USER MOD reduce.3.24.130724 H: found=0, std=0, add=808, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 808 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 ASN : amide:sc= -2.57 K(o=-3.8,f=-14!) USER MOD Set 1.2: A 78 MET CE :methyl -171:sc= -1.25 (180deg=0) USER MOD Set 2.1: A 27 CYS SG : rot -168:sc= -5.42! USER MOD Set 2.2: A 62 TYR OH : rot -35:sc= -0.431 USER MOD Set 3.1: A 22 GLN : amide:sc= 0.499 K(o=0.65,f=1.4) USER MOD Set 3.2: A 70 SER OG : rot -129:sc= 0.15 USER MOD Single : A 4 TYR OH : rot 80:sc= -3.25! USER MOD Single : A 6 THR OG1 : rot 80:sc= 0.0665 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 THR OG1 : rot 102:sc= 0.37 USER MOD Single : A 13 ASN : amide:sc= -0.68 K(o=-0.68,f=-2) USER MOD Single : A 16 THR OG1 : rot 180:sc= -1.08 USER MOD Single : A 24 LYS NZ :NH3+ -150:sc= 0.204 (180deg=-0.804) USER MOD Single : A 25 SER OG : rot 43:sc= 1.13 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 180:sc= -1.47 USER MOD Single : A 40 THR OG1 : rot 17:sc= 0.639! USER MOD Single : A 41 THR OG1 : rot 150:sc= 0.192 USER MOD Single : A 43 SER OG : rot 180:sc= -1.3 USER MOD Single : A 47 SER OG : rot 106:sc= 1.13 USER MOD Single : A 51 SER OG : rot 54:sc= 1.25 USER MOD Single : A 52 HIS : no HD1:sc= -0.353 X(o=-0.35,f=-0.27) USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -1.1 K(o=-1.1,f=-0.0065) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 HIS : no HD1:sc= -2.24! C(o=-2.2!,f=-2.4!) USER MOD Single : A 77 THR OG1 : rot 56:sc= 1.16 USER MOD Single : A 82 TYR OH : rot 30:sc= -2.75 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 176:sc= -0.465 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 143:sc= 1.22 (180deg=0.125) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 30:sc= -0.0642 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N ALA A 2 -4.241 15.087 8.804 1.00 35.11 N ATOM 21 CA ALA A 2 -5.555 14.476 8.954 1.00 35.11 C ATOM 22 C ALA A 2 -5.767 13.384 7.927 1.00 35.11 C ATOM 23 O ALA A 2 -6.319 12.329 8.237 1.00 35.11 O ATOM 24 CB ALA A 2 -6.649 15.526 8.861 1.00 35.11 C ATOM 0 HA ALA A 2 -5.604 14.019 9.942 1.00 35.11 H new ATOM 0 HB1 ALA A 2 -7.622 15.049 8.976 1.00 35.11 H new ATOM 0 HB2 ALA A 2 -6.512 16.265 9.650 1.00 35.11 H new ATOM 0 HB3 ALA A 2 -6.599 16.019 7.890 1.00 35.11 H new ATOM 30 N GLU A 3 -5.299 13.618 6.710 1.00 71.76 N ATOM 31 CA GLU A 3 -5.417 12.621 5.660 1.00 71.76 C ATOM 32 C GLU A 3 -4.617 11.401 6.065 1.00 71.76 C ATOM 33 O GLU A 3 -5.080 10.267 5.954 1.00 71.76 O ATOM 34 CB GLU A 3 -4.879 13.172 4.338 1.00 71.76 C ATOM 35 CG GLU A 3 -5.363 14.575 4.025 1.00 71.76 C ATOM 36 CD GLU A 3 -4.349 15.648 4.387 1.00 71.76 C ATOM 37 OE1 GLU A 3 -3.224 15.294 4.801 1.00 71.76 O ATOM 38 OE2 GLU A 3 -4.682 16.845 4.256 1.00 71.76 O ATOM 0 H GLU A 3 -4.838 14.483 6.428 1.00 71.76 H new ATOM 0 HA GLU A 3 -6.466 12.358 5.522 1.00 71.76 H new ATOM 0 HB2 GLU A 3 -3.789 13.171 4.370 1.00 71.76 H new ATOM 0 HB3 GLU A 3 -5.175 12.505 3.528 1.00 71.76 H new ATOM 0 HG2 GLU A 3 -5.594 14.645 2.962 1.00 71.76 H new ATOM 0 HG3 GLU A 3 -6.291 14.762 4.566 1.00 71.76 H new ATOM 45 N TYR A 4 -3.406 11.655 6.544 1.00112.05 N ATOM 46 CA TYR A 4 -2.527 10.590 6.982 1.00112.05 C ATOM 47 C TYR A 4 -3.158 9.827 8.144 1.00112.05 C ATOM 48 O TYR A 4 -3.094 8.599 8.194 1.00112.05 O ATOM 49 CB TYR A 4 -1.155 11.144 7.370 1.00112.05 C ATOM 50 CG TYR A 4 -0.131 10.076 7.635 1.00112.05 C ATOM 51 CD1 TYR A 4 0.300 9.230 6.620 1.00112.05 C ATOM 52 CD2 TYR A 4 0.413 9.920 8.896 1.00112.05 C ATOM 53 CE1 TYR A 4 1.247 8.255 6.860 1.00112.05 C ATOM 54 CE2 TYR A 4 1.357 8.951 9.145 1.00112.05 C ATOM 55 CZ TