -1.409 1.00 0.00 C ATOM 41 CD GLU A 4 25.769 1.750 -1.445 1.00 0.00 C ATOM 42 OE1 GLU A 4 26.014 2.211 -2.547 1.00 0.00 O ATOM 43 OE2 GLU A 4 25.874 2.312 -0.366 1.00 0.00 O ATOM 0 H GLU A 4 23.753 -2.239 -2.936 1.00 0.00 H new ATOM 0 HA GLU A 4 23.319 -1.126 -0.172 1.00 0.00 H new ATOM 0 HB2 GLU A 4 23.650 0.346 -2.838 1.00 0.00 H new ATOM 0 HB3 GLU A 4 23.271 1.113 -1.308 1.00 0.00 H new ATOM 0 HG2 GLU A 4 25.438 -0.125 -0.420 1.00 0.00 H new ATOM 0 HG3 GLU A 4 25.841 -0.305 -2.116 1.00 0.00 H new ATOM 50 N LEU A 5 20.968 -1.915 -0.868 1.00 0.00 N ATOM 51 CA LEU A 5 19.496 -2.006 -1.108 1.00 0.00 C ATOM 52 C LEU A 5 18.751 -1.065 -0.153 1.00 0.00 C ATOM 53 O LEU A 5 18.765 -1.256 1.046 1.00 0.00 O ATOM 54 CB LEU A 5 19.040 -3.452 -0.863 1.00 0.00 C ATOM 55 CG LEU A 5 19.218 -4.297 -2.144 1.00 0.00 C ATOM 56 CD1 LEU A 5 18.252 -3.809 -3.238 1.00 0.00 C ATOM 57 CD2 LEU A 5 20.667 -4.185 -2.644 1.00 0.00 C ATOM 0 H LEU A 5 21.334 -2.539 -0.148 1.00 0.00 H new ATOM 0 HA LEU A 5 19.275 -1.715 -2.135 1.00 0.00 H new ATOM 0 HB2 LEU A 5 19.617 -3.889 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU A 5 17.995 -3.463 -0.555 1.00 0.00 H new ATOM 0 HG LEU A 5 18.996 -5.339 -1.914 1.00 0.00 H new ATOM 0 HD11 LEU A 5 18.386 -4.411 -4.137 1.00 0.00 H new ATOM 0 HD12 LEU A 5 17.225 -3.906 -2.886 1.00 0.00 H new ATOM 0 HD13 LEU A 5 18.460 -2.764 -3.467 1.00 0.00 H new ATOM 0 HD21 LEU A 5 20.787 -4.783 -3.548 1.00 0.00 H new ATOM 0 HD22 LEU A 5 20.896 -3.143 -2.865 1.00 0.00 H new ATOM 0 HD23 LEU A 5 21.347 -4.550 -1.874 1.00 0.00 H new ATOM 69 N ARG A 6 18.116 -0.066 -0.711 1.00 0.00 N ATOM 70 CA ARG A 6 17.365 0.901 0.151 1.00 0.00 C ATOM 71 C ARG A 6 15.948 0.385 0.414 1.00 0.00 C ATOM 72 O ARG A 6 15.590 -0.696 -0.009 1.00 0.00 O ATOM 73 CB ARG A 6 17.286 2.256 -0.560 1.00 0.00 C ATOM 74 CG ARG A 6 18.678 2.642 -1.071 1.00 0.00 C ATOM 75 CD ARG A 6 18.605 4.019 -1.741 1.00 0.00 C ATOM 76 NE ARG A 6 19.267 3.946 -3.077 1.00 0.00 N ATOM 77 CZ ARG A 6 19.434 5.041 -3.776 1.00 0.00 C ATOM 78 NH1 ARG A 6 18.378 5.702 -4.179 1.00 0.00 N ATOM 79 NH2 ARG A 6 20.652 5.435 -4.051 1.00 0.00 N ATOM 0 H ARG A 6 18.084 0.122 -1.713 1.00 0.00 H new ATOM 0 HA ARG A 6 17.886 1.009 1.102 1.00 0.00 H new ATOM 0 HB2 ARG A 6 16.583 2.203 -1.391 1.00 0.00 H new ATOM 0 HB3 ARG A 6 16.913 3.018 0.125 1.00 0.00 H new ATOM 0 HG2 ARG A 6 19.389 2.663 -0.245 1.00 0.00 H new ATOM 0 HG3 ARG A 6 19.037 1.897 -1.781 1.00 0.00 H new ATOM 0 HD2 ARG A 6 17.566 4.329 -1.852 1.00 0.00 H new ATOM 0 HD3 ARG A 6 19.096 4.767 -1.118 1.00 0.00 H new ATOM 0 HE ARG A 6 19.587 3.049 -3.443 1.00 0.00 H new ATOM 0 HH11 ARG A 6 17.445 5.362 -3.948 1.00 0.00 H new ATOM 0 HH12 ARG A 6 18.489 6.557 -4.724 1.00 0.00 H new ATOM 0 HH21 ARG A 6 21.450 4.892 -3.722 1.00 0.00 H new ATOM 0 HH22 ARG A 6 20.803 6.285 -4.594 1.00 0.00 H new ATOM 93 N CYS A 7 15.172 1.169 1.111 1.00 0.00 N ATOM 94 CA CYS A 7 13.773 0.744 1.407 1.00 0.00 C ATOM 95 C CYS A 7 13.004 0.523 0.096 1.00 0.00 C ATOM 96 O CYS A 7 13.269 1.178 -0.891 1.00 0.00 O ATOM 97 CB CYS A 7 13.088 1.840 2.220 1.00 0.00 C ATOM 98 SG CYS A 7 13.532 1.977 3.970 1.00 0.00 S ATOM 0 H CYS A 7 15.442 2.078 1.486 1.00 0.00 H new ATOM 0 HA CYS A 7 13.786 -0.189 1.971 1.00 0.00 H new ATOM 0 HB2 CYS A 7 13.300 2.797 1.742 1.00 0.00 H new ATOM 0 HB3 CYS A 7 12.011 1.684 2.157 1.00 0.00 H new ATOM 103 N GLN A 8 12.068 -0.396 0.107 1.00 0.00 N ATOM 104 CA GLN A 8 11.288 -0.642 -1.148 1.00 0.00 C ATOM 105 C GLN A 8 10.479 0.604 -1.523 1.00 0.00 C ATOM 106 O GLN A 8 10.227 0.850 -2.687 1.00 0.00 O ATOM 107 CB GLN A 8 10.328 -1.816 -0.937 1.00 0.00 C ATOM 108 CG GLN A 8 11.080 -3.142 -1.107 1.00 0.00 C ATOM 109 CD GLN A 8 10.080 -4.298 -1.046 1.00 0.00 C ATOM 110 OE1 GLN A 8 10.189 -5.180 -0.090 1.00 0.00 O flip ATOM 111 NE2 GLN A 8 9.192 -4.408 -1.869 1.00 0.00 N flip ATOM 0 H GLN A 8 11.814 -0.973 0.909 1.00 0.00 H new ATOM 0 HA GLN A 8 11.986 -0.874 -1.952 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.888 -1.763 0.059 1.00 0.00 H new ATOM 0 HB3 GLN A 8 9.507 -1.759 -1.652 1.00 0.00 H new ATOM 0 HG2 GLN A 8 11.610 -3.154 -2.059 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.830 -3.252 -0.323 1.00 0.00 H new ATOM 0 HE21 GLN A 8 9.103 -3.721 -2.618 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.536 -5.187 -1.811 1.00 0.00 H new ATOM 120 N CYS A 9 10.093 1.362 -0.530 1.00 0.00 N ATOM 121 CA CYS A 9 9.294 2.597 -0.806 1.00 0.00 C ATOM 122 C CYS A 9 10.148 3.848 -0.580 1.00 0.00 C ATOM 123 O CYS A 9 10.580 4.116 0.524 1.00 0.00 O ATOM 124 CB CYS A 9 8.092 2.630 0.132 1.00 0.00 C ATOM 125 SG CYS A 9 6.699 1.548 -0.265 1.00 0.00 S ATOM 0 H CYS A 9 10.294 1.183 0.454 1.00 0.00 H new ATOM 0 HA CYS A 9 8.962 2.582 -1.844 1.00 0.00 H new ATOM 0 HB2 CYS A 9 8.439 2.378 1.134 1.00 0.00 H new ATOM 0 HB3 CYS A 9 7.723 3.655 0.171 1.00 0.00 H new ATOM 130 N ILE A 10 10.373 4.588 -1.632 1.00 0.00 N ATOM 131 CA ILE A 10 11.191 5.828 -1.492 1.00 0.00 C ATOM 132 C ILE A 10 10.267 7.034 -1.283 1.00 0.00 C ATOM 133 O ILE A 10 10.592 7.951 -0.554 1.00 0.00 O ATOM 134 CB ILE A 10 12.024 6.036 -2.762 1.00 0.00 C ATOM 135 CG1 ILE A 10 13.133 4.974 -2.827 1.00 0.00 C ATOM 136 CG2 ILE A 10 12.657 7.432 -2.717 1.00 0.00 C ATOM 137 CD1 ILE A 10 12.506 3.580 -2.922 1.00 0.00 C ATOM 0 H ILE A 10 10.030 4.391 -2.572 1.00 0.00 H new ATOM 0 HA ILE A 10 11.855 5.729 -0.633 1.00 0.00 H new ATOM 0 HB ILE A 10 11.387 5.946 -3.642 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.773 5.155 -3.690 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.765 5.040 -1.942 1.00 0.00 H new ATOM 0 HG21 ILE A 10 13.252 7.591 -3.616 1.00 0.00 H new ATOM 0 HG22 ILE A 10 11.872 8.186 -2.664 1.00 0.00 H new ATOM 0 HG23 ILE A 10 13.298 7.513 -1.839 1.00 0.00 H new ATOM 0 HD11 ILE A 10 13.294 2.829 -2.968 1.00 0.00 H new ATOM 0 HD12 ILE A 10 11.884 3.400 -2.045 1.00 0.00 H new ATOM 0 HD13 ILE A 10 11.892 3.517 -3.821 1.00 0.00 H new ATOM 149 N LYS A 11 9.132 7.000 -1.935 1.00 0.00 N ATOM 150 CA LYS A 11 8.158 8.127 -1.796 1.00 0.00 C ATOM 151 C LYS A 11 6.739 7.567 -1.634 1.00 0.00 C ATOM 152 O LYS A 11 6.453 6.472 -2.074 1.00 0.00 O ATOM 153 CB LYS A 11 8.217 9.000 -3.048 1.00 0.00 C ATOM 154 CG LYS A 11 8.828 10.357 -2.689 1.00 0.00 C ATOM 155 CD LYS A 11 8.904 11.220 -3.951 1.00 0.00 C ATOM 156 CE LYS A 11 10.373 11.461 -4.304 1.00 0.00 C ATOM 157 NZ LYS A 11 11.041 12.261 -3.240 1.00 0.00 N ATOM 0 H LYS A 11 8.838 6.245 -2.555 1.00 0.00 H new ATOM 0 HA LYS A 11 8.414 8.721 -0.919 1.00 0.00 H new ATOM 0 HB2 LYS A 11 8.814 8.512 -3.818 1.00 0.00 H new ATOM 0 HB3 LYS A 11 7.216 9.136 -3.458 1.00 0.00 H new ATOM 0 HG2 LYS A 11 8.223 10.853 -1.930 1.00 0.00 H new ATOM 0 HG3 LYS A 11 9.823 10.221 -2.265 1.00 0.00 H new ATOM 0 HD2 LYS A 11 8.395 10.724 -4.777 1.00 0.00 H new ATOM 0 HD3 LYS A 11 8.395 12.170 -3.788 1.00 0.00 H new ATOM 0 HE2 LYS A 11 10.885 10.507 -4.425 1.00 0.00 H new ATOM 0 HE3 LYS A 11 10.443 11.984 -5.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 11.801 12.833 -3.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 10.345 12.888 -2.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 11.444 11.621 -2.526 1.00 0.00 H new ATOM 171 N THR A 12 5.883 8.334 -1.007 1.00 0.00 N ATOM 172 CA THR A 12 4.479 7.856 -0.802 1.00 0.00 C ATOM 173 C THR A 12 3.527 8.534 -1.792 1.00 0.00 C ATOM 174 O THR A 12 3.920 9.401 -2.547 1.00 0.00 O ATOM 175 CB THR A 12 4.041 8.186 0.624 1.00 0.00 C ATOM 176 OG1 THR A 12 4.437 9.541 0.822 1.00 0.00 O ATOM 177 CG2 THR A 12 4.831 7.378 1.652 1.00 0.00 C ATOM 0 H THR A 12 6.090 9.260 -0.632 1.00 0.00 H new ATOM 0 HA THR A 12 4.447 6.779 -0.967 1.00 0.00 H new ATOM 0 HB THR A 12 2.977 7.984 0.744 1.00 0.00 H new ATOM 0 HG1 THR A 12 4.185 9.827 1.725 1.00 0.00 H new ATOM 0 HG21 THR A 12 4.494 7.637 2.656 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.671 6.314 1.479 1.00 0.00 H new ATOM 0 HG23 THR A 12 5.893 7.605 1.556 1.00 0.00 H new ATOM 185 N TYR A 13 2.289 8.119 -1.761 1.00 0.00 N ATOM 186 CA TYR A 13 1.282 8.717 -2.688 1.00 0.00 C ATOM 187 C TYR A 13 0.452 9.779 -1.952 1.00 0.00 C ATOM 188 O TYR A 13 -0.313 9.463 -1.062 1.00 0.00 O ATOM 189 CB TYR A 13 0.361 7.605 -3.193 1.00 0.00 C ATOM 190 CG TYR A 13 -0.185 7.976 -4.573 1.00 0.00 C ATOM 191 CD1 TYR A 13 0.665 8.109 -5.651 1.00 0.00 C ATOM 192 CD2 TYR A 13 -1.540 8.182 -4.760 1.00 0.00 C ATOM 193 CE1 TYR A 13 0.172 8.444 -6.896 1.00 0.00 C ATOM 194 CE2 TYR A 13 -2.032 8.514 -6.005 1.00 0.00 C ATOM 195 CZ TYR A 13 -1.181 8.649 -7.082 1.00 0.00 C ATOM 196 OH TYR A 13 -1.674 8.988 -8.325 1.00 0.00 O ATOM 0 H TYR A 13 1.932 7.395 -1.137 1.00 0.00 H new ATOM 0 HA TYR A 13 1.792 9.192 -3.526 1.00 0.00 H new ATOM 0 HB2 TYR A 13 0.908 6.664 -3.248 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.462 7.455 -2.494 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.725 7.950 -5.520 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -2.218 8.082 -3.925 1.00 0.00 H new ATOM 0 HE1 TYR A 13 0.849 8.547 -7.731 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -3.092 8.670 -6.138 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.647 9.093 -8.274 1.00 0.00 H new ATOM 206 N SER A 14 0.625 11.017 -2.337 1.00 0.00 N ATOM 207 CA SER A 14 -0.145 12.110 -1.667 1.00 0.00 C ATOM 208 C SER A 14 -1.430 12.413 -2.449 1.00 0.00 C ATOM 209 O SER A 14 -1.724 13.553 -2.747 1.00 0.00 O ATOM 210 CB SER A 14 0.721 13.367 -1.602 1.00 0.00 C ATOM 211 OG SER A 14 1.194 13.536 -2.930 1.00 0.00 O ATOM 0 H SER A 14 1.258 11.317 -3.078 1.00 0.00 H new ATOM 0 HA SER A 14 -0.414 11.792 -0.660 1.00 0.00 H new ATOM 0 HB2 SER A 14 0.144 14.231 -1.272 1.00 0.00 H new ATOM 0 HB3 SER A 14 1.545 13.247 -0.899 1.00 0.00 H new ATOM 0 HG SER A 14 1.764 14.332 -2.976 1.00 0.00 H new ATOM 217 N LYS A 15 -2.164 11.383 -2.760 1.00 0.00 N ATOM 218 CA LYS A 15 -3.430 11.583 -3.522 1.00 0.00 C ATOM 219 C LYS A 15 -4.478 10.518 -3.087 1.00 0.00 C ATOM 220 O LYS A 15 -4.446 9.403 -3.569 1.00 0.00 O ATOM 221 CB LYS A 15 -3.131 11.405 -5.010 1.00 0.00 C ATOM 222 CG LYS A 15 -3.159 12.772 -5.698 1.00 0.00 C ATOM 223 CD LYS A 15 -4.599 13.289 -5.744 1.00 0.00 C ATOM 224 CE LYS A 15 -5.063 13.356 -7.201 1.00 0.00 C ATOM 225 NZ LYS A 15 -6.498 13.746 -7.268 1.00 0.00 N ATOM 0 H LYS A 15 -1.945 10.416 -2.522 1.00 0.00 H new ATOM 0 HA LYS A 15 -3.826 12.580 -3.327 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.155 10.938 -5.143 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.867 10.741 -5.464 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -2.525 13.476 -5.158 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -2.758 12.691 -6.708 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -5.253 12.631 -5.171 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.659 14.276 -5.285 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -4.457 14.077 -7.750 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.919 12.388 -7.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.800 13.788 -8.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -7.073 13.043 -6.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -6.625 14.680 -6.828 1.00 0.00 H new ATOM 239 N PRO A 16 -5.395 10.874 -2.182 1.00 0.00 N ATOM 240 CA PRO A 16 -6.404 9.914 -1.705 1.00 0.00 C ATOM 241 C PRO A 16 -7.238 9.353 -2.863 1.00 0.00 C ATOM 242 O PRO A 16 -7.576 10.063 -3.791 1.00 0.00 O ATOM 243 CB PRO A 16 -7.284 10.701 -0.728 1.00 0.00 C ATOM 244 CG PRO A 16 -6.626 12.099 -0.538 1.00 0.00 C ATOM 245 CD PRO A 16 -5.501 12.220 -1.583 1.00 0.00 C ATOM 0 HA PRO A 16 -5.937 9.052 -1.229 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -8.297 10.802 -1.119 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.361 10.179 0.226 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -7.362 12.892 -0.672 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.226 12.202 0.471 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.740 12.970 -2.336 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.562 12.522 -1.120 1.00 0.00 H new ATOM 253 N PHE A 17 -7.547 8.081 -2.779 1.00 0.00 N ATOM 254 CA PHE A 17 -8.358 7.444 -3.860 1.00 0.00 C ATOM 255 C PHE A 17 -9.405 6.496 -3.254 1.00 0.00 C ATOM 256 O PHE A 17 -9.680 6.546 -2.071 1.00 0.00 O ATOM 257 CB PHE A 17 -7.428 6.663 -4.792 1.00 0.00 C ATOM 258 CG PHE A 17 -6.541 5.729 -3.969 1.00 0.00 C ATOM 259 CD1 PHE A 17 -6.989 4.471 -3.613 1.00 0.00 C ATOM 260 CD2 PHE A 17 -5.279 6.130 -3.570 1.00 0.00 C ATOM 261 CE1 PHE A 17 -6.189 3.628 -2.872 1.00 0.00 C ATOM 262 CE2 PHE A 17 -4.480 5.286 -2.828 1.00 0.00 C ATOM 263 CZ PHE A 17 -4.935 4.035 -2.479 1.00 0.00 C ATOM 0 H PHE A 17 -7.275 7.462 -2.015 1.00 0.00 H new ATOM 0 HA PHE A 17 -8.877 8.219 -4.423 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -8.014 6.087 -5.508 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -6.811 7.353 -5.368 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -7.973 4.146 -3.918 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -4.917 7.111 -3.841 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -6.547 2.646 -2.599 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -3.496 5.607 -2.520 1.00 0.00 H new ATOM 0 HZ PHE A 17 -4.309 3.374 -1.898 1.00 0.00 H new ATOM 273 N HIS A 18 -9.959 5.654 -4.087 1.00 0.00 N ATOM 274 CA HIS A 18 -11.012 4.698 -3.608 1.00 0.00 C ATOM 275 C HIS A 18 -10.493 3.231 -3.700 1.00 0.00 C ATOM 276 O HIS A 18 -9.820 2.887 -4.651 1.00 0.00 O ATOM 277 CB HIS A 18 -12.220 4.856 -4.539 1.00 0.00 C ATOM 278 CG HIS A 18 -13.428 4.139 -3.953 1.00 0.00 C ATOM 279 ND1 HIS A 18 -13.630 2.833 -4.011 1.00 0.00 N ATOM 280 CD2 HIS A 18 -14.506 4.667 -3.255 1.00 0.00 C ATOM 281 CE1 HIS A 18 -14.741 2.566 -3.401 1.00 0.00 C ATOM 282 NE2 HIS A 18 -15.253 3.651 -2.957 1.00 0.00 N ATOM 0 H HIS A 18 -9.731 5.584 -5.079 1.00 0.00 H new ATOM 0 HA HIS A 18 -11.272 4.910 -2.571 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -12.447 5.913 -4.678 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -11.987 4.448 -5.523 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -14.684 5.704 -3.012 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -15.168 1.581 -3.285 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -16.130 3.709 -2.439 1.00 0.00 H new ATOM 290 N PRO A 19 -10.818 2.380 -2.712 1.00 0.00 N ATOM 291 CA PRO A 19 -10.380 0.977 -2.755 1.00 0.00 C ATOM 292 C PRO A 19 -10.907 0.307 -4.028 1.00 0.00 C ATOM 293 O PRO A 19 -10.514 -0.789 -4.375 1.00 0.00 O ATOM 294 CB PRO A 19 -10.995 0.318 -1.516 1.00 0.00 C ATOM 295 CG PRO A 19 -11.816 1.409 -0.769 1.00 0.00 C ATOM 296 CD PRO A 19 -11.617 2.734 -1.518 1.00 0.00 C ATOM 0 HA PRO A 19 -9.294 0.887 -2.762 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -11.636 -0.516 -1.803 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -10.216 -0.086 -0.870 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -12.872 1.141 -0.740 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -11.481 1.499 0.264 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -12.573 3.176 -1.799 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -11.098 3.464 -0.898 1.00 0.00 H new ATOM 304 N LYS A 20 -11.789 0.999 -4.688 1.00 0.00 N ATOM 305 CA LYS A 20 -12.386 0.457 -5.941 1.00 0.00 C ATOM 306 C LYS A 20 -11.319 0.332 -7.035 1.00 0.00 C ATOM 307 O LYS A 20 -11.545 -0.288 -8.055 1.00 0.00 O ATOM 308 CB LYS A 20 -13.486 1.415 -6.382 1.00 0.00 C ATOM 309 CG LYS A 20 -13.913 1.123 -7.819 1.00 0.00 C ATOM 310 CD LYS A 20 -15.190 1.916 -8.113 1.00 0.00 C ATOM 311 CE LYS A 20 -15.057 2.593 -9.478 1.00 0.00 C ATOM 312 NZ LYS A 20 -14.835 1.577 -10.546 1.00 0.00 N ATOM 0 H LYS A 20 -12.125 1.922 -4.414 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.795 -0.538 -5.764 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.344 1.322 -5.716 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -13.132 2.443 -6.304 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.123 1.405 -8.515 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -14.090 0.056 -7.953 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -16.055 1.252 -8.105 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -15.355 2.664 -7.337 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -15.958 3.166 -9.695 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.226 3.299 -9.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.080 1.986 -11.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -13.836 1.289 -10.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.434 0.746 -10.365 1.00 0.00 H new ATOM 326 N PHE A 21 -10.177 0.923 -6.794 1.00 0.00 N ATOM 327 CA PHE A 21 -9.077 0.856 -7.808 1.00 0.00 C ATOM 328 C PHE A 21 -7.999 -0.137 -7.358 1.00 0.00 C ATOM 329 O PHE A 21 -7.085 -0.445 -8.099 1.00 0.00 O ATOM 330 CB PHE A 21 -8.458 2.245 -7.955 1.00 0.00 C ATOM 331 CG PHE A 21 -9.453 3.168 -8.659 1.00 0.00 C ATOM 332 CD1 PHE A 21 -9.692 3.038 -10.017 1.00 0.00 C ATOM 333 CD2 PHE A 21 -10.129 4.145 -7.949 1.00 0.00 C ATOM 334 CE1 PHE A 21 -10.591 3.872 -10.652 1.00 0.00 C ATOM 335 CE2 PHE A 21 -11.028 4.976 -8.587 1.00 0.00 C ATOM 336 CZ PHE A 21 -11.258 4.839 -9.936 1.00 0.00 C ATOM 0 H PHE A 21 -9.957 1.446 -5.946 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.485 0.522 -8.762 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -8.201 2.647 -6.975 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -7.532 2.185 -8.527 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -9.172 2.279 -10.583 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -9.952 4.258 -6.890 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -10.771 3.765 -11.712 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -11.552 5.735 -8.026 1.00 0.00 H new ATOM 0 HZ PHE A 21 -11.962 5.490 -10.433 1.00 0.00 H new ATOM 346 N ILE A 22 -8.133 -0.619 -6.154 1.00 0.00 N ATOM 347 CA ILE A 22 -7.124 -1.583 -5.631 1.00 0.00 C ATOM 348 C ILE A 22 -7.594 -3.020 -5.849 1.00 0.00 C ATOM 349 O ILE A 22 -8.743 -3.341 -5.617 1.00 0.00 O ATOM 350 CB ILE A 22 -6.936 -1.337 -4.127 1.00 0.00 C ATOM 351 CG1 ILE A 22 -6.663 0.159 -3.882 1.00 0.00 C ATOM 352 CG2 ILE A 22 -5.766 -2.189 -3.593 1.00 0.00 C ATOM 353 CD1 ILE A 22 -5.470 0.628 -4.717 1.00 0.00 C ATOM 0 H ILE A 22 -8.892 -0.389 -5.513 1.00 0.00 H new ATOM 0 HA ILE A 22 -6.183 -1.437 -6.161 1.00 0.00 H new ATOM 0 HB ILE A 22 -7.844 -1.626 -3.598 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -7.547 0.743 -4.139 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -6.464 0.330 -2.824 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -5.641 -2.007 -2.526 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -5.980 -3.245 -3.759 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -4.850 -1.918 -4.117 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.290 1.687 -4.532 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -4.584 0.056 -4.440 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -5.684 0.475 -5.775 1.00 0.00 H new ATOM 365 N LYS A 23 -6.685 -3.850 -6.295 1.00 0.00 N ATOM 366 CA LYS A 23 -7.028 -5.276 -6.525 1.00 0.00 C ATOM 367 C LYS A 23 -6.050 -6.176 -5.778 1.00 0.00 C ATOM 368 O LYS A 23 -6.342 -7.326 -5.515 1.00 0.00 O ATOM 369 CB LYS A 23 -6.970 -5.584 -8.019 1.00 0.00 C ATOM 370 CG LYS A 23 -8.270 -5.122 -8.676 1.00 0.00 C ATOM 371 CD LYS A 23 -9.281 -6.271 -8.650 1.00 0.00 C ATOM 372 CE LYS A 23 -10.637 -5.758 -9.138 1.00 0.00 C ATOM 373 NZ LYS A 23 -10.474 -4.960 -10.385 1.00 0.00 N ATOM 0 H LYS A 23 -5.720 -3.596 -6.508 1.00 0.00 H new ATOM 0 HA LYS A 23 -8.036 -5.463 -6.155 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.118 -5.078 -8.474 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -6.828 -6.653 -8.177 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.671 -4.257 -8.148 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.082 -4.810 -9.703 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -8.938 -7.088 -9.285 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -9.371 -6.669 -7.639 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -11.306 -6.599 -9.322 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -11.100 -5.145 -8.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -11.392 -4.878 -10.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.122 -4.011 -10.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -9.794 -5.433 -11.014 1.00 0.00 H new ATOM 387 N GLU A 24 -4.904 -5.639 -5.452 1.00 0.00 N ATOM 388 CA GLU A 24 -3.906 -6.469 -4.708 1.00 0.00 C ATOM 389 C GLU A 24 -3.127 -5.596 -3.718 1.00 0.00 C ATOM 390 O GLU A 24 -2.494 -4.631 -4.098 1.00 0.00 O ATOM 391 CB GLU A 24 -2.949 -7.122 -5.710 1.00 0.00 C ATOM 392 CG GLU A 24 -1.604 -7.401 -5.030 1.00 0.00 C ATOM 393 CD GLU A 24 -0.833 -8.442 -5.845 1.00 0.00 C ATOM 394 OE1 GLU A 24 -1.121 -8.527 -7.026 1.00 0.00 O ATOM 395 OE2 GLU A 24 0.000 -9.095 -5.238 1.00 0.00 O ATOM 0 H GLU A 24 -4.618 -4.683 -5.662 1.00 0.00 H new ATOM 0 HA GLU A 24 -4.424 -7.246 -4.146 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.378 -8.051 -6.085 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -2.804 -6.468 -6.570 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -1.025 -6.481 -4.952 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -1.765 -7.763 -4.015 1.00 0.00 H new ATOM 402 N LEU A 25 -3.195 -5.963 -2.462 1.00 0.00 N ATOM 403 CA LEU A 25 -2.476 -5.178 -1.418 1.00 0.00 C ATOM 404 C LEU A 25 -1.193 -5.906 -1.006 1.00 0.00 C ATOM 405 O LEU A 25 -1.099 -7.113 -1.116 1.00 0.00 O ATOM 406 CB LEU A 25 -3.391 -5.022 -0.201 1.00 0.00 C ATOM 407 CG LEU A 25 -2.925 -3.830 0.637 1.00 0.00 C ATOM 408 CD1 LEU A 25 -3.617 -2.560 0.136 1.00 0.00 C ATOM 409 CD2 LEU A 25 -3.306 -4.065 2.101 1.00 0.00 C ATOM 0 H LEU A 25 -3.716 -6.770 -2.118 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.212 -4.198 -1.814 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.421 -4.873 -0.524 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.374 -5.931 0.400 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.844 -3.719 0.550 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.288 -1.708 0.730 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -3.360 -2.394 -0.910 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.697 -2.673 0.230 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.976 -3.218 2.703 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.388 -4.169 2.183 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.825 -4.975 2.460 1.00 0.00 H new ATOM 421 N ARG A 26 -0.230 -5.159 -0.541 1.00 0.00 N ATOM 422 CA ARG A 26 1.052 -5.796 -0.124 1.00 0.00 C ATOM 423 C ARG A 26 1.679 -5.024 1.040 1.00 0.00 C ATOM 424 O ARG A 26 2.017 -3.864 0.906 1.00 0.00 O ATOM 425 CB ARG A 26 2.013 -5.798 -1.301 1.00 0.00 C ATOM 426 CG ARG A 26 1.455 -6.680 -2.420 1.00 0.00 C ATOM 427 CD ARG A 26 2.573 -6.980 -3.422 1.00 0.00 C ATOM 428 NE ARG A 26 3.354 -5.736 -3.670 1.00 0.00 N ATOM 429 CZ ARG A 26 4.547 -5.823 -4.196 1.00 0.00 C ATOM 430 NH1 ARG A 26 5.564 -6.073 -3.414 1.00 0.00 N ATOM 431 NH2 ARG A 26 4.682 -5.663 -5.486 1.00 0.00 N ATOM 0 H ARG A 26 -0.273 -4.146 -0.432 1.00 0.00 H new ATOM 0 HA ARG A 26 0.852 -6.818 0.199 1.00 0.00 H new ATOM 0 HB2 ARG A 26 2.160 -4.781 -1.665 1.00 0.00 H new ATOM 0 HB3 ARG A 26 2.989 -6.168 -0.986 1.00 0.00 H new ATOM 0 HG2 ARG A 26 1.061 -7.608 -2.007 1.00 0.00 H new ATOM 0 HG3 ARG A 26 0.627 -6.176 -2.919 1.00 0.00 H new ATOM 0 HD2 ARG A 26 3.225 -7.762 -3.034 1.00 0.00 H new ATOM 0 HD3 ARG A 26 2.151 -7.351 -4.356 1.00 0.00 H new ATOM 0 HE ARG A 26 2.961 -4.825 -3.432 1.00 0.00 H new ATOM 0 HH11 ARG A 26 5.419 -6.196 -2.412 1.00 0.00 H new ATOM 0 HH12 ARG A 26 6.503 -6.145 -3.806 1.00 0.00 H new ATOM 0 HH21 ARG A 26 3.864 -5.474 -6.065 1.00 0.00 H new ATOM 0 HH22 ARG A 26 5.606 -5.727 -5.914 1.00 0.00 H new ATOM 445 N VAL A 27 1.820 -5.692 2.158 1.00 0.00 N ATOM 446 CA VAL A 27 2.425 -5.026 3.352 1.00 0.00 C ATOM 447 C VAL A 27 3.797 -5.638 3.651 1.00 0.00 C ATOM 448 O VAL A 27 3.931 -6.842 3.743 1.00 0.00 O ATOM 449 CB VAL A 27 1.502 -5.229 4.553 1.00 0.00 C ATOM 450 CG1 VAL A 27 2.015 -4.395 5.731 1.00 0.00 C ATOM 451 CG2 VAL A 27 0.091 -4.765 4.184 1.00 0.00 C ATOM 0 H VAL A 27 1.544 -6.664 2.295 1.00 0.00 H new ATOM 0 HA VAL A 27 2.548 -3.961 3.153 1.00 0.00 H new ATOM 0 HB VAL A 27 1.484 -6.283 4.830 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.359 -4.537 6.590 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.025 -4.713 5.989 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.026 -3.341 5.453 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.573 -4.907 5.036 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.114 -3.709 3.914 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.274 -5.348 3.338 1.00 0.00 H new ATOM 461 N ILE A 28 4.786 -4.789 3.793 1.00 0.00 N ATOM 462 CA ILE A 28 6.166 -5.292 4.082 1.00 0.00 C ATOM 463 C ILE A 28 6.698 -4.659 5.371 1.00 0.00 C ATOM 464 O ILE A 28 6.887 -3.462 5.447 1.00 0.00 O ATOM 465 CB ILE A 28 7.084 -4.928 2.910 1.00 0.00 C ATOM 466 CG1 ILE A 28 6.813 -5.883 1.743 1.00 0.00 C ATOM 467 CG2 ILE A 28 8.547 -5.061 3.342 1.00 0.00 C ATOM 468 CD1 ILE A 28 6.975 -5.126 0.423 1.00 0.00 C ATOM 0 H ILE A 28 4.699 -3.775 3.722 1.00 0.00 H new ATOM 0 HA ILE A 28 6.139 -6.374 4.209 1.00 0.00 H new ATOM 0 HB ILE A 28 6.889 -3.901 2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 28 7.504 -6.726 1.780 1.00 0.00 H new ATOM 0 HG13 ILE A 28 5.806 -6.293 1.819 1.00 0.00 H new ATOM 0 HG21 ILE A 28 9.198 -4.802 2.507 1.00 0.00 H new ATOM 0 HG22 ILE A 28 8.742 -4.388 4.177 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.744 -6.088 3.650 1.00 0.00 H new ATOM 0 HD11 ILE A 28 6.783 -5.802 -0.410 1.00 0.00 H new ATOM 0 HD12 ILE A 28 6.267 -4.298 0.389 1.00 0.00 H new ATOM 0 HD13 ILE A 28 7.991 -4.738 0.348 1.00 0.00 H new ATOM 480 N GLU A 29 6.926 -5.483 6.355 1.00 0.00 N ATOM 481 CA GLU A 29 7.445 -4.957 7.651 1.00 0.00 C ATOM 482 C GLU A 29 8.949 -4.671 7.537 1.00 0.00 C ATOM 483 O GLU A 29 9.589 -5.080 6.589 1.00 0.00 O ATOM 484 CB GLU A 29 7.197 -6.003 8.741 1.00 0.00 C ATOM 485 CG GLU A 29 7.801 -5.519 10.061 1.00 0.00 C ATOM 486 CD GLU A 29 7.166 -6.293 11.221 1.00 0.00 C ATOM 487 OE1 GLU A 29 6.087 -5.885 11.618 1.00 0.00 O ATOM 488 OE2 GLU A 29 7.796 -7.249 11.643 1.00 0.00 O ATOM 0 H GLU A 29 6.777 -6.491 6.320 1.00 0.00 H new ATOM 0 HA GLU A 29 6.932 -4.029 7.903 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.127 -6.173 8.859 1.00 0.00 H new ATOM 0 HB3 GLU A 29 7.642 -6.956 8.453 1.00 0.00 H new ATOM 0 HG2 GLU A 29 8.881 -5.668 10.057 1.00 0.00 H new ATOM 0 HG3 GLU A 29 7.627 -4.450 10.184 1.00 0.00 H new ATOM 495 N SER A 30 9.475 -3.966 8.505 1.00 0.00 N ATOM 496 CA SER A 30 10.937 -3.641 8.478 1.00 0.00 C ATOM 497 C SER A 30 11.749 -4.856 8.024 1.00 0.00 C ATOM 498 O SER A 30 11.702 -5.901 8.642 1.00 0.00 O ATOM 499 CB SER A 30 11.380 -3.231 9.881 1.00 0.00 C ATOM 500 OG SER A 30 10.920 -4.289 10.711 1.00 0.00 O ATOM 0 H SER A 30 8.962 -3.603 9.308 1.00 0.00 H new ATOM 0 HA SER A 30 11.108 -2.826 7.775 1.00 0.00 H new ATOM 0 HB2 SER A 30 12.463 -3.119 9.941 1.00 0.00 H new ATOM 0 HB3 SER A 30 10.944 -2.276 10.174 1.00 0.00 H new ATOM 0 HG SER A 30 11.020 -5.142 10.239 1.00 0.00 H new ATOM 506 N GLY A 31 12.478 -4.682 6.948 1.00 0.00 N ATOM 507 CA GLY A 31 13.310 -5.804 6.420 1.00 0.00 C ATOM 508 C GLY A 31 14.798 -5.428 6.478 1.00 0.00 C ATOM 509 O GLY A 31 15.167 -4.419 7.044 1.00 0.00 O ATOM 0 H GLY A 31 12.532 -3.814 6.415 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.132 -6.706 7.005 1.00 0.00 H new ATOM 0 HA3 GLY A 31 13.023 -6.028 5.393 1.00 0.00 H new ATOM 513 N PRO A 32 15.622 -6.261 5.879 1.00 0.00 N ATOM 514 CA PRO A 32 17.074 -6.034 5.858 1.00 0.00 C ATOM 515 C PRO A 32 17.402 -4.819 4.989 1.00 0.00 C ATOM 516 O PRO A 32 18.547 -4.435 4.854 1.00 0.00 O ATOM 517 CB PRO A 32 17.668 -7.306 5.242 1.00 0.00 C ATOM 518 CG PRO A 32 16.474 -8.223 4.831 1.00 0.00 C ATOM 519 CD PRO A 32 15.175 -7.476 5.186 1.00 0.00 C ATOM 0 HA PRO A 32 17.475 -5.837 6.852 1.00 0.00 H new ATOM 0 HB2 PRO A 32 18.282 -7.063 4.375 1.00 0.00 H new ATOM 0 HB3 PRO A 32 18.314 -7.814 5.958 1.00 0.00 H new ATOM 0 HG2 PRO A 32 16.510 -8.445 3.764 1.00 0.00 H new ATOM 0 HG3 PRO A 32 16.524 -9.177 5.357 1.00 0.00 H new ATOM 0 HD2 PRO A 32 14.601 -7.233 4.292 1.00 0.00 H new ATOM 0 HD3 PRO A 32 14.531 -8.082 5.824 1.00 0.00 H new ATOM 527 N HIS A 33 16.374 -4.245 4.422 1.00 0.00 N ATOM 528 CA HIS A 33 16.569 -3.053 3.547 1.00 0.00 C ATOM 529 C HIS A 33 15.884 -1.833 4.166 1.00 0.00 C ATOM 530 O HIS A 33 16.220 -0.708 3.857 1.00 0.00 O ATOM 531 CB HIS A 33 15.932 -3.338 2.193 1.00 0.00 C ATOM 532 CG HIS A 33 14.413 -3.368 2.365 1.00 0.00 C ATOM 533 ND1 HIS A 33 13.785 -4.018 3.291 1.00 0.00 N ATOM 534 CD2 HIS A 33 13.418 -2.727 1.626 1.00 0.00 C ATOM 535 CE1 HIS A 33 12.521 -3.840 3.196 1.00 0.00 C ATOM 536 NE2 HIS A 33 12.269 -3.053 2.189 1.00 0.00 N ATOM 0 H HIS A 33 15.407 -4.551 4.527 1.00 0.00 H new ATOM 0 HA HIS A 33 17.635 -2.851 3.438 1.00 0.00 H new ATOM 0 HB2 HIS A 33 16.216 -2.571 1.472 1.00 0.00 H new ATOM 0 HB3 HIS A 33 16.287 -4.291 1.801 1.00 0.00 H new ATOM 0 HD2 HIS A 33 13.560 -2.091 0.765 1.00 0.00 H new ATOM 0 HE1 HIS A 33 11.779 -4.275 3.849 1.00 0.00 H new ATOM 0 HE2 HIS A 33 11.345 -2.743 1.888 1.00 0.00 H new ATOM 544 N CYS A 34 14.935 -2.089 5.028 1.00 0.00 N ATOM 545 CA CYS A 34 14.200 -0.961 5.672 1.00 0.00 C ATOM 546 C CYS A 34 13.978 -1.248 7.163 1.00 0.00 C ATOM 547 O CYS A 34 13.663 -2.358 7.546 1.00 0.00 O ATOM 548 CB CYS A 34 12.851 -0.794 4.973 1.00 0.00 C ATOM 549 SG CYS A 34 12.140 0.869 4.924 1.00 0.00 S ATOM 0 H CYS A 34 14.639 -3.023 5.312 1.00 0.00 H new ATOM 0 HA CYS A 34 14.787 -0.047 5.581 1.00 0.00 H new ATOM 0 HB2 CYS A 34 12.957 -1.145 3.947 1.00 0.00 H new ATOM 0 HB3 CYS A 34 12.134 -1.453 5.463 1.00 0.00 H new ATOM 554 N ALA A 35 14.148 -0.233 7.970 1.00 0.00 N ATOM 555 CA ALA A 35 13.956 -0.414 9.440 1.00 0.00 C ATOM 556 C ALA A 35 12.577 0.110 9.862 1.00 0.00 C ATOM 557 O ALA A 35 12.392 0.547 10.980 1.00 0.00 O ATOM 558 CB ALA A 35 15.044 0.361 10.182 1.00 0.00 C ATOM 0 H ALA A 35 14.410 0.708 7.677 1.00 0.00 H new ATOM 0 HA ALA A 35 14.020 -1.474 9.685 1.00 0.00 H new ATOM 0 HB1 ALA A 35 14.912 0.235 11.257 1.00 0.00 H new ATOM 0 HB2 ALA A 35 16.024 -0.017 9.890 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.974 1.419 9.930 1.00 0.00 H new ATOM 564 N ASN A 36 11.643 0.053 8.954 1.00 0.00 N ATOM 565 CA ASN A 36 10.269 0.549 9.276 1.00 0.00 C ATOM 566 C ASN A 36 9.211 -0.348 8.636 1.00 0.00 C ATOM 567 O ASN A 36 9.367 -1.545 8.568 1.00 0.00 O ATOM 568 CB ASN A 36 10.123 1.973 8.743 1.00 0.00 C ATOM 569 CG ASN A 36 11.298 2.819 9.241 1.00 0.00 C ATOM 570 OD1 ASN A 36 11.388 3.151 10.406 1.00 0.00 O ATOM 571 ND2 ASN A 36 12.218 3.185 8.393 1.00 0.00 N ATOM 0 H ASN A 36 11.766 -0.312 8.009 1.00 0.00 H new ATOM 0 HA ASN A 36 10.126 0.534 10.356 1.00 0.00 H new ATOM 0 HB2 ASN A 36 10.100 1.966 7.653 1.00 0.00 H new ATOM 0 HB3 ASN A 36 9.180 2.405 9.079 1.00 0.00 H new ATOM 0 HD21 ASN A 36 13.008 3.747 8.709 1.00 0.00 H new ATOM 0 HD22 ASN A 36 12.148 2.909 7.414 1.00 0.00 H new ATOM 578 N THR A 37 8.151 0.259 8.206 1.00 0.00 N ATOM 579 CA THR A 37 7.056 -0.523 7.547 1.00 0.00 C ATOM 580 C THR A 37 6.674 0.130 6.216 1.00 0.00 C ATOM 581 O THR A 37 6.399 1.314 6.161 1.00 0.00 O ATOM 582 CB THR A 37 5.843 -0.567 8.474 1.00 0.00 C ATOM 583 OG1 THR A 37 5.892 -1.861 9.070 1.00 0.00 O ATOM 584 CG2 THR A 37 4.523 -0.532 7.700 1.00 0.00 C ATOM 0 H THR A 37 7.985 1.263 8.277 1.00 0.00 H new ATOM 0 HA THR A 37 7.401 -1.538 7.351 1.00 0.00 H new ATOM 0 HB THR A 37 5.876 0.279 9.160 1.00 0.00 H new ATOM 0 HG1 THR A 37 5.268 -1.898 9.824 1.00 0.00 H new ATOM 0 HG21 THR A 37 3.689 -0.565 8.401 1.00 0.00 H new ATOM 0 HG22 THR A 37 4.469 0.386 7.115 1.00 0.00 H new ATOM 0 HG23 THR A 37 4.470 -1.392 7.032 1.00 0.00 H new ATOM 592 N GLU A 38 6.664 -0.663 5.173 1.00 0.00 N ATOM 593 CA GLU A 38 6.309 -0.121 3.826 1.00 0.00 C ATOM 594 C GLU A 38 5.034 -0.789 3.305 1.00 0.00 C ATOM 595 O GLU A 38 5.028 -1.966 3.002 1.00 0.00 O ATOM 596 CB GLU A 38 7.458 -0.405 2.861 1.00 0.00 C ATOM 597 CG GLU A 38 8.755 0.155 3.448 1.00 0.00 C ATOM 598 CD GLU A 38 9.728 -0.996 3.716 1.00 0.00 C ATOM 599 OE1 GLU A 38 9.454 -1.729 4.651 1.00 0.00 O ATOM 600 OE2 GLU A 38 10.690 -1.076 2.969 1.00 0.00 O ATOM 0 H GLU A 38 6.885 -1.658 5.196 1.00 0.00 H new ATOM 0 HA GLU A 38 6.138 0.953 3.903 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.553 -1.478 2.695 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.256 0.051 1.892 1.00 0.00 H new ATOM 0 HG2 GLU A 38 9.201 0.870 2.757 1.00 0.00 H new ATOM 0 HG3 GLU A 38 8.547 0.693 4.373 1.00 0.00 H new ATOM 607 N ILE A 39 3.982 -0.024 3.213 1.00 0.00 N ATOM 608 CA ILE A 39 2.704 -0.601 2.707 1.00 0.00 C ATOM 609 C ILE A 39 2.613 -0.424 1.190 1.00 0.00 C ATOM 610 O ILE A 39 2.189 0.607 0.707 1.00 0.00 O ATOM 611 CB ILE A 39 1.524 0.111 3.377 1.00 0.00 C ATOM 612 CG1 ILE A 39 1.745 0.131 4.893 1.00 0.00 C ATOM 613 CG2 ILE A 39 0.228 -0.649 3.065 1.00 0.00 C ATOM 614 CD1 ILE A 39 0.448 0.561 5.584 1.00 0.00 C ATOM 0 H ILE A 39 3.950 0.964 3.463 1.00 0.00 H new ATOM 0 HA ILE A 39 2.673 -1.665 2.943 1.00 0.00 H new ATOM 0 HB ILE A 39 1.449 1.131 3.001 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.047 -0.857 5.242 1.00 0.00 H new ATOM 0 HG13 ILE A 39 2.552 0.819 5.146 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.613 -0.145 3.541 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.072 -0.676 1.986 1.00 0.00 H new ATOM 0 HG23 ILE A 39 0.303 -1.667 3.446 1.00 0.00 H new ATOM 0 HD11 ILE A 39 0.599 0.577 6.663 1.00 0.00 H new ATOM 0 HD12 ILE A 39 0.166 1.557 5.242 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.346 -0.145 5.339 1.00 0.00 H new ATOM 626 N ILE A 40 3.011 -1.435 0.467 1.00 0.00 N ATOM 627 CA ILE A 40 2.945 -1.338 -1.018 1.00 0.00 C ATOM 628 C ILE A 40 1.583 -1.838 -1.509 1.00 0.00 C ATOM 629 O ILE A 40 1.041 -2.788 -0.979 1.00 0.00 O ATOM 630 CB ILE A 40 4.064 -2.186 -1.630 1.00 0.00 C ATOM 631 CG1 ILE A 40 5.383 -1.856 -0.928 1.00 0.00 C ATOM 632 CG2 ILE A 40 4.189 -1.862 -3.122 1.00 0.00 C ATOM 633 CD1 ILE A 40 6.536 -2.526 -1.679 1.00 0.00 C ATOM 0 H ILE A 40 3.375 -2.314 0.835 1.00 0.00 H new ATOM 0 HA ILE A 40 3.071 -0.299 -1.322 1.00 0.00 H new ATOM 0 HB ILE A 40 3.834 -3.244 -1.505 1.00 0.00 H new ATOM 0 HG12 ILE A 40 5.532 -0.777 -0.897 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.356 -2.203 0.105 1.00 0.00 H new ATOM 0 HG21 ILE A 40 4.985 -2.464 -3.560 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.247 -2.086 -3.623 1.00 0.00 H new ATOM 0 HG23 ILE A 40 4.424 -0.805 -3.246 1.00 0.00 H new ATOM 0 HD11 ILE A 40 7.478 -2.293 -1.182 1.00 0.00 H new ATOM 0 HD12 ILE A 40 6.387 -3.606 -1.686 1.00 0.00 H new ATOM 0 HD13 ILE A 40 6.566 -2.157 -2.704 1.00 0.00 H new ATOM 645 N VAL A 41 1.063 -1.179 -2.513 1.00 0.00 N ATOM 646 CA VAL A 41 -0.269 -1.579 -3.059 1.00 0.00 C ATOM 647 C VAL A 41 -0.187 -1.724 -4.584 1.00 0.00 C ATOM 648 O VAL A 41 0.762 -1.275 -5.196 1.00 0.00 O ATOM 649 CB VAL A 41 -1.282 -0.492 -2.696 1.00 0.00 C ATOM 650 CG1 VAL A 41 -0.728 0.871 -3.118 1.00 0.00 C ATOM 651 CG2 VAL A 41 -2.592 -0.750 -3.433 1.00 0.00 C ATOM 0 H VAL A 41 1.502 -0.384 -2.977 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.575 -2.536 -2.635 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.460 -0.503 -1.621 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.446 1.651 -2.862 1.00 0.00 H new ATOM 0 HG12 VAL A 41 0.212 1.058 -2.599 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.555 0.876 -4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.314 0.025 -3.174 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.414 -0.735 -4.508 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.986 -1.724 -3.144 1.00 0.00 H new ATOM 661 N LYS A 42 -1.184 -2.352 -5.168 1.00 0.00 N ATOM 662 CA LYS A 42 -1.165 -2.529 -6.653 1.00 0.00 C ATOM 663 C LYS A 42 -2.561 -2.298 -7.249 1.00 0.00 C ATOM 664 O LYS A 42 -3.534 -2.928 -6.852 1.00 0.00 O ATOM 665 CB LYS A 42 -0.693 -3.941 -6.980 1.00 0.00 C ATOM 666 CG LYS A 42 -0.692 -4.130 -8.499 1.00 0.00 C ATOM 667 CD LYS A 42 0.577 -4.879 -8.911 1.00 0.00 C ATOM 668 CE LYS A 42 0.624 -6.220 -8.177 1.00 0.00 C ATOM 669 NZ LYS A 42 1.668 -6.199 -7.114 1.00 0.00 N ATOM 0 H LYS A 42 -1.995 -2.742 -4.688 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.484 -1.797 -7.087 1.00 0.00 H new ATOM 0 HB2 LYS A 42 0.308 -4.105 -6.580 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.348 -4.675 -6.510 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -1.575 -4.689 -8.809 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -0.736 -3.162 -8.998 1.00 0.00 H new ATOM 0 HD2 LYS A 42 0.586 -5.039 -9.989 1.00 0.00 H new ATOM 0 HD3 LYS A 42 1.459 -4.286 -8.669 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -0.349 -6.433 -7.735 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.834 -7.021 -8.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 2.424 -6.870 -7.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 2.066 -5.241 -7.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 1.243 -6.471 -6.205 1.00 0.00 H new ATOM 683 N LEU A 43 -2.618 -1.394 -8.197 1.00 0.00 N ATOM 684 CA LEU A 43 -3.922 -1.081 -8.853 1.00 0.00 C ATOM 685 C LEU A 43 -4.192 -2.061 -9.997 1.00 0.00 C ATOM 686 O LEU A 43 -3.274 -2.544 -10.631 1.00 0.00 O ATOM 687 CB LEU A 43 -3.869 0.339 -9.416 1.00 0.00 C ATOM 688 CG LEU A 43 -4.081 1.340 -8.284 1.00 0.00 C ATOM 689 CD1 LEU A 43 -3.021 1.110 -7.206 1.00 0.00 C ATOM 690 CD2 LEU A 43 -3.936 2.760 -8.836 1.00 0.00 C ATOM 0 H LEU A 43 -1.819 -0.862 -8.543 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.720 -1.167 -8.115 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.907 0.516 -9.897 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.636 0.468 -10.179 1.00 0.00 H new ATOM 0 HG LEU A 43 -5.076 1.210 -7.857 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.167 1.822 -6.394 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.110 0.095 -6.819 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.029 1.248 -7.636 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -4.086 3.480 -8.032 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.938 2.887 -9.255 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.680 2.925 -9.615 1.00 0.00 H new ATOM 702 N SER A 44 -5.451 -2.319 -10.230 1.00 0.00 N ATOM 703 CA SER A 44 -5.843 -3.267 -11.324 1.00 0.00 C ATOM 704 C SER A 44 -5.093 -2.968 -12.632 1.00 0.00 C ATOM 705 O SER A 44 -4.708 -3.872 -13.345 1.00 0.00 O ATOM 706 CB SER A 44 -7.343 -3.131 -11.576 1.00 0.00 C ATOM 707 OG SER A 44 -7.431 -2.194 -12.640 1.00 0.00 O ATOM 0 H SER A 44 -6.230 -1.915 -9.711 1.00 0.00 H new ATOM 0 HA SER A 44 -5.586 -4.278 -11.008 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.790 -4.087 -11.849 1.00 0.00 H new ATOM 0 HB3 SER A 44 -7.866 -2.776 -10.688 1.00 0.00 H new ATOM 0 HG SER A 44 -8.372 -2.047 -12.870 1.00 0.00 H new ATOM 713 N ASP A 45 -4.903 -1.711 -12.918 1.00 0.00 N ATOM 714 CA ASP A 45 -4.201 -1.351 -14.190 1.00 0.00 C ATOM 715 C ASP A 45 -2.802 -1.971 -14.223 1.00 0.00 C ATOM 716 O ASP A 45 -2.114 -1.905 -15.222 1.00 0.00 O ATOM 717 CB ASP A 45 -4.088 0.169 -14.286 1.00 0.00 C ATOM 718 CG ASP A 45 -3.869 0.748 -12.887 1.00 0.00 C ATOM 719 OD1 ASP A 45 -3.028 0.193 -12.199 1.00 0.00 O ATOM 720 OD2 ASP A 45 -4.556 1.710 -12.585 1.00 0.00 O ATOM 0 H ASP A 45 -5.197 -0.925 -12.339 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.773 -1.737 -15.034 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -3.260 0.443 -14.940 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -4.994 0.586 -14.727 1.00 0.00 H new ATOM 725 N GLY A 46 -2.414 -2.557 -13.130 1.00 0.00 N ATOM 726 CA GLY A 46 -1.068 -3.187 -13.076 1.00 0.00 C ATOM 727 C GLY A 46 -0.028 -2.167 -12.618 1.00 0.00 C ATOM 728 O GLY A 46 1.127 -2.251 -12.987 1.00 0.00 O ATOM 0 H GLY A 46 -2.966 -2.628 -12.275 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -1.082 -4.035 -12.392 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -0.800 -3.575 -14.059 1.00 0.00 H new ATOM 732 N ARG A 47 -0.462 -1.223 -11.818 1.00 0.00 N ATOM 733 CA ARG A 47 0.489 -0.170 -11.330 1.00 0.00 C ATOM 734 C ARG A 47 0.781 -0.368 -9.840 1.00 0.00 C ATOM 735 O ARG A 47 -0.119 -0.590 -9.055 1.00 0.00 O ATOM 736 CB ARG A 47 -0.130 1.221 -11.543 1.00 0.00 C ATOM 737 CG ARG A 47 -0.564 1.390 -13.012 1.00 0.00 C ATOM 738 CD ARG A 47 0.651 1.745 -13.879 1.00 0.00 C ATOM 739 NE ARG A 47 0.594 3.197 -14.217 1.00 0.00 N ATOM 740 CZ ARG A 47 0.905 3.586 -15.423 1.00 0.00 C ATOM 741 NH1 ARG A 47 2.163 3.640 -15.765 1.00 0.00 N ATOM 742 NH2 ARG A 47 -0.054 3.911 -16.248 1.00 0.00 N ATOM 0 H ARG A 47 -1.422 -1.134 -11.484 1.00 0.00 H new ATOM 0 HA ARG A 47 1.420 -0.251 -11.891 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.989 1.349 -10.885 1.00 0.00 H new ATOM 0 HB3 ARG A 47 0.592 1.993 -11.278 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.022 0.469 -13.373 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -1.318 2.173 -13.090 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.574 1.518 -13.346 1.00 0.00 H new ATOM 0 HD3 ARG A 47 0.653 1.146 -14.789 1.00 0.00 H new ATOM 0 HE ARG A 47 0.315 3.879 -13.512 1.00 0.00 H new ATOM 0 HH11 ARG A 47 2.886 3.380 -15.094 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.424 3.942 -16.704 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.027 3.858 -15.945 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.170 4.217 -17.195 1.00 0.00 H new ATOM 756 N GLU A 48 2.039 -0.277 -9.487 1.00 0.00 N ATOM 757 CA GLU A 48 2.423 -0.454 -8.052 1.00 0.00 C ATOM 758 C GLU A 48 2.835 0.893 -7.444 1.00 0.00 C ATOM 759 O GLU A 48 3.608 1.628 -8.029 1.00 0.00 O ATOM 760 CB GLU A 48 3.597 -1.427 -7.967 1.00 0.00 C ATOM 761 CG GLU A 48 4.410 -1.347 -9.260 1.00 0.00 C ATOM 762 CD GLU A 48 5.767 -2.022 -9.046 1.00 0.00 C ATOM 763 OE1 GLU A 48 6.609 -1.369 -8.451 1.00 0.00 O ATOM 764 OE2 GLU A 48 5.885 -3.153 -9.488 1.00 0.00 O ATOM 0 H GLU A 48 2.812 -0.089 -10.125 1.00 0.00 H new ATOM 0 HA GLU A 48 1.570 -0.846 -7.498 1.00 0.00 H new ATOM 0 HB2 GLU A 48 4.227 -1.182 -7.112 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.233 -2.443 -7.814 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.872 -1.835 -10.072 1.00 0.00 H new ATOM 0 HG3 GLU A 48 4.550 -0.306 -9.551 1.00 0.00 H new ATOM 771 N LEU A 49 2.309 1.185 -6.280 1.00 0.00 N ATOM 772 CA LEU A 49 2.655 2.480 -5.611 1.00 0.00 C ATOM 773 C LEU A 49 2.958 2.242 -4.128 1.00 0.00 C ATOM 774 O LEU A 49 3.046 1.114 -3.683 1.00 0.00 O ATOM 775 CB LEU A 49 1.471 3.441 -5.737 1.00 0.00 C ATOM 776 CG LEU A 49 1.248 3.791 -7.213 1.00 0.00 C ATOM 777 CD1 LEU A 49 -0.101 3.230 -7.666 1.00 0.00 C ATOM 778 CD2 LEU A 49 1.238 5.313 -7.371 1.00 0.00 C ATOM 0 H LEU A 49 1.660 0.589 -5.767 1.00 0.00 H new ATOM 0 HA LEU A 49 3.536 2.908 -6.090 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.573 2.984 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.663 4.347 -5.163 1.00 0.00 H new ATOM 0 HG LEU A 49 2.046 3.362 -7.818 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.264 3.477 -8.715 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.104 2.147 -7.543 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.897 3.666 -7.063 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.080 5.569 -8.419 1.00 0.00 H new ATOM 0 HD22 LEU A 49 0.434 5.736 -6.769 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.193 5.720 -7.038 1.00 0.00 H new ATOM 790 N CYS A 50 3.111 3.317 -3.397 1.00 0.00 N ATOM 791 CA CYS A 50 3.411 3.187 -1.938 1.00 0.00 C ATOM 792 C CYS A 50 2.553 4.170 -1.134 1.00 0.00 C ATOM 793 O CYS A 50 2.446 5.330 -1.482 1.00 0.00 O ATOM 794 CB CYS A 50 4.888 3.494 -1.704 1.00 0.00 C ATOM 795 SG CYS A 50 6.078 2.183 -2.079 1.00 0.00 S ATOM 0 H CYS A 50 3.042 4.274 -3.744 1.00 0.00 H new ATOM 0 HA CYS A 50 3.185 2.172 -1.613 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.150 4.368 -2.301 1.00 0.00 H new ATOM 0 HB3 CYS A 50 5.013 3.774 -0.658 1.00 0.00 H new ATOM 800 N LEU A 51 1.962 3.681 -0.071 1.00 0.00 N ATOM 801 CA LEU A 51 1.099 4.568 0.774 1.00 0.00 C ATOM 802 C LEU A 51 1.781 4.859 2.114 1.00 0.00 C ATOM 803 O LEU A 51 2.697 4.165 2.512 1.00 0.00 O ATOM 804 CB LEU A 51 -0.236 3.869 1.031 1.00 0.00 C ATOM 805 CG LEU A 51 -0.782 3.327 -0.292 1.00 0.00 C ATOM 806 CD1 LEU A 51 -2.155 2.697 -0.048 1.00 0.00 C ATOM 807 CD2 LEU A 51 -0.927 4.480 -1.286 1.00 0.00 C ATOM 0 H LEU A 51 2.038 2.715 0.247 1.00 0.00 H new ATOM 0 HA LEU A 51 0.937 5.509 0.249 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.103 3.055 1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.947 4.567 1.473 1.00 0.00 H new ATOM 0 HG LEU A 51 -0.099 2.578 -0.694 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -2.549 2.309 -0.987 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -2.059 1.882 0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.836 3.451 0.348 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.316 4.099 -2.231 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.615 5.223 -0.883 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.047 4.941 -1.454 1.00 0.00 H new ATOM 819 N ASP A 52 1.311 5.888 2.780 1.00 0.00 N ATOM 820 CA ASP A 52 1.904 6.258 4.102 1.00 0.00 C ATOM 821 C ASP A 52 0.839 6.073 5.226 1.00 0.00 C ATOM 822 O ASP A 52 -0.192 6.716 5.186 1.00 0.00 O ATOM 823 CB ASP A 52 2.310 7.731 4.054 1.00 0.00 C ATOM 824 CG ASP A 52 3.401 7.987 5.095 1.00 0.00 C ATOM 825 OD1 ASP A 52 3.159 7.622 6.233 1.00 0.00 O ATOM 826 OD2 ASP A 52 4.414 8.533 4.692 1.00 0.00 O ATOM 0 H ASP A 52 0.546 6.484 2.465 1.00 0.00 H new ATOM 0 HA ASP A 52 2.767 5.625 4.308 1.00 0.00 H new ATOM 0 HB2 ASP A 52 2.673 7.988 3.059 1.00 0.00 H new ATOM 0 HB3 ASP A 52 1.446 8.365 4.252 1.00 0.00 H new ATOM 831 N PRO A 53 1.092 5.202 6.212 1.00 0.00 N ATOM 832 CA PRO A 53 0.117 4.997 7.295 1.00 0.00 C ATOM 833 C PRO A 53 -0.061 6.282 8.112 1.00 0.00 C ATOM 834 O PRO A 53 -0.919 6.363 8.970 1.00 0.00 O ATOM 835 CB PRO A 53 0.710 3.891 8.176 1.00 0.00 C ATOM 836 CG PRO A 53 2.115 3.543 7.602 1.00 0.00 C ATOM 837 CD PRO A 53 2.316 4.381 6.329 1.00 0.00 C ATOM 0 HA PRO A 53 -0.864 4.728 6.904 1.00 0.00 H new ATOM 0 HB2 PRO A 53 0.790 4.225 9.210 1.00 0.00 H new ATOM 0 HB3 PRO A 53 0.066 3.012 8.174 1.00 0.00 H new ATOM 0 HG2 PRO A 53 2.893 3.764 8.333 1.00 0.00 H new ATOM 0 HG3 PRO A 53 2.183 2.479 7.375 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.205 5.007 6.405 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.449 3.744 5.454 1.00 0.00 H new ATOM 845 N LYS A 54 0.754 7.259 7.826 1.00 0.00 N ATOM 846 CA LYS A 54 0.660 8.536 8.580 1.00 0.00 C ATOM 847 C LYS A 54 -0.540 9.369 8.109 1.00 0.00 C ATOM 848 O LYS A 54 -0.842 10.392 8.692 1.00 0.00 O ATOM 849 CB LYS A 54 1.946 9.335 8.371 1.00 0.00 C ATOM 850 CG LYS A 54 2.126 10.309 9.538 1.00 0.00 C ATOM 851 CD LYS A 54 3.407 11.118 9.327 1.00 0.00 C ATOM 852 CE LYS A 54 3.041 12.586 9.095 1.00 0.00 C ATOM 853 NZ LYS A 54 4.258 13.381 8.763 1.00 0.00 N ATOM 0 H LYS A 54 1.477 7.227 7.107 1.00 0.00 H new ATOM 0 HA LYS A 54 0.523 8.307 9.637 1.00 0.00 H new ATOM 0 HB2 LYS A 54 2.801 8.662 8.308 1.00 0.00 H new ATOM 0 HB3 LYS A 54 1.900 9.881 7.429 1.00 0.00 H new ATOM 0 HG2 LYS A 54 1.267 10.977 9.605 1.00 0.00 H new ATOM 0 HG3 LYS A 54 2.179 9.762 10.479 1.00 0.00 H new ATOM 0 HD2 LYS A 54 4.057 11.026 10.197 1.00 0.00 H new ATOM 0 HD3 LYS A 54 3.961 10.729 8.472 1.00 0.00 H new ATOM 0 HE2 LYS A 54 2.317 12.663 8.284 1.00 0.00 H new ATOM 0 HE3 LYS A 54 2.565 12.994 9.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 3.992 14.375 8.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 4.936 13.322 9.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 4.696 13.002 7.899 1.00 0.00 H new ATOM 867 N GLU A 55 -1.199 8.916 7.067 1.00 0.00 N ATOM 868 CA GLU A 55 -2.379 9.686 6.556 1.00 0.00 C ATOM 869 C GLU A 55 -3.687 8.991 6.954 1.00 0.00 C ATOM 870 O GLU A 55 -3.804 7.786 6.875 1.00 0.00 O ATOM 871 CB GLU A 55 -2.295 9.792 5.036 1.00 0.00 C ATOM 872 CG GLU A 55 -1.081 10.646 4.658 1.00 0.00 C ATOM 873 CD GLU A 55 -1.503 12.114 4.572 1.00 0.00 C ATOM 874 OE1 GLU A 55 -2.398 12.465 5.324 1.00 0.00 O ATOM 875 OE2 GLU A 55 -0.906 12.802 3.759 1.00 0.00 O ATOM 0 H GLU A 55 -0.976 8.062 6.556 1.00 0.00 H new ATOM 0 HA GLU A 55 -2.367 10.683 6.996 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.208 8.799 4.594 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.207 10.239 4.640 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.292 10.525 5.400 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.673 10.316 3.702 1.00 0.00 H new ATOM 882 N ASN A 56 -4.645 9.772 7.366 1.00 0.00 N ATOM 883 CA ASN A 56 -5.948 9.179 7.791 1.00 0.00 C ATOM 884 C ASN A 56 -6.693 8.564 6.600 1.00 0.00 C ATOM 885 O ASN A 56 -7.234 7.481 6.704 1.00 0.00 O ATOM 886 CB ASN A 56 -6.811 10.273 8.416 1.00 0.00 C ATOM 887 CG ASN A 56 -6.028 10.950 9.542 1.00 0.00 C ATOM 888 OD1 ASN A 56 -5.912 12.159 9.592 1.00 0.00 O ATOM 889 ND2 ASN A 56 -5.476 10.210 10.463 1.00 0.00 N ATOM 0 H ASN A 56 -4.586 10.788 7.428 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.750 8.388 8.515 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -7.093 11.007 7.661 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.735 9.846 8.805 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -4.950 10.646 11.220 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -5.570 9.195 10.426 1.00 0.00 H new ATOM 896 N TRP A 57 -6.710 9.257 5.492 1.00 0.00 N ATOM 897 CA TRP A 57 -7.439 8.702 4.314 1.00 0.00 C ATOM 898 C TRP A 57 -6.856 7.345 3.913 1.00 0.00 C ATOM 899 O TRP A 57 -7.495 6.577 3.227 1.00 0.00 O ATOM 900 CB TRP A 57 -7.365 9.681 3.132 1.00 0.00 C ATOM 901 CG TRP A 57 -5.907 9.918 2.715 1.00 0.00 C ATOM 902 CD1 TRP A 57 -5.169 10.941 3.134 1.00 0.00 C ATOM 903 CD2 TRP A 57 -5.228 9.170 1.861 1.00 0.00 C ATOM 904 NE1 TRP A 57 -4.003 10.779 2.489 1.00 0.00 N ATOM 905 CE2 TRP A 57 -3.957 9.685 1.663 1.00 0.00 C ATOM 906 CE3 TRP A 57 -5.609 8.020 1.191 1.00 0.00 C ATOM 907 CZ2 TRP A 57 -3.078 9.057 0.802 1.00 0.00 C ATOM 908 CZ3 TRP A 57 -4.726 7.393 0.333 1.00 0.00 C ATOM 909 CH2 TRP A 57 -3.462 7.912 0.139 1.00 0.00 C ATOM 0 H TRP A 57 -6.262 10.163 5.352 1.00 0.00 H new ATOM 0 HA TRP A 57 -8.484 8.563 4.590 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -7.930 9.284 2.289 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -7.828 10.628 3.408 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -5.443 11.720 3.830 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -3.216 11.417 2.604 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -6.598 7.612 1.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -2.089 9.464 0.649 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -5.026 6.495 -0.187 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -2.774 7.420 -0.533 1.00 0.00 H new ATOM 920 N VAL A 58 -5.663 7.066 4.356 1.00 0.00 N ATOM 921 CA VAL A 58 -5.055 5.751 3.999 1.00 0.00 C ATOM 922 C VAL A 58 -5.632 4.662 4.896 1.00 0.00 C ATOM 923 O VAL A 58 -5.807 3.539 4.478 1.00 0.00 O ATOM 924 CB VAL A 58 -3.535 5.826 4.185 1.00 0.00 C ATOM 925 CG1 VAL A 58 -2.976 4.430 4.468 1.00 0.00 C ATOM 926 CG2 VAL A 58 -2.898 6.369 2.913 1.00 0.00 C ATOM 0 H VAL A 58 -5.090 7.677 4.939 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.280 5.515 2.959 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.309 6.484 5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -1.896 4.490 4.599 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -3.430 4.033 5.376 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.204 3.770 3.631 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.817 6.424 3.042 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.131 5.708 2.078 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -3.289 7.365 2.707 1.00 0.00 H new ATOM 936 N GLN A 59 -5.915 5.023 6.111 1.00 0.00 N ATOM 937 CA GLN A 59 -6.485 4.024 7.050 1.00 0.00 C ATOM 938 C GLN A 59 -7.937 3.717 6.678 1.00 0.00 C ATOM 939 O GLN A 59 -8.454 2.672 7.007 1.00 0.00 O ATOM 940 CB GLN A 59 -6.433 4.595 8.468 1.00 0.00 C ATOM 941 CG GLN A 59 -6.601 3.456 9.473 1.00 0.00 C ATOM 942 CD GLN A 59 -7.148 4.017 10.787 1.00 0.00 C ATOM 943 OE1 GLN A 59 -6.658 5.001 11.307 1.00 0.00 O ATOM 944 NE2 GLN A 59 -8.162 3.424 11.354 1.00 0.00 N ATOM 0 H GLN A 59 -5.778 5.959 6.493 1.00 0.00 H new ATOM 0 HA GLN A 59 -5.906 3.102 6.994 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -5.484 5.105 8.633 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -7.221 5.336 8.604 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -7.281 2.702 9.075 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -5.644 2.963 9.645 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -8.577 2.598 10.922 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -8.540 3.786 12.229 1.00 0.00 H new ATOM 953 N ARG A 60 -8.562 4.629 5.984 1.00 0.00 N ATOM 954 CA ARG A 60 -9.990 4.410 5.605 1.00 0.00 C ATOM 955 C ARG A 60 -10.111 3.653 4.273 1.00 0.00 C ATOM 956 O ARG A 60 -10.784 2.646 4.199 1.00 0.00 O ATOM 957 CB ARG A 60 -10.687 5.764 5.485 1.00 0.00 C ATOM 958 CG ARG A 60 -12.195 5.571 5.652 1.00 0.00 C ATOM 959 CD ARG A 60 -12.895 6.920 5.465 1.00 0.00 C ATOM 960 NE ARG A 60 -14.359 6.687 5.295 1.00 0.00 N ATOM 961 CZ ARG A 60 -15.125 7.674 4.915 1.00 0.00 C ATOM 962 NH1 ARG A 60 -14.571 8.792 4.529 1.00 0.00 N ATOM 963 NH2 ARG A 60 -16.421 7.509 4.931 1.00 0.00 N ATOM 0 H ARG A 60 -8.153 5.507 5.665 1.00 0.00 H new ATOM 0 HA ARG A 60 -10.462 3.805 6.379 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -10.310 6.449 6.244 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -10.471 6.213 4.515 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -12.565 4.851 4.923 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -12.415 5.166 6.640 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -12.713 7.561 6.327 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -12.492 7.436 4.594 1.00 0.00 H new ATOM 0 HE ARG A 60 -14.758 5.765 5.474 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -13.555 8.884 4.528 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -15.154 9.573 4.229 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -16.818 6.621 5.237 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -17.035 8.269 4.638 1.00 0.00 H new ATOM 977 N VAL A 61 -9.464 4.145 3.244 1.00 0.00 N ATOM 978 CA VAL A 61 -9.573 3.450 1.934 1.00 0.00 C ATOM 979 C VAL A 61 -9.001 2.031 2.055 1.00 0.00 C ATOM 980 O VAL A 61 -9.502 1.099 1.452 1.00 0.00 O ATOM 981 CB VAL A 61 -8.812 4.255 0.877 1.00 0.00 C ATOM 982 CG1 VAL A 61 -9.345 5.696 0.862 1.00 0.00 C ATOM 983 CG2 VAL A 61 -7.323 4.259 1.224 1.00 0.00 C ATOM 0 H VAL A 61 -8.878 4.980 3.257 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.618 3.374 1.635 1.00 0.00 H new ATOM 0 HB VAL A 61 -8.953 3.806 -0.106 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -8.807 6.275 0.111 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -10.408 5.688 0.621 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -9.198 6.148 1.843 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -6.776 4.831 0.474 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -7.179 4.714 2.204 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -6.951 3.235 1.241 1.00 0.00 H new ATOM 993 N VAL A 62 -7.971 1.892 2.843 1.00 0.00 N ATOM 994 CA VAL A 62 -7.380 0.536 3.027 1.00 0.00 C ATOM 995 C VAL A 62 -8.308 -0.300 3.912 1.00 0.00 C ATOM 996 O VAL A 62 -8.520 -1.470 3.663 1.00 0.00 O ATOM 997 CB VAL A 62 -6.011 0.662 3.695 1.00 0.00 C ATOM 998 CG1 VAL A 62 -5.466 -0.736 3.993 1.00 0.00 C ATOM 999 CG2 VAL A 62 -5.050 1.384 2.749 1.00 0.00 C ATOM 0 H VAL A 62 -7.518 2.645 3.360 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.264 0.051 2.058 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.107 1.227 4.622 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -4.489 -0.652 4.470 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -6.151 -1.259 4.660 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.368 -1.295 3.062 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.073 1.475 3.223 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.953 0.815 1.825 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -5.438 2.377 2.524 1.00 0.00 H new ATOM 1009 N GLU A 63 -8.844 0.325 4.931 1.00 0.00 N ATOM 1010 CA GLU A 63 -9.771 -0.414 5.836 1.00 0.00 C ATOM 1011 C GLU A 63 -10.911 -1.021 5.022 1.00 0.00 C ATOM 1012 O GLU A 63 -11.365 -2.113 5.299 1.00 0.00 O ATOM 1013 CB GLU A 63 -10.353 0.558 6.864 1.00 0.00 C ATOM 1014 CG GLU A 63 -11.594 -0.070 7.499 1.00 0.00 C ATOM 1015 CD GLU A 63 -11.848 0.577 8.862 1.00 0.00 C ATOM 1016 OE1 GLU A 63 -12.284 1.718 8.846 1.00 0.00 O ATOM 1017 OE2 GLU A 63 -11.591 -0.104 9.841 1.00 0.00 O ATOM 0 H GLU A 63 -8.681 1.303 5.172 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.223 -1.208 6.343 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -9.611 0.783 7.630 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -10.613 1.502 6.384 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.459 0.070 6.850 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.453 -1.145 7.614 1.00 0.00 H new ATOM 1024 N LYS A 64 -11.350 -0.296 4.031 1.00 0.00 N ATOM 1025 CA LYS A 64 -12.461 -0.813 3.189 1.00 0.00 C ATOM 1026 C LYS A 64 -11.984 -2.007 2.357 1.00 0.00 C ATOM 1027 O LYS A 64 -12.704 -2.967 2.182 1.00 0.00 O ATOM 1028 CB LYS A 64 -12.949 0.297 2.267 1.00 0.00 C ATOM 1029 CG LYS A 64 -14.393 0.656 2.633 1.00 0.00 C ATOM 1030 CD LYS A 64 -14.897 1.762 1.695 1.00 0.00 C ATOM 1031 CE LYS A 64 -14.064 3.033 1.900 1.00 0.00 C ATOM 1032 NZ LYS A 64 -14.899 4.245 1.668 1.00 0.00 N ATOM 0 H LYS A 64 -10.991 0.623 3.771 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.277 -1.141 3.833 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -12.308 1.174 2.362 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -12.894 -0.027 1.228 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.030 -0.224 2.550 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -14.445 0.991 3.669 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -14.827 1.433 0.658 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.949 1.969 1.893 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -13.659 3.051 2.912 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.215 3.033 1.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -14.321 5.098 1.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -15.265 4.234 0.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -15.695 4.251 2.337 1.00 0.00 H new ATOM 1046 N PHE A 65 -10.782 -1.928 1.854 1.00 0.00 N ATOM 1047 CA PHE A 65 -10.269 -3.075 1.047 1.00 0.00 C ATOM 1048 C PHE A 65 -10.213 -4.339 1.905 1.00 0.00 C ATOM 1049 O PHE A 65 -10.403 -5.434 1.415 1.00 0.00 O ATOM 1050 CB PHE A 65 -8.876 -2.766 0.527 1.00 0.00 C ATOM 1051 CG PHE A 65 -8.375 -3.969 -0.283 1.00 0.00 C ATOM 1052 CD1 PHE A 65 -8.971 -4.301 -1.489 1.00 0.00 C ATOM 1053 CD2 PHE A 65 -7.323 -4.744 0.180 1.00 0.00 C ATOM 1054 CE1 PHE A 65 -8.524 -5.386 -2.216 1.00 0.00 C ATOM 1055 CE2 PHE A 65 -6.881 -5.830 -0.551 1.00 0.00 C ATOM 1056 CZ PHE A 65 -7.480 -6.150 -1.747 1.00 0.00 C ATOM 0 H PHE A 65 -10.145 -1.139 1.962 1.00 0.00 H new ATOM 0 HA PHE A 65 -10.945 -3.235 0.207 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -8.895 -1.872 -0.097 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -8.200 -2.561 1.357 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -9.791 -3.706 -1.863 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -6.846 -4.498 1.117 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -8.995 -5.636 -3.155 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -6.062 -6.430 -0.182 1.00 0.00 H new ATOM 0 HZ PHE A 65 -7.132 -6.999 -2.317 1.00 0.00 H new ATOM 1066 N LEU A 66 -9.954 -4.163 3.173 1.00 0.00 N ATOM 1067 CA LEU A 66 -9.877 -5.348 4.073 1.00 0.00 C ATOM 1068 C LEU A 66 -11.277 -5.915 4.324 1.00 0.00 C ATOM 1069 O LEU A 66 -11.505 -7.100 4.170 1.00 0.00 O ATOM 1070 CB LEU A 66 -9.245 -4.932 5.400 1.00 0.00 C ATOM 1071 CG LEU A 66 -7.722 -4.960 5.258 1.00 0.00 C ATOM 1072 CD1 LEU A 66 -7.109 -3.912 6.190 1.00 0.00 C ATOM 1073 CD2 LEU A 66 -7.205 -6.346 5.650 1.00 0.00 C ATOM 0 H LEU A 66 -9.794 -3.260 3.620 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.267 -6.118 3.600 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.579 -3.932 5.679 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.561 -5.607 6.195 1.00 0.00 H new ATOM 0 HG LEU A 66 -7.445 -4.742 4.227 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.024 -3.928 6.092 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -7.483 -2.924 5.922 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.384 -4.136 7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.120 -6.371 5.550 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -7.480 -6.558 6.683 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -7.647 -7.098 4.996 1.00 0.00 H new ATOM 1085 N LYS A 67 -12.188 -5.061 4.705 1.00 0.00 N ATOM 1086 CA LYS A 67 -13.574 -5.547 4.965 1.00 0.00 C ATOM 1087 C LYS A 67 -14.199 -6.060 3.659 1.00 0.00 C ATOM 1088 O LYS A 67 -15.070 -6.906 3.676 1.00 0.00 O ATOM 1089 CB LYS A 67 -14.412 -4.397 5.565 1.00 0.00 C ATOM 1090 CG LYS A 67 -15.125 -3.598 4.451 1.00 0.00 C ATOM 1091 CD LYS A 67 -16.431 -4.302 4.025 1.00 0.00 C ATOM 1092 CE LYS A 67 -17.621 -3.422 4.411 1.00 0.00 C ATOM 1093 NZ LYS A 67 -17.612 -2.156 3.624 1.00 0.00 N ATOM 0 H LYS A 67 -12.037 -4.062 4.846 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.551 -6.372 5.677 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -15.150 -4.802 6.258 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -13.767 -3.732 6.139 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -15.347 -2.591 4.804 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -14.464 -3.495 3.590 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -16.429 -4.481 2.950 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -16.510 -5.275 4.510 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -18.552 -3.961 4.233 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -17.582 -3.195 5.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -18.587 -1.815 3.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -17.053 -1.438 4.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -17.189 -2.331 2.690 1.00 0.00 H new ATOM 1107 N ARG A 68 -13.731 -5.539 2.553 1.00 0.00 N ATOM 1108 CA ARG A 68 -14.284 -5.991 1.245 1.00 0.00 C ATOM 1109 C ARG A 68 -13.690 -7.351 0.869 1.00 0.00 C ATOM 1110 O ARG A 68 -14.400 -8.257 0.482 1.00 0.00 O ATOM 1111 CB ARG A 68 -13.933 -4.965 0.167 1.00 0.00 C ATOM 1112 CG ARG A 68 -14.747 -5.266 -1.093 1.00 0.00 C ATOM 1113 CD ARG A 68 -15.955 -4.329 -1.148 1.00 0.00 C ATOM 1114 NE ARG A 68 -16.949 -4.876 -2.114 1.00 0.00 N ATOM 1115 CZ ARG A 68 -16.534 -5.394 -3.237 1.00 0.00 C ATOM 1116 NH1 ARG A 68 -16.151 -4.596 -4.197 1.00 0.00 N ATOM 1117 NH2 ARG A 68 -16.515 -6.695 -3.364 1.00 0.00 N ATOM 0 H ARG A 68 -13.000 -4.830 2.500 1.00 0.00 H new ATOM 0 HA ARG A 68 -15.367 -6.085 1.325 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -14.148 -3.957 0.522 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -12.867 -5.003 -0.056 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -14.128 -5.133 -1.980 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -15.077 -6.305 -1.087 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -16.404 -4.234 -0.159 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -15.643 -3.330 -1.453 1.00 0.00 H new ATOM 0 HE ARG A 68 -17.946 -4.846 -1.899 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -16.179 -3.585 -4.062 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -15.823 -4.983 -5.082 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -16.822 -7.287 -2.592 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -16.194 -7.118 -4.235 1.00 0.00 H new ATOM 1131 N ALA A 69 -12.394 -7.463 0.991 1.00 0.00 N ATOM 1132 CA ALA A 69 -11.739 -8.759 0.652 1.00 0.00 C ATOM 1133 C ALA A 69 -12.043 -9.797 1.736 1.00 0.00 C ATOM 1134 O ALA A 69 -11.904 -10.984 1.522 1.00 0.00 O ATOM 1135 CB ALA A 69 -10.227 -8.545 0.557 1.00 0.00 C ATOM 0 H ALA A 69 -11.767 -6.723 1.307 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.122 -9.121 -0.302 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.741 -9.489 0.309 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -10.011 -7.811 -0.219 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -9.850 -8.183 1.513 1.00 0.00 H new ATOM 1141 N GLU A 70 -12.455 -9.323 2.881 1.00 0.00 N ATOM 1142 CA GLU A 70 -12.775 -10.263 3.994 1.00 0.00 C ATOM 1143 C GLU A 70 -14.218 -10.763 3.865 1.00 0.00 C ATOM 1144 O GLU A 70 -14.498 -11.926 4.082 1.00 0.00 O ATOM 1145 CB GLU A 70 -12.607 -9.533 5.326 1.00 0.00 C ATOM 1146 CG GLU A 70 -13.021 -10.464 6.467 1.00 0.00 C ATOM 1147 CD GLU A 70 -12.097 -10.237 7.667 1.00 0.00 C ATOM 1148 OE1 GLU A 70 -11.046 -10.854 7.664 1.00 0.00 O ATOM 1149 OE2 GLU A 70 -12.499 -9.459 8.518 1.00 0.00 O ATOM 0 H GLU A 70 -12.583 -8.334 3.093 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.100 -11.118 3.949 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -11.571 -9.220 5.454 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.217 -8.630 5.339 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -14.056 -10.273 6.750 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.965 -11.503 6.142 1.00 0.00 H new ATOM 1156 N ASN A 71 -15.101 -9.870 3.514 1.00 0.00 N ATOM 1157 CA ASN A 71 -16.533 -10.267 3.369 1.00 0.00 C ATOM 1158 C ASN A 71 -16.721 -11.154 2.135 1.00 0.00 C ATOM 1159 O ASN A 71 -17.497 -12.089 2.154 1.00 0.00 O ATOM 1160 CB ASN A 71 -17.386 -9.007 3.228 1.00 0.00 C ATOM 1161 CG ASN A 71 -18.862 -9.400 3.160 1.00 0.00 C ATOM 1162 OD1 ASN A 71 -19.207 -10.623 3.458 1.00 0.00 O flip ATOM 1163 ND2 ASN A 71 -19.715 -8.597 2.835 1.00 0.00 N flip ATOM 0 H ASN A 71 -14.897 -8.889 3.322 1.00 0.00 H new ATOM 0 HA ASN A 71 -16.839 -10.830 4.251 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -17.214 -8.341 4.074 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -17.102 -8.460 2.329 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -19.452 -7.640 2.601 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -20.694 -8.881 2.796 1.00 0.00 H new ATOM 1170 N SER A 72 -16.011 -10.841 1.087 1.00 0.00 N ATOM 1171 CA SER A 72 -16.142 -11.660 -0.155 1.00 0.00 C ATOM 1172 C SER A 72 -15.674 -13.095 0.107 1.00 0.00 C ATOM 1173 O SER A 72 -16.285 -13.977 -0.473 1.00 0.00 O ATOM 1174 CB SER A 72 -15.288 -11.036 -1.258 1.00 0.00 C ATOM 1175 OG SER A 72 -15.725 -11.686 -2.444 1.00 0.00 O ATOM 1176 OXT SER A 72 -14.732 -13.226 0.873 1.00 0.00 O ATOM 0 H SER A 72 -15.353 -10.064 1.034 1.00 0.00 H new ATOM 0 HA SER A 72 -17.187 -11.682 -0.463 1.00 0.00 H new ATOM 0 HB2 SER A 72 -15.437 -9.958 -1.316 1.00 0.00 H new ATOM 0 HB3 SER A 72 -14.225 -11.201 -1.081 1.00 0.00 H new ATOM 0 HG SER A 72 -15.223 -11.339 -3.211 1.00 0.00 H new TER 1182 SER A 72 ATOM 1183 N ALA B 2 -1.194 -17.278 -22.109 1.00 0.00 N ATOM 1184 CA ALA B 2 -2.285 -17.070 -21.110 1.00 0.00 C ATOM 1185 C ALA B 2 -3.619 -17.529 -21.707 1.00 0.00 C ATOM 1186 O ALA B 2 -4.037 -17.049 -22.740 1.00 0.00 O ATOM 1187 CB ALA B 2 -2.389 -15.594 -20.721 1.00 0.00 C ATOM 0 HA ALA B 2 -2.054 -17.653 -20.218 1.00 0.00 H new ATOM 0 HB1 ALA B 2 -3.190 -15.465 -19.993 1.00 0.00 H new ATOM 0 HB2 ALA B 2 -1.446 -15.265 -20.285 1.00 0.00 H new ATOM 0 HB3 ALA B 2 -2.606 -14.998 -21.608 1.00 0.00 H new ATOM 1195 N LYS B 3 -4.260 -18.451 -21.038 1.00 0.00 N ATOM 1196 CA LYS B 3 -5.568 -18.954 -21.553 1.00 0.00 C ATOM 1197 C LYS B 3 -6.419 -19.492 -20.397 1.00 0.00 C ATOM 1198 O LYS B 3 -7.583 -19.161 -20.275 1.00 0.00 O ATOM 1199 CB LYS B 3 -5.313 -20.076 -22.559 1.00 0.00 C ATOM 1200 CG LYS B 3 -3.921 -20.663 -22.312 1.00 0.00 C ATOM 1201 CD LYS B 3 -3.758 -21.947 -23.130 1.00 0.00 C ATOM 1202 CE LYS B 3 -3.937 -21.626 -24.615 1.00 0.00 C ATOM 1203 NZ LYS B 3 -5.374 -21.712 -24.998 1.00 0.00 N ATOM 0 H LYS B 3 -3.939 -18.874 -20.167 1.00 0.00 H new ATOM 0 HA LYS B 3 -6.102 -18.135 -22.035 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -6.072 -20.852 -22.457 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -5.384 -19.692 -23.577 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -3.155 -19.940 -22.592 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -3.787 -20.875 -21.251 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -2.773 -22.380 -22.956 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -4.493 -22.688 -22.815 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -3.558 -20.626 -24.825 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -3.352 -22.322 -25.217 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -5.486 -22.397 -25.773 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -5.934 -22.022 -24.178 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -5.706 -20.778 -25.311 1.00 0.00 H new ATOM 1217 N GLU B 4 -5.810 -20.312 -19.574 1.00 0.00 N ATOM 1218 CA GLU B 4 -6.553 -20.897 -18.413 1.00 0.00 C ATOM 1219 C GLU B 4 -5.832 -20.563 -17.101 1.00 0.00 C ATOM 1220 O GLU B 4 -5.122 -21.382 -16.553 1.00 0.00 O ATOM 1221 CB GLU B 4 -6.624 -22.415 -18.582 1.00 0.00 C ATOM 1222 CG GLU B 4 -7.379 -22.741 -19.875 1.00 0.00 C ATOM 1223 CD GLU B 4 -7.892 -24.181 -19.813 1.00 0.00 C ATOM 1224 OE1 GLU B 4 -7.078 -25.056 -20.063 1.00 0.00 O ATOM 1225 OE2 GLU B 4 -9.067 -24.325 -19.520 1.00 0.00 O ATOM 0 H GLU B 4 -4.835 -20.600 -19.655 1.00 0.00 H new ATOM 0 HA GLU B 4 -7.558 -20.477 -18.380 1.00 0.00 H new ATOM 0 HB2 GLU B 4 -5.620 -22.837 -18.617 1.00 0.00 H new ATOM 0 HB3 GLU B 4 -7.130 -22.865 -17.728 1.00 0.00 H new ATOM 0 HG2 GLU B 4 -8.213 -22.051 -20.006 1.00 0.00 H new ATOM 0 HG3 GLU B 4 -6.722 -22.614 -20.735 1.00 0.00 H new ATOM 1232 N LEU B 5 -6.033 -19.364 -16.628 1.00 0.00 N ATOM 1233 CA LEU B 5 -5.370 -18.955 -15.353 1.00 0.00 C ATOM 1234 C LEU B 5 -6.298 -19.241 -14.166 1.00 0.00 C ATOM 1235 O LEU B 5 -7.349 -18.644 -14.039 1.00 0.00 O ATOM 1236 CB LEU B 5 -5.061 -17.453 -15.412 1.00 0.00 C ATOM 1237 CG LEU B 5 -3.699 -17.209 -16.100 1.00 0.00 C ATOM 1238 CD1 LEU B 5 -2.559 -17.765 -15.230 1.00 0.00 C ATOM 1239 CD2 LEU B 5 -3.683 -17.896 -17.476 1.00 0.00 C ATOM 0 H LEU B 5 -6.622 -18.654 -17.063 1.00 0.00 H new ATOM 0 HA LEU B 5 -4.447 -19.520 -15.225 1.00 0.00 H new ATOM 0 HB2 LEU B 5 -5.849 -16.934 -15.958 1.00 0.00 H new ATOM 0 HB3 LEU B 5 -5.046 -17.039 -14.404 1.00 0.00 H new ATOM 0 HG LEU B 5 -3.555 -16.136 -16.229 1.00 0.00 H new ATOM 0 HD11 LEU B 5 -1.604 -17.588 -15.725 1.00 0.00 H new ATOM 0 HD12 LEU B 5 -2.564 -17.266 -14.261 1.00 0.00 H new ATOM 0 HD13 LEU B 5 -2.700 -18.836 -15.087 1.00 0.00 H new ATOM 0 HD21 LEU B 5 -2.721 -17.722 -17.958 1.00 0.00 H new ATOM 0 HD22 LEU B 5 -3.837 -18.968 -17.349 1.00 0.00 H new ATOM 0 HD23 LEU B 5 -4.480 -17.486 -18.097 1.00 0.00 H new ATOM 1251 N ARG B 6 -5.887 -20.150 -13.321 1.00 0.00 N ATOM 1252 CA ARG B 6 -6.735 -20.491 -12.137 1.00 0.00 C ATOM 1253 C ARG B 6 -6.432 -19.538 -10.977 1.00 0.00 C ATOM 1254 O ARG B 6 -5.639 -18.627 -11.110 1.00 0.00 O ATOM 1255 CB ARG B 6 -6.441 -21.930 -11.700 1.00 0.00 C ATOM 1256 CG ARG B 6 -6.476 -22.848 -12.925 1.00 0.00 C ATOM 1257 CD ARG B 6 -6.226 -24.294 -12.480 1.00 0.00 C ATOM 1258 NE ARG B 6 -5.168 -24.894 -13.345 1.00 0.00 N ATOM 1259 CZ ARG B 6 -4.881 -26.167 -13.226 1.00 0.00 C ATOM 1260 NH1 ARG B 6 -4.397 -26.603 -12.089 1.00 0.00 N ATOM 1261 NH2 ARG B 6 -5.083 -26.959 -14.247 1.00 0.00 N ATOM 0 H ARG B 6 -5.011 -20.667 -13.396 1.00 0.00 H new ATOM 0 HA ARG B 6 -7.785 -20.393 -12.413 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -5.464 -21.984 -11.219 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -7.177 -22.257 -10.965 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -7.442 -22.771 -13.425 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -5.719 -22.541 -13.646 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -5.916 -24.318 -11.435 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -7.146 -24.874 -12.553 1.00 0.00 H new ATOM 0 HE ARG B 6 -4.672 -24.317 -14.024 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -4.250 -25.955 -11.315 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -4.168 -27.591 -11.978 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -5.458 -26.583 -15.118 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -4.865 -27.953 -14.173 1.00 0.00 H new ATOM 1275 N CYS B 7 -7.070 -19.769 -9.863 1.00 0.00 N ATOM 1276 CA CYS B 7 -6.826 -18.891 -8.681 1.00 0.00 C ATOM 1277 C CYS B 7 -5.345 -18.948 -8.283 1.00 0.00 C ATOM 1278 O CYS B 7 -4.698 -19.961 -8.461 1.00 0.00 O ATOM 1279 CB CYS B 7 -7.686 -19.382 -7.518 1.00 0.00 C ATOM 1280 SG CYS B 7 -9.455 -19.002 -7.573 1.00 0.00 S ATOM 0 H CYS B 7 -7.744 -20.521 -9.719 1.00 0.00 H new ATOM 0 HA CYS B 7 -7.085 -17.862 -8.930 1.00 0.00 H new ATOM 0 HB2 CYS B 7 -7.576 -20.464 -7.451 1.00 0.00 H new ATOM 0 HB3 CYS B 7 -7.280 -18.962 -6.598 1.00 0.00 H new ATOM 1285 N GLN B 8 -4.832 -17.863 -7.753 1.00 0.00 N ATOM 1286 CA GLN B 8 -3.391 -17.875 -7.343 1.00 0.00 C ATOM 1287 C GLN B 8 -3.167 -18.892 -6.219 1.00 0.00 C ATOM 1288 O GLN B 8 -2.097 -19.458 -6.101 1.00 0.00 O ATOM 1289 CB GLN B 8 -2.984 -16.484 -6.849 1.00 0.00 C ATOM 1290 CG GLN B 8 -2.669 -15.577 -8.044 1.00 0.00 C ATOM 1291 CD GLN B 8 -2.118 -14.245 -7.533 1.00 0.00 C ATOM 1292 OE1 GLN B 8 -2.777 -13.148 -7.784 1.00 0.00 O flip ATOM 1293 NE2 GLN B 8 -1.082 -14.192 -6.900 1.00 0.00 N flip ATOM 0 H GLN B 8 -5.333 -16.990 -7.589 1.00 0.00 H new ATOM 0 HA GLN B 8 -2.785 -18.153 -8.205 1.00 0.00 H new ATOM 0 HB2 GLN B 8 -3.788 -16.050 -6.254 1.00 0.00 H new ATOM 0 HB3 GLN B 8 -2.112 -16.560 -6.199 1.00 0.00 H new ATOM 0 HG2 GLN B 8 -1.942 -16.058 -8.699 1.00 0.00 H new ATOM 0 HG3 GLN B 8 -3.569 -15.409 -8.636 1.00 0.00 H new ATOM 0 HE21 GLN B 8 -0.562 -15.047 -6.700 1.00 0.00 H new ATOM 0 HE22 GLN B 8 -0.732 -13.293 -6.568 1.00 0.00 H new ATOM 1302 N CYS B 9 -4.181 -19.101 -5.420 1.00 0.00 N ATOM 1303 CA CYS B 9 -4.047 -20.075 -4.291 1.00 0.00 C ATOM 1304 C CYS B 9 -4.847 -21.348 -4.586 1.00 0.00 C ATOM 1305 O CYS B 9 -6.057 -21.312 -4.693 1.00 0.00 O ATOM 1306 CB CYS B 9 -4.577 -19.431 -3.015 1.00 0.00 C ATOM 1307 SG CYS B 9 -3.515 -18.217 -2.195 1.00 0.00 S ATOM 0 H CYS B 9 -5.090 -18.645 -5.497 1.00 0.00 H new ATOM 0 HA CYS B 9 -2.997 -20.340 -4.171 1.00 0.00 H new ATOM 0 HB2 CYS B 9 -5.524 -18.946 -3.250 1.00 0.00 H new ATOM 0 HB3 CYS B 9 -4.794 -20.226 -2.301 1.00 0.00 H new ATOM 1312 N ILE B 10 -4.154 -22.447 -4.709 1.00 0.00 N ATOM 1313 CA ILE B 10 -4.861 -23.730 -4.988 1.00 0.00 C ATOM 1314 C ILE B 10 -5.129 -24.470 -3.672 1.00 0.00 C ATOM 1315 O ILE B 10 -6.146 -25.115 -3.513 1.00 0.00 O ATOM 1316 CB ILE B 10 -3.990 -24.606 -5.897 1.00 0.00 C ATOM 1317 CG1 ILE B 10 -3.947 -23.994 -7.308 1.00 0.00 C ATOM 1318 CG2 ILE B 10 -4.602 -26.010 -5.968 1.00 0.00 C ATOM 1319 CD1 ILE B 10 -3.291 -22.611 -7.249 1.00 0.00 C ATOM 0 H ILE B 10 -3.139 -22.513 -4.629 1.00 0.00 H new ATOM 0 HA ILE B 10 -5.809 -23.519 -5.483 1.00 0.00 H new ATOM 0 HB ILE B 10 -2.978 -24.663 -5.497 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -3.388 -24.644 -7.980 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.957 -23.912 -7.711 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -3.990 -26.641 -6.612 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -4.640 -26.441 -4.968 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -5.611 -25.947 -6.375 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -3.262 -22.179 -8.249 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -3.869 -21.962 -6.591 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -2.275 -22.706 -6.865 1.00 0.00 H new ATOM 1331 N LYS B 11 -4.200 -24.354 -2.756 1.00 0.00 N ATOM 1332 CA LYS B 11 -4.367 -25.033 -1.434 1.00 0.00 C ATOM 1333 C LYS B 11 -3.958 -24.077 -0.306 1.00 0.00 C ATOM 1334 O LYS B 11 -3.165 -23.180 -0.513 1.00 0.00 O ATOM 1335 CB LYS B 11 -3.481 -26.276 -1.391 1.00 0.00 C ATOM 1336 CG LYS B 11 -4.363 -27.526 -1.402 1.00 0.00 C ATOM 1337 CD LYS B 11 -3.470 -28.768 -1.379 1.00 0.00 C ATOM 1338 CE LYS B 11 -3.628 -29.524 -2.701 1.00 0.00 C ATOM 1339 NZ LYS B 11 -5.018 -30.041 -2.842 1.00 0.00 N ATOM 0 H LYS B 11 -3.337 -23.821 -2.865 1.00 0.00 H new ATOM 0 HA LYS B 11 -5.410 -25.320 -1.303 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -2.806 -26.285 -2.247 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -2.860 -26.263 -0.495 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -5.028 -27.525 -0.538 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -4.994 -27.533 -2.290 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -2.429 -28.480 -1.233 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -3.743 -29.412 -0.543 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -3.393 -28.863 -3.535 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -2.920 -30.352 -2.741 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -5.010 -30.906 -3.419 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -5.405 -30.256 -1.901 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -5.611 -29.322 -3.304 1.00 0.00 H new ATOM 1353 N THR B 12 -4.504 -24.295 0.863 1.00 0.00 N ATOM 1354 CA THR B 12 -4.160 -23.401 2.014 1.00 0.00 C ATOM 1355 C THR B 12 -3.173 -24.092 2.960 1.00 0.00 C ATOM 1356 O THR B 12 -2.835 -25.246 2.780 1.00 0.00 O ATOM 1357 CB THR B 12 -5.437 -23.061 2.782 1.00 0.00 C ATOM 1358 OG1 THR B 12 -6.111 -24.307 2.940 1.00 0.00 O ATOM 1359 CG2 THR B 12 -6.377 -22.194 1.945 1.00 0.00 C ATOM 0 H THR B 12 -5.165 -25.043 1.071 1.00 0.00 H new ATOM 0 HA THR B 12 -3.697 -22.493 1.628 1.00 0.00 H new ATOM 0 HB THR B 12 -5.189 -22.540 3.707 1.00 0.00 H new ATOM 0 HG1 THR B 12 -6.948 -24.166 3.431 1.00 0.00 H new ATOM 0 HG21 THR B 12 -7.275 -21.971 2.521 1.00 0.00 H new ATOM 0 HG22 THR B 12 -5.875 -21.264 1.680 1.00 0.00 H new ATOM 0 HG23 THR B 12 -6.652 -22.729 1.036 1.00 0.00 H new ATOM 1367 N TYR B 13 -2.735 -23.363 3.951 1.00 0.00 N ATOM 1368 CA TYR B 13 -1.767 -23.945 4.927 1.00 0.00 C ATOM 1369 C TYR B 13 -2.505 -24.392 6.198 1.00 0.00 C ATOM 1370 O TYR B 13 -3.015 -23.578 6.941 1.00 0.00 O ATOM 1371 CB TYR B 13 -0.732 -22.877 5.285 1.00 0.00 C ATOM 1372 CG TYR B 13 0.585 -23.550 5.681 1.00 0.00 C ATOM 1373 CD1 TYR B 13 1.296 -24.294 4.763 1.00 0.00 C ATOM 1374 CD2 TYR B 13 1.083 -23.419 6.963 1.00 0.00 C ATOM 1375 CE1 TYR B 13 2.484 -24.900 5.120 1.00 0.00 C ATOM 1376 CE2 TYR B 13 2.271 -24.023 7.320 1.00 0.00 C ATOM 1377 CZ TYR B 13 2.981 -24.769 6.401 1.00 0.00 C ATOM 1378 OH TYR B 13 4.165 -25.379 6.759 1.00 0.00 O ATOM 0 H TYR B 13 -3.003 -22.395 4.127 1.00 0.00 H new ATOM 0 HA TYR B 13 -1.275 -24.811 4.484 1.00 0.00 H new ATOM 0 HB2 TYR B 13 -0.572 -22.213 4.436 1.00 0.00 H new ATOM 0 HB3 TYR B 13 -1.099 -22.262 6.106 1.00 0.00 H new ATOM 0 HD1 TYR B 13 0.920 -24.404 3.756 1.00 0.00 H new ATOM 0 HD2 TYR B 13 0.537 -22.839 7.692 1.00 0.00 H new ATOM 0 HE1 TYR B 13 3.029 -25.481 4.391 1.00 0.00 H new ATOM 0 HE2 TYR B 13 2.648 -23.911 8.326 1.00 0.00 H new ATOM 0 HH TYR B 13 4.365 -25.180 7.698 1.00 0.00 H new ATOM 1388 N SER B 14 -2.547 -25.681 6.418 1.00 0.00 N ATOM 1389 CA SER B 14 -3.249 -26.197 7.634 1.00 0.00 C ATOM 1390 C SER B 14 -2.253 -26.387 8.784 1.00 0.00 C ATOM 1391 O SER B 14 -2.216 -27.426 9.413 1.00 0.00 O ATOM 1392 CB SER B 14 -3.908 -27.537 7.302 1.00 0.00 C ATOM 1393 OG SER B 14 -2.870 -28.296 6.700 1.00 0.00 O ATOM 0 H SER B 14 -2.131 -26.392 5.817 1.00 0.00 H new ATOM 0 HA SER B 14 -4.006 -25.476 7.942 1.00 0.00 H new ATOM 0 HB2 SER B 14 -4.290 -28.026 8.198 1.00 0.00 H new ATOM 0 HB3 SER B 14 -4.752 -27.409 6.624 1.00 0.00 H new ATOM 0 HG SER B 14 -3.212 -29.181 6.455 1.00 0.00 H new ATOM 1399 N LYS B 15 -1.472 -25.375 9.035 1.00 0.00 N ATOM 1400 CA LYS B 15 -0.470 -25.470 10.135 1.00 0.00 C ATOM 1401 C LYS B 15 -0.273 -24.072 10.788 1.00 0.00 C ATOM 1402 O LYS B 15 0.472 -23.263 10.275 1.00 0.00 O ATOM 1403 CB LYS B 15 0.860 -25.931 9.538 1.00 0.00 C ATOM 1404 CG LYS B 15 1.116 -27.387 9.936 1.00 0.00 C ATOM 1405 CD LYS B 15 1.422 -27.457 11.434 1.00 0.00 C ATOM 1406 CE LYS B 15 2.869 -27.910 11.632 1.00 0.00 C ATOM 1407 NZ LYS B 15 3.229 -27.878 13.077 1.00 0.00 N ATOM 0 H LYS B 15 -1.483 -24.489 8.529 1.00 0.00 H new ATOM 0 HA LYS B 15 -0.816 -26.175 10.891 1.00 0.00 H new ATOM 0 HB2 LYS B 15 0.836 -25.838 8.452 1.00 0.00 H new ATOM 0 HB3 LYS B 15 1.671 -25.296 9.895 1.00 0.00 H new ATOM 0 HG2 LYS B 15 0.244 -27.998 9.703 1.00 0.00 H new ATOM 0 HG3 LYS B 15 1.951 -27.791 9.364 1.00 0.00 H new ATOM 0 HD2 LYS B 15 1.268 -26.481 11.895 1.00 0.00 H new ATOM 0 HD3 LYS B 15 0.741 -28.152 11.924 1.00 0.00 H new ATOM 0 HE2 LYS B 15 2.998 -28.919 11.241 1.00 0.00 H new ATOM 0 HE3 LYS B 15 3.540 -27.262 11.069 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 4.214 -28.188 13.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 3.125 -26.909 13.439 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 2.599 -28.515 13.606 1.00 0.00 H new ATOM 1421 N PRO B 16 -0.944 -23.807 11.914 1.00 0.00 N ATOM 1422 CA PRO B 16 -0.827 -22.497 12.577 1.00 0.00 C ATOM 1423 C PRO B 16 0.629 -22.180 12.939 1.00 0.00 C ATOM 1424 O PRO B 16 1.376 -23.049 13.343 1.00 0.00 O ATOM 1425 CB PRO B 16 -1.694 -22.600 13.836 1.00 0.00 C ATOM 1426 CG PRO B 16 -2.447 -23.962 13.767 1.00 0.00 C ATOM 1427 CD PRO B 16 -1.842 -24.759 12.599 1.00 0.00 C ATOM 0 HA PRO B 16 -1.155 -21.689 11.923 1.00 0.00 H new ATOM 0 HB2 PRO B 16 -1.077 -22.546 14.733 1.00 0.00 H new ATOM 0 HB3 PRO B 16 -2.401 -21.772 13.885 1.00 0.00 H new ATOM 0 HG2 PRO B 16 -2.338 -24.509 14.703 1.00 0.00 H new ATOM 0 HG3 PRO B 16 -3.514 -23.804 13.613 1.00 0.00 H new ATOM 0 HD2 PRO B 16 -1.294 -25.631 12.957 1.00 0.00 H new ATOM 0 HD3 PRO B 16 -2.618 -25.124 11.926 1.00 0.00 H new ATOM 1435 N PHE B 17 0.996 -20.930 12.780 1.00 0.00 N ATOM 1436 CA PHE B 17 2.395 -20.522 13.106 1.00 0.00 C ATOM 1437 C PHE B 17 2.402 -19.167 13.831 1.00 0.00 C ATOM 1438 O PHE B 17 1.381 -18.710 14.307 1.00 0.00 O ATOM 1439 CB PHE B 17 3.206 -20.424 11.812 1.00 0.00 C ATOM 1440 CG PHE B 17 2.461 -19.546 10.806 1.00 0.00 C ATOM 1441 CD1 PHE B 17 2.615 -18.172 10.826 1.00 0.00 C ATOM 1442 CD2 PHE B 17 1.626 -20.115 9.862 1.00 0.00 C ATOM 1443 CE1 PHE B 17 1.945 -17.381 9.917 1.00 0.00 C ATOM 1444 CE2 PHE B 17 0.955 -19.322 8.954 1.00 0.00 C ATOM 1445 CZ PHE B 17 1.115 -17.956 8.982 1.00 0.00 C ATOM 0 H PHE B 17 0.391 -20.182 12.441 1.00 0.00 H new ATOM 0 HA PHE B 17 2.841 -21.268 13.763 1.00 0.00 H new ATOM 0 HB2 PHE B 17 4.190 -20.003 12.019 1.00 0.00 H new ATOM 0 HB3 PHE B 17 3.365 -21.418 11.395 1.00 0.00 H new ATOM 0 HD1 PHE B 17 3.264 -17.716 11.558 1.00 0.00 H new ATOM 0 HD2 PHE B 17 1.498 -21.187 9.835 1.00 0.00 H new ATOM 0 HE1 PHE B 17 2.072 -16.309 9.939 1.00 0.00 H new ATOM 0 HE2 PHE B 17 0.304 -19.774 8.221 1.00 0.00 H new ATOM 0 HZ PHE B 17 0.590 -17.336 8.271 1.00 0.00 H new ATOM 1455 N HIS B 18 3.559 -18.561 13.892 1.00 0.00 N ATOM 1456 CA HIS B 18 3.686 -17.241 14.596 1.00 0.00 C ATOM 1457 C HIS B 18 4.035 -16.115 13.579 1.00 0.00 C ATOM 1458 O HIS B 18 4.813 -16.339 12.672 1.00 0.00 O ATOM 1459 CB HIS B 18 4.838 -17.376 15.600 1.00 0.00 C ATOM 1460 CG HIS B 18 4.843 -16.188 16.550 1.00 0.00 C ATOM 1461 ND1 HIS B 18 5.320 -14.990 16.257 1.00 0.00 N ATOM 1462 CD2 HIS B 18 4.361 -16.106 17.850 1.00 0.00 C ATOM 1463 CE1 HIS B 18 5.149 -14.221 17.286 1.00 0.00 C ATOM 1464 NE2 HIS B 18 4.583 -14.884 18.222 1.00 0.00 N ATOM 0 H HIS B 18 4.424 -18.919 13.486 1.00 0.00 H new ATOM 0 HA HIS B 18 2.748 -16.984 15.088 1.00 0.00 H new ATOM 0 HB2 HIS B 18 4.733 -18.303 16.164 1.00 0.00 H new ATOM 0 HB3 HIS B 18 5.789 -17.432 15.070 1.00 0.00 H new ATOM 0 HD2 HIS B 18 3.899 -16.893 18.428 1.00 0.00 H new ATOM 0 HE1 HIS B 18 5.439 -13.182 17.344 1.00 0.00 H new ATOM 0 HE2 HIS B 18 4.339 -14.503 19.136 1.00 0.00 H new ATOM 1472 N PRO B 19 3.459 -14.912 13.741 1.00 0.00 N ATOM 1473 CA PRO B 19 3.767 -13.801 12.827 1.00 0.00 C ATOM 1474 C PRO B 19 5.271 -13.514 12.849 1.00 0.00 C ATOM 1475 O PRO B 19 5.786 -12.773 12.035 1.00 0.00 O ATOM 1476 CB PRO B 19 2.989 -12.597 13.370 1.00 0.00 C ATOM 1477 CG PRO B 19 2.231 -13.070 14.644 1.00 0.00 C ATOM 1478 CD PRO B 19 2.491 -14.573 14.807 1.00 0.00 C ATOM 0 HA PRO B 19 3.491 -14.028 11.797 1.00 0.00 H new ATOM 0 HB2 PRO B 19 3.667 -11.778 13.609 1.00 0.00 H new ATOM 0 HB3 PRO B 19 2.289 -12.224 12.623 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.578 -12.524 15.521 1.00 0.00 H new ATOM 0 HG3 PRO B 19 1.163 -12.874 14.549 1.00 0.00 H new ATOM 0 HD2 PRO B 19 2.895 -14.799 15.794 1.00 0.00 H new ATOM 0 HD3 PRO B 19 1.570 -15.147 14.701 1.00 0.00 H new ATOM 1486 N LYS B 20 5.934 -14.118 13.793 1.00 0.00 N ATOM 1487 CA LYS B 20 7.404 -13.918 13.928 1.00 0.00 C ATOM 1488 C LYS B 20 8.140 -14.499 12.714 1.00 0.00 C ATOM 1489 O LYS B 20 9.313 -14.250 12.522 1.00 0.00 O ATOM 1490 CB LYS B 20 7.851 -14.619 15.204 1.00 0.00 C ATOM 1491 CG LYS B 20 9.372 -14.755 15.242 1.00 0.00 C ATOM 1492 CD LYS B 20 9.781 -15.207 16.646 1.00 0.00 C ATOM 1493 CE LYS B 20 10.805 -16.337 16.532 1.00 0.00 C ATOM 1494 NZ LYS B 20 12.006 -15.878 15.777 1.00 0.00 N ATOM 0 H LYS B 20 5.519 -14.746 14.482 1.00 0.00 H new ATOM 0 HA LYS B 20 7.637 -12.854 13.976 1.00 0.00 H new ATOM 0 HB2 LYS B 20 7.510 -14.056 16.073 1.00 0.00 H new ATOM 0 HB3 LYS B 20 7.391 -15.606 15.263 1.00 0.00 H new ATOM 0 HG2 LYS B 20 9.707 -15.478 14.498 1.00 0.00 H new ATOM 0 HG3 LYS B 20 9.844 -13.804 14.997 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.205 -14.370 17.201 1.00 0.00 H new ATOM 0 HD3 LYS B 20 8.907 -15.547 17.201 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.099 -16.671 17.527 1.00 0.00 H new ATOM 0 HE3 LYS B 20 10.356 -17.193 16.028 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 12.809 -16.504 15.989 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 11.806 -15.905 14.757 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 12.242 -14.905 16.058 1.00 0.00 H new ATOM 1508 N PHE B 21 7.429 -15.259 11.922 1.00 0.00 N ATOM 1509 CA PHE B 21 8.067 -15.872 10.713 1.00 0.00 C ATOM 1510 C PHE B 21 7.626 -15.130 9.446 1.00 0.00 C ATOM 1511 O PHE B 21 8.134 -15.379 8.369 1.00 0.00 O ATOM 1512 CB PHE B 21 7.636 -17.336 10.620 1.00 0.00 C ATOM 1513 CG PHE B 21 8.306 -18.131 11.742 1.00 0.00 C ATOM 1514 CD1 PHE B 21 9.656 -18.435 11.678 1.00 0.00 C ATOM 1515 CD2 PHE B 21 7.573 -18.555 12.836 1.00 0.00 C ATOM 1516 CE1 PHE B 21 10.258 -19.151 12.692 1.00 0.00 C ATOM 1517 CE2 PHE B 21 8.178 -19.272 13.848 1.00 0.00 C ATOM 1518 CZ PHE B 21 9.520 -19.568 13.776 1.00 0.00 C ATOM 0 H PHE B 21 6.443 -15.482 12.056 1.00 0.00 H new ATOM 0 HA PHE B 21 9.151 -15.802 10.800 1.00 0.00 H new ATOM 0 HB2 PHE B 21 6.552 -17.414 10.701 1.00 0.00 H new ATOM 0 HB3 PHE B 21 7.914 -17.748 9.650 1.00 0.00 H new ATOM 0 HD1 PHE B 21 10.240 -18.110 10.830 1.00 0.00 H new ATOM 0 HD2 PHE B 21 6.520 -18.323 12.898 1.00 0.00 H new ATOM 0 HE1 PHE B 21 11.311 -19.385 12.635 1.00 0.00 H new ATOM 0 HE2 PHE B 21 7.598 -19.601 14.697 1.00 0.00 H new ATOM 0 HZ PHE B 21 9.994 -20.127 14.569 1.00 0.00 H new ATOM 1528 N ILE B 22 6.695 -14.232 9.605 1.00 0.00 N ATOM 1529 CA ILE B 22 6.201 -13.469 8.423 1.00 0.00 C ATOM 1530 C ILE B 22 6.935 -12.137 8.299 1.00 0.00 C ATOM 1531 O ILE B 22 7.139 -11.445 9.279 1.00 0.00 O ATOM 1532 CB ILE B 22 4.700 -13.203 8.600 1.00 0.00 C ATOM 1533 CG1 ILE B 22 3.976 -14.523 8.930 1.00 0.00 C ATOM 1534 CG2 ILE B 22 4.116 -12.582 7.313 1.00 0.00 C ATOM 1535 CD1 ILE B 22 4.274 -15.575 7.859 1.00 0.00 C ATOM 0 H ILE B 22 6.257 -13.994 10.495 1.00 0.00 H new ATOM 0 HA ILE B 22 6.382 -14.053 7.520 1.00 0.00 H new ATOM 0 HB ILE B 22 4.555 -12.502 9.422 1.00 0.00 H new ATOM 0 HG12 ILE B 22 4.296 -14.887 9.906 1.00 0.00 H new ATOM 0 HG13 ILE B 22 2.901 -14.351 8.991 1.00 0.00 H new ATOM 0 HG21 ILE B 22 3.050 -12.397 7.449 1.00 0.00 H new ATOM 0 HG22 ILE B 22 4.623 -11.641 7.101 1.00 0.00 H new ATOM 0 HG23 ILE B 22 4.261 -13.269 6.479 1.00 0.00 H new ATOM 0 HD11 ILE B 22 3.756 -16.502 8.105 1.00 0.00 H new ATOM 0 HD12 ILE B 22 3.931 -15.214 6.889 1.00 0.00 H new ATOM 0 HD13 ILE B 22 5.348 -15.759 7.819 1.00 0.00 H new ATOM 1547 N LYS B 23 7.320 -11.814 7.090 1.00 0.00 N ATOM 1548 CA LYS B 23 8.029 -10.531 6.852 1.00 0.00 C ATOM 1549 C LYS B 23 7.318 -9.737 5.762 1.00 0.00 C ATOM 1550 O LYS B 23 7.482 -8.537 5.662 1.00 0.00 O ATOM 1551 CB LYS B 23 9.467 -10.809 6.429 1.00 0.00 C ATOM 1552 CG LYS B 23 10.309 -11.090 7.674 1.00 0.00 C ATOM 1553 CD LYS B 23 10.895 -9.775 8.192 1.00 0.00 C ATOM 1554 CE LYS B 23 11.581 -10.025 9.536 1.00 0.00 C ATOM 1555 NZ LYS B 23 12.457 -11.229 9.457 1.00 0.00 N ATOM 0 H LYS B 23 7.171 -12.388 6.260 1.00 0.00 H new ATOM 0 HA LYS B 23 8.030 -9.949 7.774 1.00 0.00 H new ATOM 0 HB2 LYS B 23 9.501 -11.662 5.751 1.00 0.00 H new ATOM 0 HB3 LYS B 23 9.871 -9.954 5.887 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.696 -11.557 8.445 1.00 0.00 H new ATOM 0 HG3 LYS B 23 11.110 -11.790 7.436 1.00 0.00 H new ATOM 0 HD2 LYS B 23 11.610 -9.374 7.474 1.00 0.00 H new ATOM 0 HD3 LYS B 23 10.106 -9.031 8.305 1.00 0.00 H new ATOM 0 HE2 LYS B 23 12.174 -9.154 9.816 1.00 0.00 H new ATOM 0 HE3 LYS B 23 10.831 -10.164 10.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 13.179 -11.183 10.205 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 11.881 -12.086 9.584 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 12.923 -11.259 8.528 1.00 0.00 H new ATOM 1569 N GLU B 24 6.543 -10.420 4.961 1.00 0.00 N ATOM 1570 CA GLU B 24 5.811 -9.695 3.876 1.00 0.00 C ATOM 1571 C GLU B 24 4.438 -10.335 3.647 1.00 0.00 C ATOM 1572 O GLU B 24 4.336 -11.509 3.349 1.00 0.00 O ATOM 1573 CB GLU B 24 6.643 -9.742 2.591 1.00 0.00 C ATOM 1574 CG GLU B 24 5.716 -9.628 1.374 1.00 0.00 C ATOM 1575 CD GLU B 24 6.537 -9.210 0.152 1.00 0.00 C ATOM 1576 OE1 GLU B 24 7.726 -9.478 0.181 1.00 0.00 O ATOM 1577 OE2 GLU B 24 5.926 -8.646 -0.741 1.00 0.00 O ATOM 0 H GLU B 24 6.386 -11.427 5.006 1.00 0.00 H new ATOM 0 HA GLU B 24 5.659 -8.656 4.169 1.00 0.00 H new ATOM 0 HB2 GLU B 24 7.369 -8.929 2.586 1.00 0.00 H new ATOM 0 HB3 GLU B 24 7.208 -10.673 2.545 1.00 0.00 H new ATOM 0 HG2 GLU B 24 5.223 -10.582 1.187 1.00 0.00 H new ATOM 0 HG3 GLU B 24 4.931 -8.897 1.567 1.00 0.00 H new ATOM 1584 N LEU B 25 3.408 -9.539 3.795 1.00 0.00 N ATOM 1585 CA LEU B 25 2.026 -10.065 3.599 1.00 0.00 C ATOM 1586 C LEU B 25 1.490 -9.630 2.232 1.00 0.00 C ATOM 1587 O LEU B 25 1.903 -8.622 1.694 1.00 0.00 O ATOM 1588 CB LEU B 25 1.126 -9.510 4.706 1.00 0.00 C ATOM 1589 CG LEU B 25 -0.108 -10.401 4.853 1.00 0.00 C ATOM 1590 CD1 LEU B 25 0.191 -11.518 5.855 1.00 0.00 C ATOM 1591 CD2 LEU B 25 -1.278 -9.561 5.370 1.00 0.00 C ATOM 0 H LEU B 25 3.466 -8.551 4.042 1.00 0.00 H new ATOM 0 HA LEU B 25 2.038 -11.154 3.641 1.00 0.00 H new ATOM 0 HB2 LEU B 25 1.673 -9.469 5.648 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.825 -8.490 4.468 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.364 -10.834 3.886 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.687 -12.155 5.962 1.00 0.00 H new ATOM 0 HD12 LEU B 25 1.030 -12.114 5.496 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.443 -11.082 6.822 1.00 0.00 H new ATOM 0 HD21 LEU B 25 -2.160 -10.192 5.476 1.00 0.00 H new ATOM 0 HD22 LEU B 25 -1.019 -9.133 6.339 1.00 0.00 H new ATOM 0 HD23 LEU B 25 -1.489 -8.758 4.664 1.00 0.00 H new ATOM 1603 N ARG B 26 0.582 -10.399 1.699 1.00 0.00 N ATOM 1604 CA ARG B 26 0.013 -10.043 0.366 1.00 0.00 C ATOM 1605 C ARG B 26 -1.447 -10.488 0.271 1.00 0.00 C ATOM 1606 O ARG B 26 -1.745 -11.664 0.354 1.00 0.00 O ATOM 1607 CB ARG B 26 0.822 -10.734 -0.718 1.00 0.00 C ATOM 1608 CG ARG B 26 2.254 -10.193 -0.718 1.00 0.00 C ATOM 1609 CD ARG B 26 2.939 -10.600 -2.025 1.00 0.00 C ATOM 1610 NE ARG B 26 2.598 -12.016 -2.336 1.00 0.00 N ATOM 1611 CZ ARG B 26 2.766 -12.462 -3.554 1.00 0.00 C ATOM 1612 NH1 ARG B 26 1.831 -12.246 -4.440 1.00 0.00 N ATOM 1613 NH2 ARG B 26 3.867 -13.106 -3.843 1.00 0.00 N ATOM 0 H ARG B 26 0.211 -11.250 2.122 1.00 0.00 H new ATOM 0 HA ARG B 26 0.058 -8.962 0.237 1.00 0.00 H new ATOM 0 HB2 ARG B 26 0.830 -11.811 -0.549 1.00 0.00 H new ATOM 0 HB3 ARG B 26 0.360 -10.568 -1.691 1.00 0.00 H new ATOM 0 HG2 ARG B 26 2.247 -9.108 -0.619 1.00 0.00 H new ATOM 0 HG3 ARG B 26 2.806 -10.587 0.135 1.00 0.00 H new ATOM 0 HD2 ARG B 26 2.616 -9.949 -2.837 1.00 0.00 H new ATOM 0 HD3 ARG B 26 4.019 -10.485 -1.935 1.00 0.00 H new ATOM 0 HE ARG B 26 2.237 -12.631 -1.607 1.00 0.00 H new ATOM 0 HH11 ARG B 26 0.987 -11.737 -4.177 1.00 0.00 H new ATOM 0 HH12 ARG B 26 1.945 -12.586 -5.395 1.00 0.00 H new ATOM 0 HH21 ARG B 26 4.576 -13.253 -3.124 1.00 0.00 H new ATOM 0 HH22 ARG B 26 4.017 -13.462 -4.787 1.00 0.00 H new ATOM 1627 N VAL B 27 -2.325 -9.533 0.095 1.00 0.00 N ATOM 1628 CA VAL B 27 -3.779 -9.866 -0.013 1.00 0.00 C ATOM 1629 C VAL B 27 -4.269 -9.601 -1.439 1.00 0.00 C ATOM 1630 O VAL B 27 -4.055 -8.534 -1.979 1.00 0.00 O ATOM 1631 CB VAL B 27 -4.562 -8.996 0.968 1.00 0.00 C ATOM 1632 CG1 VAL B 27 -6.021 -9.461 1.002 1.00 0.00 C ATOM 1633 CG2 VAL B 27 -3.954 -9.145 2.365 1.00 0.00 C ATOM 0 H VAL B 27 -2.100 -8.541 0.022 1.00 0.00 H new ATOM 0 HA VAL B 27 -3.931 -10.919 0.224 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.516 -7.953 0.654 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -6.584 -8.843 1.701 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -6.455 -9.370 0.006 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -6.064 -10.502 1.323 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -4.508 -8.526 3.071 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -4.008 -10.188 2.676 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -2.912 -8.827 2.344 1.00 0.00 H new ATOM 1643 N ILE B 28 -4.919 -10.584 -2.016 1.00 0.00 N ATOM 1644 CA ILE B 28 -5.433 -10.420 -3.412 1.00 0.00 C ATOM 1645 C ILE B 28 -6.944 -10.670 -3.450 1.00 0.00 C ATOM 1646 O ILE B 28 -7.403 -11.762 -3.179 1.00 0.00 O ATOM 1647 CB ILE B 28 -4.720 -11.423 -4.326 1.00 0.00 C ATOM 1648 CG1 ILE B 28 -3.306 -10.915 -4.624 1.00 0.00 C ATOM 1649 CG2 ILE B 28 -5.494 -11.561 -5.640 1.00 0.00 C ATOM 1650 CD1 ILE B 28 -2.355 -12.108 -4.729 1.00 0.00 C ATOM 0 H ILE B 28 -5.115 -11.487 -1.584 1.00 0.00 H new ATOM 0 HA ILE B 28 -5.238 -9.403 -3.754 1.00 0.00 H new ATOM 0 HB ILE B 28 -4.669 -12.393 -3.832 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -3.299 -10.346 -5.554 1.00 0.00 H new ATOM 0 HG13 ILE B 28 -2.975 -10.239 -3.835 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -4.986 -12.274 -6.289 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -6.504 -11.915 -5.432 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -5.544 -10.592 -6.136 1.00 0.00 H new ATOM 0 HD11 ILE B 28 -1.347 -11.752 -4.941 1.00 0.00 H new ATOM 0 HD12 ILE B 28 -2.355 -12.657 -3.788 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -2.684 -12.766 -5.533 1.00 0.00 H new ATOM 1662 N GLU B 29 -7.681 -9.648 -3.784 1.00 0.00 N ATOM 1663 CA GLU B 29 -9.163 -9.798 -3.846 1.00 0.00 C ATOM 1664 C GLU B 29 -9.565 -10.516 -5.142 1.00 0.00 C ATOM 1665 O GLU B 29 -8.761 -10.671 -6.040 1.00 0.00 O ATOM 1666 CB GLU B 29 -9.799 -8.406 -3.806 1.00 0.00 C ATOM 1667 CG GLU B 29 -11.317 -8.532 -3.957 1.00 0.00 C ATOM 1668 CD GLU B 29 -11.984 -7.249 -3.451 1.00 0.00 C ATOM 1669 OE1 GLU B 29 -12.158 -7.168 -2.247 1.00 0.00 O ATOM 1670 OE2 GLU B 29 -12.282 -6.424 -4.300 1.00 0.00 O ATOM 0 H GLU B 29 -7.325 -8.721 -4.016 1.00 0.00 H new ATOM 0 HA GLU B 29 -9.509 -10.390 -2.998 1.00 0.00 H new ATOM 0 HB2 GLU B 29 -9.557 -7.911 -2.866 1.00 0.00 H new ATOM 0 HB3 GLU B 29 -9.394 -7.787 -4.606 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -11.577 -8.703 -5.002 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -11.680 -9.391 -3.393 1.00 0.00 H new ATOM 1677 N SER B 30 -10.800 -10.944 -5.203 1.00 0.00 N ATOM 1678 CA SER B 30 -11.279 -11.654 -6.431 1.00 0.00 C ATOM 1679 C SER B 30 -10.753 -10.964 -7.691 1.00 0.00 C ATOM 1680 O SER B 30 -11.014 -9.798 -7.916 1.00 0.00 O ATOM 1681 CB SER B 30 -12.806 -11.640 -6.446 1.00 0.00 C ATOM 1682 OG SER B 30 -13.142 -10.272 -6.261 1.00 0.00 O ATOM 0 H SER B 30 -11.494 -10.835 -4.463 1.00 0.00 H new ATOM 0 HA SER B 30 -10.910 -12.680 -6.416 1.00 0.00 H new ATOM 0 HB2 SER B 30 -13.199 -12.023 -7.388 1.00 0.00 H new ATOM 0 HB3 SER B 30 -13.218 -12.263 -5.652 1.00 0.00 H new ATOM 0 HG SER B 30 -12.559 -9.714 -6.816 1.00 0.00 H new ATOM 1688 N GLY B 31 -10.022 -11.709 -8.483 1.00 0.00 N ATOM 1689 CA GLY B 31 -9.458 -11.134 -9.741 1.00 0.00 C ATOM 1690 C GLY B 31 -10.037 -11.866 -10.961 1.00 0.00 C ATOM 1691 O GLY B 31 -10.945 -12.666 -10.838 1.00 0.00 O ATOM 0 H GLY B 31 -9.792 -12.688 -8.312 1.00 0.00 H new ATOM 0 HA2 GLY B 31 -9.691 -10.071 -9.801 1.00 0.00 H new ATOM 0 HA3 GLY B 31 -8.372 -11.223 -9.736 1.00 0.00 H new ATOM 1695 N PRO B 32 -9.489 -11.571 -12.119 1.00 0.00 N ATOM 1696 CA PRO B 32 -9.944 -12.190 -13.372 1.00 0.00 C ATOM 1697 C PRO B 32 -9.582 -13.676 -13.386 1.00 0.00 C ATOM 1698 O PRO B 32 -9.889 -14.387 -14.323 1.00 0.00 O ATOM 1699 CB PRO B 32 -9.192 -11.446 -14.481 1.00 0.00 C ATOM 1700 CG PRO B 32 -8.219 -10.440 -13.788 1.00 0.00 C ATOM 1701 CD PRO B 32 -8.387 -10.613 -12.267 1.00 0.00 C ATOM 0 HA PRO B 32 -11.025 -12.122 -13.497 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -8.639 -12.146 -15.107 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -9.890 -10.919 -15.132 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -7.189 -10.635 -14.085 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -8.448 -9.417 -14.086 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -7.472 -10.988 -11.808 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -8.620 -9.664 -11.784 1.00 0.00 H new ATOM 1709 N HIS B 33 -8.931 -14.100 -12.338 1.00 0.00 N ATOM 1710 CA HIS B 33 -8.517 -15.530 -12.238 1.00 0.00 C ATOM 1711 C HIS B 33 -9.233 -16.201 -11.065 1.00 0.00 C ATOM 1712 O HIS B 33 -9.359 -17.408 -11.021 1.00 0.00 O ATOM 1713 CB HIS B 33 -7.016 -15.583 -11.992 1.00 0.00 C ATOM 1714 CG HIS B 33 -6.733 -15.067 -10.581 1.00 0.00 C ATOM 1715 ND1 HIS B 33 -7.223 -13.979 -10.077 1.00 0.00 N ATOM 1716 CD2 HIS B 33 -5.955 -15.623 -9.566 1.00 0.00 C ATOM 1717 CE1 HIS B 33 -6.828 -13.818 -8.870 1.00 0.00 C ATOM 1718 NE2 HIS B 33 -6.054 -14.807 -8.531 1.00 0.00 N ATOM 0 H HIS B 33 -8.667 -13.517 -11.544 1.00 0.00 H new ATOM 0 HA HIS B 33 -8.775 -16.049 -13.161 1.00 0.00 H new ATOM 0 HB2 HIS B 33 -6.651 -16.604 -12.101 1.00 0.00 H new ATOM 0 HB3 HIS B 33 -6.490 -14.976 -12.729 1.00 0.00 H new ATOM 0 HD2 HIS B 33 -5.385 -16.539 -9.616 1.00 0.00 H new ATOM 0 HE1 HIS B 33 -7.096 -12.989 -8.232 1.00 0.00 H new ATOM 0 HE2 HIS B 33 -5.602 -14.931 -7.625 1.00 0.00 H new ATOM 1726 N CYS B 34 -9.682 -15.396 -10.137 1.00 0.00 N ATOM 1727 CA CYS B 34 -10.381 -15.964 -8.947 1.00 0.00 C ATOM 1728 C CYS B 34 -11.606 -15.111 -8.587 1.00 0.00 C ATOM 1729 O CYS B 34 -11.556 -13.897 -8.631 1.00 0.00 O ATOM 1730 CB CYS B 34 -9.405 -15.984 -7.770 1.00 0.00 C ATOM 1731 SG CYS B 34 -9.625 -17.281 -6.528 1.00 0.00 S ATOM 0 H CYS B 34 -9.596 -14.380 -10.151 1.00 0.00 H new ATOM 0 HA CYS B 34 -10.719 -16.975 -9.174 1.00 0.00 H new ATOM 0 HB2 CYS B 34 -8.395 -16.070 -8.171 1.00 0.00 H new ATOM 0 HB3 CYS B 34 -9.467 -15.020 -7.265 1.00 0.00 H new ATOM 1736 N ALA B 35 -12.679 -15.771 -8.237 1.00 0.00 N ATOM 1737 CA ALA B 35 -13.921 -15.030 -7.872 1.00 0.00 C ATOM 1738 C ALA B 35 -14.065 -14.957 -6.347 1.00 0.00 C ATOM 1739 O ALA B 35 -15.160 -14.893 -5.826 1.00 0.00 O ATOM 1740 CB ALA B 35 -15.127 -15.760 -8.463 1.00 0.00 C ATOM 0 H ALA B 35 -12.748 -16.787 -8.188 1.00 0.00 H new ATOM 0 HA ALA B 35 -13.866 -14.016 -8.269 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -16.040 -15.225 -8.201 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -15.030 -15.803 -9.548 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -15.172 -16.773 -8.062 1.00 0.00 H new ATOM 1746 N ASN B 36 -12.951 -14.970 -5.668 1.00 0.00 N ATOM 1747 CA ASN B 36 -12.997 -14.909 -4.174 1.00 0.00 C ATOM 1748 C ASN B 36 -11.858 -14.043 -3.638 1.00 0.00 C ATOM 1749 O ASN B 36 -11.505 -13.046 -4.223 1.00 0.00 O ATOM 1750 CB ASN B 36 -12.865 -16.328 -3.620 1.00 0.00 C ATOM 1751 CG ASN B 36 -13.892 -17.231 -4.307 1.00 0.00 C ATOM 1752 OD1 ASN B 36 -15.079 -17.134 -4.068 1.00 0.00 O ATOM 1753 ND2 ASN B 36 -13.478 -18.120 -5.167 1.00 0.00 N ATOM 0 H ASN B 36 -12.017 -15.020 -6.076 1.00 0.00 H new ATOM 0 HA ASN B 36 -13.943 -14.468 -3.861 1.00 0.00 H new ATOM 0 HB2 ASN B 36 -11.857 -16.706 -3.791 1.00 0.00 H new ATOM 0 HB3 ASN B 36 -13.026 -16.327 -2.542 1.00 0.00 H new ATOM 0 HD21 ASN B 36 -14.150 -18.729 -5.635 1.00 0.00 H new ATOM 0 HD22 ASN B 36 -12.483 -18.206 -5.372 1.00 0.00 H new ATOM 1760 N THR B 37 -11.334 -14.439 -2.522 1.00 0.00 N ATOM 1761 CA THR B 37 -10.201 -13.671 -1.913 1.00 0.00 C ATOM 1762 C THR B 37 -9.054 -14.624 -1.559 1.00 0.00 C ATOM 1763 O THR B 37 -9.258 -15.620 -0.891 1.00 0.00 O ATOM 1764 CB THR B 37 -10.695 -12.959 -0.656 1.00 0.00 C ATOM 1765 OG1 THR B 37 -10.892 -11.608 -1.063 1.00 0.00 O ATOM 1766 CG2 THR B 37 -9.620 -12.897 0.433 1.00 0.00 C ATOM 0 H THR B 37 -11.634 -15.260 -1.997 1.00 0.00 H new ATOM 0 HA THR B 37 -9.835 -12.934 -2.628 1.00 0.00 H new ATOM 0 HB THR B 37 -11.571 -13.475 -0.263 1.00 0.00 H new ATOM 0 HG1 THR B 37 -11.383 -11.125 -0.366 1.00 0.00 H new ATOM 0 HG21 THR B 37 -10.017 -12.382 1.308 1.00 0.00 H new ATOM 0 HG22 THR B 37 -9.325 -13.909 0.711 1.00 0.00 H new ATOM 0 HG23 THR B 37 -8.752 -12.356 0.057 1.00 0.00 H new ATOM 1774 N GLU B 38 -7.873 -14.289 -2.016 1.00 0.00 N ATOM 1775 CA GLU B 38 -6.689 -15.155 -1.729 1.00 0.00 C ATOM 1776 C GLU B 38 -5.662 -14.389 -0.891 1.00 0.00 C ATOM 1777 O GLU B 38 -5.052 -13.448 -1.359 1.00 0.00 O ATOM 1778 CB GLU B 38 -6.049 -15.571 -3.052 1.00 0.00 C ATOM 1779 CG GLU B 38 -7.112 -16.224 -3.939 1.00 0.00 C ATOM 1780 CD GLU B 38 -7.311 -15.377 -5.197 1.00 0.00 C ATOM 1781 OE1 GLU B 38 -7.886 -14.312 -5.047 1.00 0.00 O ATOM 1782 OE2 GLU B 38 -6.877 -15.844 -6.238 1.00 0.00 O ATOM 0 H GLU B 38 -7.678 -13.457 -2.573 1.00 0.00 H new ATOM 0 HA GLU B 38 -7.013 -16.034 -1.173 1.00 0.00 H new ATOM 0 HB2 GLU B 38 -5.623 -14.702 -3.553 1.00 0.00 H new ATOM 0 HB3 GLU B 38 -5.230 -16.268 -2.871 1.00 0.00 H new ATOM 0 HG2 GLU B 38 -6.805 -17.234 -4.211 1.00 0.00 H new ATOM 0 HG3 GLU B 38 -8.052 -16.313 -3.394 1.00 0.00 H new ATOM 1789 N ILE B 39 -5.494 -14.808 0.333 1.00 0.00 N ATOM 1790 CA ILE B 39 -4.507 -14.115 1.210 1.00 0.00 C ATOM 1791 C ILE B 39 -3.138 -14.792 1.094 1.00 0.00 C ATOM 1792 O ILE B 39 -2.865 -15.763 1.770 1.00 0.00 O ATOM 1793 CB ILE B 39 -4.986 -14.177 2.664 1.00 0.00 C ATOM 1794 CG1 ILE B 39 -6.445 -13.713 2.731 1.00 0.00 C ATOM 1795 CG2 ILE B 39 -4.119 -13.248 3.525 1.00 0.00 C ATOM 1796 CD1 ILE B 39 -6.832 -13.483 4.194 1.00 0.00 C ATOM 0 H ILE B 39 -5.990 -15.590 0.760 1.00 0.00 H new ATOM 0 HA ILE B 39 -4.418 -13.075 0.897 1.00 0.00 H new ATOM 0 HB ILE B 39 -4.906 -15.199 3.035 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -6.574 -12.794 2.159 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -7.098 -14.461 2.283 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -4.458 -13.290 4.560 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -3.078 -13.567 3.470 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -4.204 -12.226 3.157 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -7.869 -13.153 4.248 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -6.718 -14.413 4.751 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -6.185 -12.719 4.626 1.00 0.00 H new ATOM 1808 N ILE B 40 -2.306 -14.263 0.241 1.00 0.00 N ATOM 1809 CA ILE B 40 -0.952 -14.865 0.079 1.00 0.00 C ATOM 1810 C ILE B 40 0.025 -14.213 1.063 1.00 0.00 C ATOM 1811 O ILE B 40 -0.041 -13.024 1.310 1.00 0.00 O ATOM 1812 CB ILE B 40 -0.469 -14.643 -1.358 1.00 0.00 C ATOM 1813 CG1 ILE B 40 -1.580 -15.056 -2.327 1.00 0.00 C ATOM 1814 CG2 ILE B 40 0.773 -15.502 -1.616 1.00 0.00 C ATOM 1815 CD1 ILE B 40 -1.029 -15.053 -3.756 1.00 0.00 C ATOM 0 H ILE B 40 -2.500 -13.451 -0.344 1.00 0.00 H new ATOM 0 HA ILE B 40 -1.001 -15.934 0.284 1.00 0.00 H new ATOM 0 HB ILE B 40 -0.221 -13.592 -1.505 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -1.953 -16.048 -2.070 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -2.422 -14.369 -2.248 1.00 0.00 H new ATOM 0 HG21 ILE B 40 1.118 -15.345 -2.638 1.00 0.00 H new ATOM 0 HG22 ILE B 40 1.562 -15.219 -0.919 1.00 0.00 H new ATOM 0 HG23 ILE B 40 0.524 -16.554 -1.474 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -1.816 -15.347 -4.450 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -0.677 -14.053 -4.008 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -0.201 -15.758 -3.828 1.00 0.00 H new ATOM 1827 N VAL B 41 0.908 -15.012 1.602 1.00 0.00 N ATOM 1828 CA VAL B 41 1.898 -14.479 2.585 1.00 0.00 C ATOM 1829 C VAL B 41 3.314 -14.919 2.194 1.00 0.00 C ATOM 1830 O VAL B 41 3.481 -15.805 1.379 1.00 0.00 O ATOM 1831 CB VAL B 41 1.549 -15.030 3.966 1.00 0.00 C ATOM 1832 CG1 VAL B 41 1.396 -16.551 3.876 1.00 0.00 C ATOM 1833 CG2 VAL B 41 2.667 -14.697 4.947 1.00 0.00 C ATOM 0 H VAL B 41 0.987 -16.010 1.405 1.00 0.00 H new ATOM 0 HA VAL B 41 1.863 -13.390 2.595 1.00 0.00 H new ATOM 0 HB VAL B 41 0.617 -14.582 4.311 1.00 0.00 H new ATOM 0 HG11 VAL B 41 1.147 -16.950 4.859 1.00 0.00 H new ATOM 0 HG12 VAL B 41 0.600 -16.796 3.173 1.00 0.00 H new ATOM 0 HG13 VAL B 41 2.332 -16.991 3.532 1.00 0.00 H new ATOM 0 HG21 VAL B 41 2.416 -15.091 5.932 1.00 0.00 H new ATOM 0 HG22 VAL B 41 3.599 -15.146 4.603 1.00 0.00 H new ATOM 0 HG23 VAL B 41 2.787 -13.615 5.009 1.00 0.00 H new ATOM 1843 N LYS B 42 4.308 -14.289 2.781 1.00 0.00 N ATOM 1844 CA LYS B 42 5.714 -14.669 2.443 1.00 0.00 C ATOM 1845 C LYS B 42 6.591 -14.698 3.702 1.00 0.00 C ATOM 1846 O LYS B 42 6.679 -13.720 4.437 1.00 0.00 O ATOM 1847 CB LYS B 42 6.276 -13.663 1.445 1.00 0.00 C ATOM 1848 CG LYS B 42 7.723 -14.041 1.112 1.00 0.00 C ATOM 1849 CD LYS B 42 7.951 -13.878 -0.391 1.00 0.00 C ATOM 1850 CE LYS B 42 7.640 -12.435 -0.788 1.00 0.00 C ATOM 1851 NZ LYS B 42 6.363 -12.366 -1.555 1.00 0.00 N ATOM 0 H LYS B 42 4.207 -13.541 3.467 1.00 0.00 H new ATOM 0 HA LYS B 42 5.714 -15.668 2.006 1.00 0.00 H new ATOM 0 HB2 LYS B 42 5.671 -13.655 0.538 1.00 0.00 H new ATOM 0 HB3 LYS B 42 6.237 -12.657 1.863 1.00 0.00 H new ATOM 0 HG2 LYS B 42 8.414 -13.407 1.668 1.00 0.00 H new ATOM 0 HG3 LYS B 42 7.921 -15.070 1.413 1.00 0.00 H new ATOM 0 HD2 LYS B 42 8.982 -14.124 -0.644 1.00 0.00 H new ATOM 0 HD3 LYS B 42 7.313 -14.567 -0.945 1.00 0.00 H new ATOM 0 HE2 LYS B 42 7.568 -11.814 0.105 1.00 0.00 H new ATOM 0 HE3 LYS B 42 8.455 -12.034 -1.391 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 6.558 -12.051 -2.527 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 5.921 -13.307 -1.578 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 5.718 -11.692 -1.096 1.00 0.00 H new ATOM 1865 N LEU B 43 7.224 -15.826 3.914 1.00 0.00 N ATOM 1866 CA LEU B 43 8.107 -15.974 5.108 1.00 0.00 C ATOM 1867 C LEU B 43 9.507 -15.435 4.806 1.00 0.00 C ATOM 1868 O LEU B 43 9.965 -15.491 3.681 1.00 0.00 O ATOM 1869 CB LEU B 43 8.210 -17.454 5.473 1.00 0.00 C ATOM 1870 CG LEU B 43 6.952 -17.880 6.223 1.00 0.00 C ATOM 1871 CD1 LEU B 43 5.728 -17.586 5.356 1.00 0.00 C ATOM 1872 CD2 LEU B 43 7.019 -19.381 6.505 1.00 0.00 C ATOM 0 H LEU B 43 7.166 -16.648 3.312 1.00 0.00 H new ATOM 0 HA LEU B 43 7.680 -15.409 5.937 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.330 -18.055 4.571 1.00 0.00 H new ATOM 0 HB3 LEU B 43 9.091 -17.627 6.091 1.00 0.00 H new ATOM 0 HG LEU B 43 6.879 -17.332 7.162 1.00 0.00 H new ATOM 0 HD11 LEU B 43 4.825 -17.888 5.887 1.00 0.00 H new ATOM 0 HD12 LEU B 43 5.682 -16.518 5.141 1.00 0.00 H new ATOM 0 HD13 LEU B 43 5.803 -18.141 4.421 1.00 0.00 H new ATOM 0 HD21 LEU B 43 6.122 -19.691 7.041 1.00 0.00 H new ATOM 0 HD22 LEU B 43 7.085 -19.926 5.563 1.00 0.00 H new ATOM 0 HD23 LEU B 43 7.898 -19.598 7.112 1.00 0.00 H new ATOM 1884 N SER B 44 10.150 -14.935 5.828 1.00 0.00 N ATOM 1885 CA SER B 44 11.531 -14.374 5.655 1.00 0.00 C ATOM 1886 C SER B 44 12.434 -15.321 4.851 1.00 0.00 C ATOM 1887 O SER B 44 13.232 -14.880 4.047 1.00 0.00 O ATOM 1888 CB SER B 44 12.149 -14.164 7.037 1.00 0.00 C ATOM 1889 OG SER B 44 12.887 -15.355 7.270 1.00 0.00 O ATOM 0 H SER B 44 9.782 -14.889 6.778 1.00 0.00 H new ATOM 0 HA SER B 44 11.452 -13.434 5.109 1.00 0.00 H new ATOM 0 HB2 SER B 44 12.794 -13.285 7.056 1.00 0.00 H new ATOM 0 HB3 SER B 44 11.383 -14.014 7.798 1.00 0.00 H new ATOM 0 HG SER B 44 13.323 -15.303 8.146 1.00 0.00 H new ATOM 1895 N ASP B 45 12.291 -16.595 5.077 1.00 0.00 N ATOM 1896 CA ASP B 45 13.158 -17.569 4.343 1.00 0.00 C ATOM 1897 C ASP B 45 12.965 -17.423 2.832 1.00 0.00 C ATOM 1898 O ASP B 45 13.668 -18.033 2.051 1.00 0.00 O ATOM 1899 CB ASP B 45 12.787 -18.988 4.769 1.00 0.00 C ATOM 1900 CG ASP B 45 11.280 -19.063 5.019 1.00 0.00 C ATOM 1901 OD1 ASP B 45 10.566 -18.559 4.168 1.00 0.00 O ATOM 1902 OD2 ASP B 45 10.928 -19.618 6.046 1.00 0.00 O ATOM 0 H ASP B 45 11.622 -17.005 5.728 1.00 0.00 H new ATOM 0 HA ASP B 45 14.202 -17.368 4.583 1.00 0.00 H new ATOM 0 HB2 ASP B 45 13.075 -19.699 3.995 1.00 0.00 H new ATOM 0 HB3 ASP B 45 13.331 -19.263 5.673 1.00 0.00 H new ATOM 1907 N GLY B 46 12.017 -16.617 2.455 1.00 0.00 N ATOM 1908 CA GLY B 46 11.763 -16.416 1.003 1.00 0.00 C ATOM 1909 C GLY B 46 10.761 -17.452 0.496 1.00 0.00 C ATOM 1910 O GLY B 46 10.797 -17.835 -0.657 1.00 0.00 O ATOM 0 H GLY B 46 11.410 -16.091 3.084 1.00 0.00 H new ATOM 0 HA2 GLY B 46 11.378 -15.411 0.829 1.00 0.00 H new ATOM 0 HA3 GLY B 46 12.697 -16.500 0.448 1.00 0.00 H new ATOM 1914 N ARG B 47 9.887 -17.883 1.372 1.00 0.00 N ATOM 1915 CA ARG B 47 8.875 -18.912 0.962 1.00 0.00 C ATOM 1916 C ARG B 47 7.480 -18.285 0.882 1.00 0.00 C ATOM 1917 O ARG B 47 7.079 -17.552 1.763 1.00 0.00 O ATOM 1918 CB ARG B 47 8.856 -20.053 1.993 1.00 0.00 C ATOM 1919 CG ARG B 47 10.279 -20.608 2.198 1.00 0.00 C ATOM 1920 CD ARG B 47 10.630 -21.578 1.062 1.00 0.00 C ATOM 1921 NE ARG B 47 10.549 -22.975 1.576 1.00 0.00 N ATOM 1922 CZ ARG B 47 11.459 -23.842 1.222 1.00 0.00 C ATOM 1923 NH1 ARG B 47 11.401 -24.366 0.028 1.00 0.00 N ATOM 1924 NH2 ARG B 47 12.396 -24.156 2.075 1.00 0.00 N ATOM 0 H ARG B 47 9.828 -17.573 2.342 1.00 0.00 H new ATOM 0 HA ARG B 47 9.149 -19.301 -0.019 1.00 0.00 H new ATOM 0 HB2 ARG B 47 8.459 -19.690 2.941 1.00 0.00 H new ATOM 0 HB3 ARG B 47 8.193 -20.849 1.654 1.00 0.00 H new ATOM 0 HG2 ARG B 47 10.998 -19.789 2.224 1.00 0.00 H new ATOM 0 HG3 ARG B 47 10.344 -21.120 3.158 1.00 0.00 H new ATOM 0 HD2 ARG B 47 9.943 -21.444 0.226 1.00 0.00 H new ATOM 0 HD3 ARG B 47 11.633 -21.372 0.687 1.00 0.00 H new ATOM 0 HE ARG B 47 9.790 -23.251 2.199 1.00 0.00 H new ATOM 0 HH11 ARG B 47 10.653 -24.097 -0.611 1.00 0.00 H new ATOM 0 HH12 ARG B 47 12.103 -25.045 -0.266 1.00 0.00 H new ATOM 0 HH21 ARG B 47 12.409 -23.726 3.000 1.00 0.00 H new ATOM 0 HH22 ARG B 47 13.115 -24.831 1.817 1.00 0.00 H new ATOM 1938 N GLU B 48 6.775 -18.592 -0.177 1.00 0.00 N ATOM 1939 CA GLU B 48 5.399 -18.029 -0.344 1.00 0.00 C ATOM 1940 C GLU B 48 4.347 -19.125 -0.132 1.00 0.00 C ATOM 1941 O GLU B 48 4.460 -20.206 -0.678 1.00 0.00 O ATOM 1942 CB GLU B 48 5.262 -17.461 -1.756 1.00 0.00 C ATOM 1943 CG GLU B 48 6.195 -18.224 -2.697 1.00 0.00 C ATOM 1944 CD GLU B 48 5.804 -17.929 -4.147 1.00 0.00 C ATOM 1945 OE1 GLU B 48 4.837 -18.534 -4.581 1.00 0.00 O ATOM 1946 OE2 GLU B 48 6.493 -17.114 -4.738 1.00 0.00 O ATOM 0 H GLU B 48 7.089 -19.204 -0.930 1.00 0.00 H new ATOM 0 HA GLU B 48 5.241 -17.242 0.394 1.00 0.00 H new ATOM 0 HB2 GLU B 48 4.231 -17.548 -2.098 1.00 0.00 H new ATOM 0 HB3 GLU B 48 5.510 -16.400 -1.760 1.00 0.00 H new ATOM 0 HG2 GLU B 48 7.229 -17.929 -2.520 1.00 0.00 H new ATOM 0 HG3 GLU B 48 6.131 -19.294 -2.502 1.00 0.00 H new ATOM 1953 N LEU B 49 3.349 -18.819 0.656 1.00 0.00 N ATOM 1954 CA LEU B 49 2.274 -19.827 0.921 1.00 0.00 C ATOM 1955 C LEU B 49 0.893 -19.170 0.815 1.00 0.00 C ATOM 1956 O LEU B 49 0.777 -18.031 0.405 1.00 0.00 O ATOM 1957 CB LEU B 49 2.455 -20.395 2.330 1.00 0.00 C ATOM 1958 CG LEU B 49 3.774 -21.175 2.404 1.00 0.00 C ATOM 1959 CD1 LEU B 49 4.728 -20.459 3.361 1.00 0.00 C ATOM 1960 CD2 LEU B 49 3.495 -22.583 2.933 1.00 0.00 C ATOM 0 H LEU B 49 3.230 -17.921 1.126 1.00 0.00 H new ATOM 0 HA LEU B 49 2.345 -20.626 0.183 1.00 0.00 H new ATOM 0 HB2 LEU B 49 2.457 -19.587 3.061 1.00 0.00 H new ATOM 0 HB3 LEU B 49 1.619 -21.049 2.580 1.00 0.00 H new ATOM 0 HG LEU B 49 4.223 -21.235 1.413 1.00 0.00 H new ATOM 0 HD11 LEU B 49 5.667 -21.009 3.418 1.00 0.00 H new ATOM 0 HD12 LEU B 49 4.920 -19.450 2.996 1.00 0.00 H new ATOM 0 HD13 LEU B 49 4.278 -20.407 4.352 1.00 0.00 H new ATOM 0 HD21 LEU B 49 4.429 -23.143 2.988 1.00 0.00 H new ATOM 0 HD22 LEU B 49 3.052 -22.517 3.927 1.00 0.00 H new ATOM 0 HD23 LEU B 49 2.805 -23.094 2.262 1.00 0.00 H new ATOM 1972 N CYS B 50 -0.121 -19.908 1.187 1.00 0.00 N ATOM 1973 CA CYS B 50 -1.509 -19.352 1.118 1.00 0.00 C ATOM 1974 C CYS B 50 -2.278 -19.698 2.399 1.00 0.00 C ATOM 1975 O CYS B 50 -2.254 -20.825 2.851 1.00 0.00 O ATOM 1976 CB CYS B 50 -2.226 -19.957 -0.085 1.00 0.00 C ATOM 1977 SG CYS B 50 -1.854 -19.260 -1.712 1.00 0.00 S ATOM 0 H CYS B 50 -0.051 -20.865 1.533 1.00 0.00 H new ATOM 0 HA CYS B 50 -1.461 -18.268 1.017 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -1.996 -21.022 -0.114 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -3.299 -19.868 0.082 1.00 0.00 H new ATOM 1982 N LEU B 51 -2.948 -18.715 2.949 1.00 0.00 N ATOM 1983 CA LEU B 51 -3.728 -18.959 4.206 1.00 0.00 C ATOM 1984 C LEU B 51 -5.232 -18.929 3.917 1.00 0.00 C ATOM 1985 O LEU B 51 -5.661 -18.426 2.897 1.00 0.00 O ATOM 1986 CB LEU B 51 -3.389 -17.869 5.222 1.00 0.00 C ATOM 1987 CG LEU B 51 -1.869 -17.707 5.299 1.00 0.00 C ATOM 1988 CD1 LEU B 51 -1.528 -16.673 6.373 1.00 0.00 C ATOM 1989 CD2 LEU B 51 -1.240 -19.050 5.674 1.00 0.00 C ATOM 0 H LEU B 51 -2.990 -17.762 2.587 1.00 0.00 H new ATOM 0 HA LEU B 51 -3.465 -19.940 4.603 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -3.853 -16.927 4.930 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.789 -18.131 6.202 1.00 0.00 H new ATOM 0 HG LEU B 51 -1.483 -17.376 4.335 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -0.446 -16.553 6.432 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -1.985 -15.717 6.116 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -1.909 -17.010 7.337 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -0.157 -18.941 5.730 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -1.623 -19.374 6.642 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -1.491 -19.793 4.917 1.00 0.00 H new ATOM 2001 N ASP B 52 -5.996 -19.472 4.833 1.00 0.00 N ATOM 2002 CA ASP B 52 -7.481 -19.496 4.652 1.00 0.00 C ATOM 2003 C ASP B 52 -8.158 -18.629 5.756 1.00 0.00 C ATOM 2004 O ASP B 52 -8.011 -18.924 6.925 1.00 0.00 O ATOM 2005 CB ASP B 52 -7.965 -20.938 4.800 1.00 0.00 C ATOM 2006 CG ASP B 52 -9.301 -21.099 4.072 1.00 0.00 C ATOM 2007 OD1 ASP B 52 -10.174 -20.297 4.361 1.00 0.00 O ATOM 2008 OD2 ASP B 52 -9.372 -22.015 3.269 1.00 0.00 O ATOM 0 H ASP B 52 -5.657 -19.898 5.695 1.00 0.00 H new ATOM 0 HA ASP B 52 -7.737 -19.102 3.669 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -7.227 -21.626 4.387 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -8.080 -21.189 5.854 1.00 0.00 H new ATOM 2013 N PRO B 53 -8.891 -17.570 5.383 1.00 0.00 N ATOM 2014 CA PRO B 53 -9.550 -16.724 6.391 1.00 0.00 C ATOM 2015 C PRO B 53 -10.609 -17.525 7.158 1.00 0.00 C ATOM 2016 O PRO B 53 -11.176 -17.048 8.121 1.00 0.00 O ATOM 2017 CB PRO B 53 -10.216 -15.592 5.602 1.00 0.00 C ATOM 2018 CG PRO B 53 -9.991 -15.882 4.088 1.00 0.00 C ATOM 2019 CD PRO B 53 -9.115 -17.142 3.985 1.00 0.00 C ATOM 0 HA PRO B 53 -8.838 -16.348 7.126 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -11.281 -15.542 5.829 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -9.786 -14.629 5.876 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -10.944 -16.035 3.581 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -9.504 -15.036 3.604 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -9.612 -17.922 3.409 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -8.172 -16.927 3.483 1.00 0.00 H new ATOM 2027 N LYS B 54 -10.853 -18.727 6.711 1.00 0.00 N ATOM 2028 CA LYS B 54 -11.875 -19.567 7.387 1.00 0.00 C ATOM 2029 C LYS B 54 -11.336 -20.139 8.704 1.00 0.00 C ATOM 2030 O LYS B 54 -12.072 -20.756 9.451 1.00 0.00 O ATOM 2031 CB LYS B 54 -12.271 -20.714 6.459 1.00 0.00 C ATOM 2032 CG LYS B 54 -13.665 -21.212 6.846 1.00 0.00 C ATOM 2033 CD LYS B 54 -14.062 -22.369 5.926 1.00 0.00 C ATOM 2034 CE LYS B 54 -14.156 -23.656 6.749 1.00 0.00 C ATOM 2035 NZ LYS B 54 -14.420 -24.825 5.862 1.00 0.00 N ATOM 0 H LYS B 54 -10.390 -19.159 5.911 1.00 0.00 H new ATOM 0 HA LYS B 54 -12.742 -18.946 7.613 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -12.266 -20.378 5.422 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -11.547 -21.526 6.534 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -13.671 -21.540 7.885 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -14.389 -20.402 6.763 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -15.019 -22.158 5.448 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -13.327 -22.485 5.130 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -13.228 -23.812 7.299 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -14.953 -23.565 7.487 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -14.481 -25.690 6.436 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -15.317 -24.681 5.356 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -13.646 -24.920 5.174 1.00 0.00 H new ATOM 2049 N GLU B 55 -10.068 -19.924 8.967 1.00 0.00 N ATOM 2050 CA GLU B 55 -9.480 -20.462 10.236 1.00 0.00 C ATOM 2051 C GLU B 55 -9.280 -19.333 11.255 1.00 0.00 C ATOM 2052 O GLU B 55 -8.836 -18.255 10.915 1.00 0.00 O ATOM 2053 CB GLU B 55 -8.139 -21.126 9.934 1.00 0.00 C ATOM 2054 CG GLU B 55 -8.376 -22.361 9.062 1.00 0.00 C ATOM 2055 CD GLU B 55 -8.589 -23.581 9.961 1.00 0.00 C ATOM 2056 OE1 GLU B 55 -9.124 -23.373 11.039 1.00 0.00 O ATOM 2057 OE2 GLU B 55 -8.205 -24.653 9.521 1.00 0.00 O ATOM 0 H GLU B 55 -9.423 -19.408 8.368 1.00 0.00 H new ATOM 0 HA GLU B 55 -10.166 -21.196 10.659 1.00 0.00 H new ATOM 0 HB2 GLU B 55 -7.479 -20.425 9.422 1.00 0.00 H new ATOM 0 HB3 GLU B 55 -7.643 -21.411 10.862 1.00 0.00 H new ATOM 0 HG2 GLU B 55 -9.247 -22.208 8.424 1.00 0.00 H new ATOM 0 HG3 GLU B 55 -7.523 -22.525 8.403 1.00 0.00 H new ATOM 2064 N ASN B 56 -9.604 -19.611 12.485 1.00 0.00 N ATOM 2065 CA ASN B 56 -9.459 -18.564 13.541 1.00 0.00 C ATOM 2066 C ASN B 56 -7.984 -18.235 13.795 1.00 0.00 C ATOM 2067 O ASN B 56 -7.623 -17.082 13.921 1.00 0.00 O ATOM 2068 CB ASN B 56 -10.094 -19.071 14.833 1.00 0.00 C ATOM 2069 CG ASN B 56 -11.538 -19.490 14.554 1.00 0.00 C ATOM 2070 OD1 ASN B 56 -11.957 -20.580 14.891 1.00 0.00 O ATOM 2071 ND2 ASN B 56 -12.333 -18.656 13.940 1.00 0.00 N ATOM 0 H ASN B 56 -9.961 -20.511 12.807 1.00 0.00 H new ATOM 0 HA ASN B 56 -9.958 -17.656 13.202 1.00 0.00 H new ATOM 0 HB2 ASN B 56 -9.527 -19.916 15.224 1.00 0.00 H new ATOM 0 HB3 ASN B 56 -10.070 -18.291 15.594 1.00 0.00 H new ATOM 0 HD21 ASN B 56 -13.299 -18.921 13.746 1.00 0.00 H new ATOM 0 HD22 ASN B 56 -11.988 -17.740 13.654 1.00 0.00 H new ATOM 2078 N TRP B 57 -7.157 -19.245 13.868 1.00 0.00 N ATOM 2079 CA TRP B 57 -5.714 -18.968 14.133 1.00 0.00 C ATOM 2080 C TRP B 57 -5.131 -18.068 13.042 1.00 0.00 C ATOM 2081 O TRP B 57 -4.106 -17.451 13.233 1.00 0.00 O ATOM 2082 CB TRP B 57 -4.926 -20.284 14.213 1.00 0.00 C ATOM 2083 CG TRP B 57 -5.023 -21.055 12.889 1.00 0.00 C ATOM 2084 CD1 TRP B 57 -5.902 -22.022 12.653 1.00 0.00 C ATOM 2085 CD2 TRP B 57 -4.222 -20.886 11.849 1.00 0.00 C ATOM 2086 NE1 TRP B 57 -5.596 -22.438 11.413 1.00 0.00 N ATOM 2087 CE2 TRP B 57 -4.544 -21.772 10.834 1.00 0.00 C ATOM 2088 CE3 TRP B 57 -3.178 -19.995 11.669 1.00 0.00 C ATOM 2089 CZ2 TRP B 57 -3.829 -21.770 9.654 1.00 0.00 C ATOM 2090 CZ3 TRP B 57 -2.464 -19.994 10.485 1.00 0.00 C ATOM 2091 CH2 TRP B 57 -2.791 -20.880 9.479 1.00 0.00 C ATOM 0 H TRP B 57 -7.409 -20.227 13.759 1.00 0.00 H new ATOM 0 HA TRP B 57 -5.632 -18.451 15.089 1.00 0.00 H new ATOM 0 HB2 TRP B 57 -3.881 -20.075 14.442 1.00 0.00 H new ATOM 0 HB3 TRP B 57 -5.314 -20.897 15.026 1.00 0.00 H new ATOM 0 HD1 TRP B 57 -6.681 -22.388 13.305 1.00 0.00 H new ATOM 0 HE1 TRP B 57 -6.103 -23.187 10.941 1.00 0.00 H new ATOM 0 HE3 TRP B 57 -2.921 -19.300 12.454 1.00 0.00 H new ATOM 0 HZ2 TRP B 57 -4.083 -22.466 8.868 1.00 0.00 H new ATOM 0 HZ3 TRP B 57 -1.649 -19.299 10.347 1.00 0.00 H new ATOM 0 HH2 TRP B 57 -2.233 -20.876 8.554 1.00 0.00 H new ATOM 2102 N VAL B 58 -5.798 -17.995 11.924 1.00 0.00 N ATOM 2103 CA VAL B 58 -5.273 -17.125 10.833 1.00 0.00 C ATOM 2104 C VAL B 58 -5.628 -15.672 11.125 1.00 0.00 C ATOM 2105 O VAL B 58 -4.880 -14.771 10.809 1.00 0.00 O ATOM 2106 CB VAL B 58 -5.897 -17.551 9.497 1.00 0.00 C ATOM 2107 CG1 VAL B 58 -5.922 -16.365 8.532 1.00 0.00 C ATOM 2108 CG2 VAL B 58 -5.063 -18.671 8.889 1.00 0.00 C ATOM 0 H VAL B 58 -6.667 -18.489 11.719 1.00 0.00 H new ATOM 0 HA VAL B 58 -4.189 -17.226 10.775 1.00 0.00 H new ATOM 0 HB VAL B 58 -6.916 -17.896 9.671 1.00 0.00 H new ATOM 0 HG11 VAL B 58 -6.366 -16.675 7.586 1.00 0.00 H new ATOM 0 HG12 VAL B 58 -6.514 -15.557 8.963 1.00 0.00 H new ATOM 0 HG13 VAL B 58 -4.904 -16.016 8.358 1.00 0.00 H new ATOM 0 HG21 VAL B 58 -5.502 -18.977 7.940 1.00 0.00 H new ATOM 0 HG22 VAL B 58 -4.046 -18.317 8.721 1.00 0.00 H new ATOM 0 HG23 VAL B 58 -5.043 -19.521 9.571 1.00 0.00 H new ATOM 2118 N GLN B 59 -6.762 -15.476 11.725 1.00 0.00 N ATOM 2119 CA GLN B 59 -7.184 -14.091 12.051 1.00 0.00 C ATOM 2120 C GLN B 59 -6.344 -13.542 13.209 1.00 0.00 C ATOM 2121 O GLN B 59 -6.207 -12.350 13.363 1.00 0.00 O ATOM 2122 CB GLN B 59 -8.658 -14.105 12.454 1.00 0.00 C ATOM 2123 CG GLN B 59 -9.214 -12.682 12.373 1.00 0.00 C ATOM 2124 CD GLN B 59 -10.421 -12.558 13.304 1.00 0.00 C ATOM 2125 OE1 GLN B 59 -11.312 -13.384 13.299 1.00 0.00 O ATOM 2126 NE2 GLN B 59 -10.487 -11.541 14.120 1.00 0.00 N ATOM 0 H GLN B 59 -7.413 -16.210 12.003 1.00 0.00 H new ATOM 0 HA GLN B 59 -7.040 -13.454 11.178 1.00 0.00 H new ATOM 0 HB2 GLN B 59 -9.221 -14.767 11.796 1.00 0.00 H new ATOM 0 HB3 GLN B 59 -8.767 -14.494 13.466 1.00 0.00 H new ATOM 0 HG2 GLN B 59 -8.446 -11.962 12.656 1.00 0.00 H new ATOM 0 HG3 GLN B 59 -9.505 -12.451 11.348 1.00 0.00 H new ATOM 0 HE21 GLN B 59 -9.742 -10.845 14.128 1.00 0.00 H new ATOM 0 HE22 GLN B 59 -11.284 -11.443 14.749 1.00 0.00 H new ATOM 2135 N ARG B 60 -5.787 -14.428 13.988 1.00 0.00 N ATOM 2136 CA ARG B 60 -4.973 -13.967 15.152 1.00 0.00 C ATOM 2137 C ARG B 60 -3.505 -13.738 14.761 1.00 0.00 C ATOM 2138 O ARG B 60 -2.964 -12.678 15.004 1.00 0.00 O ATOM 2139 CB ARG B 60 -5.044 -15.019 16.258 1.00 0.00 C ATOM 2140 CG ARG B 60 -4.717 -14.364 17.601 1.00 0.00 C ATOM 2141 CD ARG B 60 -4.725 -15.434 18.696 1.00 0.00 C ATOM 2142 NE ARG B 60 -4.090 -14.877 19.924 1.00 0.00 N ATOM 2143 CZ ARG B 60 -3.800 -15.676 20.915 1.00 0.00 C ATOM 2144 NH1 ARG B 60 -3.917 -16.966 20.743 1.00 0.00 N ATOM 2145 NH2 ARG B 60 -3.401 -15.159 22.046 1.00 0.00 N ATOM 0 H ARG B 60 -5.857 -15.439 13.873 1.00 0.00 H new ATOM 0 HA ARG B 60 -5.380 -13.018 15.499 1.00 0.00 H new ATOM 0 HB2 ARG B 60 -6.039 -15.463 16.290 1.00 0.00 H new ATOM 0 HB3 ARG B 60 -4.341 -15.826 16.053 1.00 0.00 H new ATOM 0 HG2 ARG B 60 -3.741 -13.880 17.556 1.00 0.00 H new ATOM 0 HG3 ARG B 60 -5.448 -13.588 17.829 1.00 0.00 H new ATOM 0 HD2 ARG B 60 -5.747 -15.746 18.909 1.00 0.00 H new ATOM 0 HD3 ARG B 60 -4.184 -16.319 18.361 1.00 0.00 H new ATOM 0 HE ARG B 60 -3.884 -13.880 19.990 1.00 0.00 H new ATOM 0 HH11 ARG B 60 -4.231 -17.334 19.845 1.00 0.00 H new ATOM 0 HH12 ARG B 60 -3.695 -17.605 21.507 1.00 0.00 H new ATOM 0 HH21 ARG B 60 -3.320 -14.147 22.144 1.00 0.00 H new ATOM 0 HH22 ARG B 60 -3.170 -15.767 22.831 1.00 0.00 H new ATOM 2159 N VAL B 61 -2.883 -14.726 14.166 1.00 0.00 N ATOM 2160 CA VAL B 61 -1.455 -14.547 13.790 1.00 0.00 C ATOM 2161 C VAL B 61 -1.331 -13.401 12.776 1.00 0.00 C ATOM 2162 O VAL B 61 -0.374 -12.647 12.795 1.00 0.00 O ATOM 2163 CB VAL B 61 -0.927 -15.858 13.199 1.00 0.00 C ATOM 2164 CG1 VAL B 61 -1.167 -16.994 14.201 1.00 0.00 C ATOM 2165 CG2 VAL B 61 -1.668 -16.154 11.893 1.00 0.00 C ATOM 0 H VAL B 61 -3.295 -15.629 13.930 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.863 -14.293 14.669 1.00 0.00 H new ATOM 0 HB VAL B 61 0.141 -15.773 12.998 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.793 -17.930 13.786 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -0.644 -16.775 15.132 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.235 -17.085 14.398 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -1.297 -17.086 11.467 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -2.735 -16.246 12.093 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -1.500 -15.341 11.187 1.00 0.00 H new ATOM 2175 N VAL B 62 -2.306 -13.285 11.918 1.00 0.00 N ATOM 2176 CA VAL B 62 -2.262 -12.178 10.920 1.00 0.00 C ATOM 2177 C VAL B 62 -2.576 -10.856 11.624 1.00 0.00 C ATOM 2178 O VAL B 62 -1.960 -9.844 11.355 1.00 0.00 O ATOM 2179 CB VAL B 62 -3.299 -12.434 9.826 1.00 0.00 C ATOM 2180 CG1 VAL B 62 -3.333 -11.237 8.875 1.00 0.00 C ATOM 2181 CG2 VAL B 62 -2.905 -13.688 9.040 1.00 0.00 C ATOM 0 H VAL B 62 -3.120 -13.898 11.863 1.00 0.00 H new ATOM 0 HA VAL B 62 -1.270 -12.128 10.470 1.00 0.00 H new ATOM 0 HB VAL B 62 -4.281 -12.575 10.277 1.00 0.00 H new ATOM 0 HG11 VAL B 62 -4.071 -11.415 8.093 1.00 0.00 H new ATOM 0 HG12 VAL B 62 -3.602 -10.339 9.430 1.00 0.00 H new ATOM 0 HG13 VAL B 62 -2.350 -11.103 8.423 1.00 0.00 H new ATOM 0 HG21 VAL B 62 -3.642 -13.874 8.259 1.00 0.00 H new ATOM 0 HG22 VAL B 62 -1.925 -13.540 8.587 1.00 0.00 H new ATOM 0 HG23 VAL B 62 -2.867 -14.543 9.715 1.00 0.00 H new ATOM 2191 N GLU B 63 -3.535 -10.895 12.516 1.00 0.00 N ATOM 2192 CA GLU B 63 -3.895 -9.653 13.259 1.00 0.00 C ATOM 2193 C GLU B 63 -2.656 -9.085 13.944 1.00 0.00 C ATOM 2194 O GLU B 63 -2.476 -7.885 14.016 1.00 0.00 O ATOM 2195 CB GLU B 63 -4.945 -9.985 14.319 1.00 0.00 C ATOM 2196 CG GLU B 63 -5.000 -8.849 15.342 1.00 0.00 C ATOM 2197 CD GLU B 63 -6.359 -8.866 16.044 1.00 0.00 C ATOM 2198 OE1 GLU B 63 -6.541 -9.763 16.850 1.00 0.00 O ATOM 2199 OE2 GLU B 63 -7.139 -7.980 15.732 1.00 0.00 O ATOM 0 H GLU B 63 -4.077 -11.724 12.758 1.00 0.00 H new ATOM 0 HA GLU B 63 -4.293 -8.918 12.560 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -5.921 -10.119 13.853 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -4.697 -10.924 14.813 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -4.199 -8.963 16.072 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -4.846 -7.890 14.847 1.00 0.00 H new ATOM 2206 N LYS B 64 -1.825 -9.961 14.436 1.00 0.00 N ATOM 2207 CA LYS B 64 -0.593 -9.490 15.123 1.00 0.00 C ATOM 2208 C LYS B 64 0.369 -8.860 14.112 1.00 0.00 C ATOM 2209 O LYS B 64 1.003 -7.867 14.397 1.00 0.00 O ATOM 2210 CB LYS B 64 0.080 -10.673 15.810 1.00 0.00 C ATOM 2211 CG LYS B 64 0.053 -10.454 17.324 1.00 0.00 C ATOM 2212 CD LYS B 64 0.745 -11.633 18.022 1.00 0.00 C ATOM 2213 CE LYS B 64 -0.036 -12.926 17.751 1.00 0.00 C ATOM 2214 NZ LYS B 64 0.074 -13.853 18.913 1.00 0.00 N ATOM 0 H LYS B 64 -1.944 -10.973 14.393 1.00 0.00 H new ATOM 0 HA LYS B 64 -0.860 -8.737 15.865 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -0.435 -11.599 15.555 1.00 0.00 H new ATOM 0 HB3 LYS B 64 1.108 -10.774 15.463 1.00 0.00 H new ATOM 0 HG2 LYS B 64 0.557 -9.521 17.577 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -0.976 -10.365 17.671 1.00 0.00 H new ATOM 0 HD2 LYS B 64 1.768 -11.732 17.660 1.00 0.00 H new ATOM 0 HD3 LYS B 64 0.803 -11.450 19.095 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -1.084 -12.693 17.562 1.00 0.00 H new ATOM 0 HE3 LYS B 64 0.350 -13.410 16.854 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -0.460 -14.723 18.715 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 1.074 -14.089 19.075 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -0.315 -13.394 19.761 1.00 0.00 H new ATOM 2228 N PHE B 65 0.468 -9.449 12.950 1.00 0.00 N ATOM 2229 CA PHE B 65 1.385 -8.862 11.929 1.00 0.00 C ATOM 2230 C PHE B 65 0.935 -7.444 11.571 1.00 0.00 C ATOM 2231 O PHE B 65 1.746 -6.592 11.266 1.00 0.00 O ATOM 2232 CB PHE B 65 1.380 -9.715 10.672 1.00 0.00 C ATOM 2233 CG PHE B 65 2.318 -9.075 9.640 1.00 0.00 C ATOM 2234 CD1 PHE B 65 3.685 -9.046 9.858 1.00 0.00 C ATOM 2235 CD2 PHE B 65 1.813 -8.515 8.476 1.00 0.00 C ATOM 2236 CE1 PHE B 65 4.532 -8.466 8.931 1.00 0.00 C ATOM 2237 CE2 PHE B 65 2.663 -7.935 7.554 1.00 0.00 C ATOM 2238 CZ PHE B 65 4.019 -7.911 7.781 1.00 0.00 C ATOM 0 H PHE B 65 -0.033 -10.291 12.667 1.00 0.00 H new ATOM 0 HA PHE B 65 2.392 -8.831 12.346 1.00 0.00 H new ATOM 0 HB2 PHE B 65 1.707 -10.729 10.902 1.00 0.00 H new ATOM 0 HB3 PHE B 65 0.370 -9.789 10.270 1.00 0.00 H new ATOM 0 HD1 PHE B 65 4.093 -9.480 10.759 1.00 0.00 H new ATOM 0 HD2 PHE B 65 0.749 -8.532 8.289 1.00 0.00 H new ATOM 0 HE1 PHE B 65 5.597 -8.449 9.110 1.00 0.00 H new ATOM 0 HE2 PHE B 65 2.261 -7.499 6.652 1.00 0.00 H new ATOM 0 HZ PHE B 65 4.680 -7.457 7.058 1.00 0.00 H new ATOM 2248 N LEU B 66 -0.350 -7.221 11.616 1.00 0.00 N ATOM 2249 CA LEU B 66 -0.865 -5.862 11.276 1.00 0.00 C ATOM 2250 C LEU B 66 -0.540 -4.874 12.400 1.00 0.00 C ATOM 2251 O LEU B 66 -0.003 -3.812 12.156 1.00 0.00 O ATOM 2252 CB LEU B 66 -2.378 -5.936 11.077 1.00 0.00 C ATOM 2253 CG LEU B 66 -2.672 -6.390 9.645 1.00 0.00 C ATOM 2254 CD1 LEU B 66 -3.993 -7.160 9.620 1.00 0.00 C ATOM 2255 CD2 LEU B 66 -2.788 -5.161 8.741 1.00 0.00 C ATOM 0 H LEU B 66 -1.058 -7.910 11.870 1.00 0.00 H new ATOM 0 HA LEU B 66 -0.388 -5.516 10.359 1.00 0.00 H new ATOM 0 HB2 LEU B 66 -2.818 -6.633 11.790 1.00 0.00 H new ATOM 0 HB3 LEU B 66 -2.830 -4.962 11.263 1.00 0.00 H new ATOM 0 HG LEU B 66 -1.866 -7.033 9.291 1.00 0.00 H new ATOM 0 HD11 LEU B 66 -4.206 -7.485 8.601 1.00 0.00 H new ATOM 0 HD12 LEU B 66 -3.919 -8.031 10.271 1.00 0.00 H new ATOM 0 HD13 LEU B 66 -4.798 -6.513 9.970 1.00 0.00 H new ATOM 0 HD21 LEU B 66 -2.997 -5.479 7.720 1.00 0.00 H new ATOM 0 HD22 LEU B 66 -3.598 -4.523 9.096 1.00 0.00 H new ATOM 0 HD23 LEU B 66 -1.851 -4.604 8.763 1.00 0.00 H new ATOM 2267 N LYS B 67 -0.871 -5.242 13.608 1.00 0.00 N ATOM 2268 CA LYS B 67 -0.580 -4.328 14.749 1.00 0.00 C ATOM 2269 C LYS B 67 0.937 -4.163 14.911 1.00 0.00 C ATOM 2270 O LYS B 67 1.406 -3.159 15.408 1.00 0.00 O ATOM 2271 CB LYS B 67 -1.215 -4.900 16.035 1.00 0.00 C ATOM 2272 CG LYS B 67 -0.215 -5.810 16.783 1.00 0.00 C ATOM 2273 CD LYS B 67 0.742 -4.969 17.653 1.00 0.00 C ATOM 2274 CE LYS B 67 0.478 -5.280 19.128 1.00 0.00 C ATOM 2275 NZ LYS B 67 0.843 -6.691 19.437 1.00 0.00 N ATOM 0 H LYS B 67 -1.324 -6.123 13.852 1.00 0.00 H new ATOM 0 HA LYS B 67 -1.009 -3.345 14.555 1.00 0.00 H new ATOM 0 HB2 LYS B 67 -1.528 -4.083 16.686 1.00 0.00 H new ATOM 0 HB3 LYS B 67 -2.111 -5.467 15.782 1.00 0.00 H new ATOM 0 HG2 LYS B 67 -0.758 -6.517 17.410 1.00 0.00 H new ATOM 0 HG3 LYS B 67 0.359 -6.396 16.065 1.00 0.00 H new ATOM 0 HD2 LYS B 67 1.778 -5.195 17.400 1.00 0.00 H new ATOM 0 HD3 LYS B 67 0.592 -3.907 17.459 1.00 0.00 H new ATOM 0 HE2 LYS B 67 1.055 -4.603 19.758 1.00 0.00 H new ATOM 0 HE3 LYS B 67 -0.574 -5.111 19.359 1.00 0.00 H new ATOM 0 HZ1 LYS B 67 1.133 -6.764 20.433 1.00 0.00 H new ATOM 0 HZ2 LYS B 67 0.022 -7.307 19.270 1.00 0.00 H new ATOM 0 HZ3 LYS B 67 1.629 -6.988 18.824 1.00 0.00 H new ATOM 2289 N ARG B 68 1.674 -5.155 14.478 1.00 0.00 N ATOM 2290 CA ARG B 68 3.158 -5.067 14.596 1.00 0.00 C ATOM 2291 C ARG B 68 3.714 -4.159 13.496 1.00 0.00 C ATOM 2292 O ARG B 68 4.525 -3.291 13.755 1.00 0.00 O ATOM 2293 CB ARG B 68 3.759 -6.465 14.456 1.00 0.00 C ATOM 2294 CG ARG B 68 5.230 -6.420 14.876 1.00 0.00 C ATOM 2295 CD ARG B 68 5.359 -6.935 16.311 1.00 0.00 C ATOM 2296 NE ARG B 68 6.680 -6.515 16.858 1.00 0.00 N ATOM 2297 CZ ARG B 68 7.738 -6.573 16.095 1.00 0.00 C ATOM 2298 NH1 ARG B 68 8.286 -7.736 15.866 1.00 0.00 N ATOM 2299 NH2 ARG B 68 8.213 -5.467 15.590 1.00 0.00 N ATOM 0 H ARG B 68 1.317 -6.011 14.053 1.00 0.00 H new ATOM 0 HA ARG B 68 3.419 -4.650 15.569 1.00 0.00 H new ATOM 0 HB2 ARG B 68 3.212 -7.174 15.077 1.00 0.00 H new ATOM 0 HB3 ARG B 68 3.672 -6.811 13.426 1.00 0.00 H new ATOM 0 HG2 ARG B 68 5.832 -7.030 14.202 1.00 0.00 H new ATOM 0 HG3 ARG B 68 5.609 -5.400 14.807 1.00 0.00 H new ATOM 0 HD2 ARG B 68 4.552 -6.538 16.928 1.00 0.00 H new ATOM 0 HD3 ARG B 68 5.271 -8.021 16.331 1.00 0.00 H new ATOM 0 HE ARG B 68 6.757 -6.185 17.820 1.00 0.00 H new ATOM 0 HH11 ARG B 68 7.887 -8.578 16.280 1.00 0.00 H new ATOM 0 HH12 ARG B 68 9.113 -7.802 15.273 1.00 0.00 H new ATOM 0 HH21 ARG B 68 7.758 -4.577 15.794 1.00 0.00 H new ATOM 0 HH22 ARG B 68 9.039 -5.493 14.992 1.00 0.00 H new ATOM 2313 N ALA B 69 3.267 -4.378 12.290 1.00 0.00 N ATOM 2314 CA ALA B 69 3.756 -3.532 11.164 1.00 0.00 C ATOM 2315 C ALA B 69 3.138 -2.133 11.257 1.00 0.00 C ATOM 2316 O ALA B 69 3.628 -1.193 10.667 1.00 0.00 O ATOM 2317 CB ALA B 69 3.355 -4.181 9.839 1.00 0.00 C ATOM 0 H ALA B 69 2.591 -5.099 12.036 1.00 0.00 H new ATOM 0 HA ALA B 69 4.841 -3.446 11.219 1.00 0.00 H new ATOM 0 HB1 ALA B 69 3.710 -3.567 9.011 1.00 0.00 H new ATOM 0 HB2 ALA B 69 3.800 -5.174 9.771 1.00 0.00 H new ATOM 0 HB3 ALA B 69 2.269 -4.265 9.789 1.00 0.00 H new ATOM 2323 N GLU B 70 2.073 -2.029 12.004 1.00 0.00 N ATOM 2324 CA GLU B 70 1.407 -0.702 12.152 1.00 0.00 C ATOM 2325 C GLU B 70 2.073 0.102 13.274 1.00 0.00 C ATOM 2326 O GLU B 70 2.279 1.294 13.150 1.00 0.00 O ATOM 2327 CB GLU B 70 -0.068 -0.922 12.492 1.00 0.00 C ATOM 2328 CG GLU B 70 -0.736 0.433 12.735 1.00 0.00 C ATOM 2329 CD GLU B 70 -2.162 0.401 12.178 1.00 0.00 C ATOM 2330 OE1 GLU B 70 -2.285 0.655 10.990 1.00 0.00 O ATOM 2331 OE2 GLU B 70 -3.047 0.127 12.972 1.00 0.00 O ATOM 0 H GLU B 70 1.638 -2.797 12.514 1.00 0.00 H new ATOM 0 HA GLU B 70 1.498 -0.147 11.218 1.00 0.00 H new ATOM 0 HB2 GLU B 70 -0.567 -1.446 11.677 1.00 0.00 H new ATOM 0 HB3 GLU B 70 -0.160 -1.550 13.378 1.00 0.00 H new ATOM 0 HG2 GLU B 70 -0.755 0.656 13.802 1.00 0.00 H new ATOM 0 HG3 GLU B 70 -0.163 1.226 12.254 1.00 0.00 H new ATOM 2338 N ASN B 71 2.394 -0.571 14.344 1.00 0.00 N ATOM 2339 CA ASN B 71 3.044 0.133 15.488 1.00 0.00 C ATOM 2340 C ASN B 71 4.478 0.533 15.129 1.00 0.00 C ATOM 2341 O ASN B 71 4.943 1.591 15.506 1.00 0.00 O ATOM 2342 CB ASN B 71 3.063 -0.799 16.699 1.00 0.00 C ATOM 2343 CG ASN B 71 3.654 -0.059 17.900 1.00 0.00 C ATOM 2344 OD1 ASN B 71 3.820 1.234 17.828 1.00 0.00 O flip ATOM 2345 ND2 ASN B 71 3.968 -0.649 18.914 1.00 0.00 N flip ATOM 0 H ASN B 71 2.237 -1.570 14.477 1.00 0.00 H new ATOM 0 HA ASN B 71 2.479 1.036 15.718 1.00 0.00 H new ATOM 0 HB2 ASN B 71 2.052 -1.137 16.928 1.00 0.00 H new ATOM 0 HB3 ASN B 71 3.654 -1.688 16.479 1.00 0.00 H new ATOM 0 HD21 ASN B 71 3.841 -1.659 18.976 1.00 0.00 H new ATOM 0 HD22 ASN B 71 4.359 -0.134 19.703 1.00 0.00 H new ATOM 2352 N SER B 72 5.151 -0.321 14.408 1.00 0.00 N ATOM 2353 CA SER B 72 6.556 -0.001 14.018 1.00 0.00 C ATOM 2354 C SER B 72 6.586 1.239 13.120 1.00 0.00 C ATOM 2355 O SER B 72 7.538 1.988 13.262 1.00 0.00 O ATOM 2356 CB SER B 72 7.151 -1.192 13.268 1.00 0.00 C ATOM 2357 OG SER B 72 8.545 -0.916 13.229 1.00 0.00 O ATOM 2358 OXT SER B 72 5.653 1.366 12.341 1.00 0.00 O ATOM 0 H SER B 72 4.795 -1.217 14.074 1.00 0.00 H new ATOM 0 HA SER B 72 7.141 0.201 14.915 1.00 0.00 H new ATOM 0 HB2 SER B 72 6.945 -2.130 13.783 1.00 0.00 H new ATOM 0 HB3 SER B 72 6.734 -1.280 12.265 1.00 0.00 H new ATOM 0 HG SER B 72 9.009 -1.641 12.760 1.00 0.00 H new TER 2364 SER B 72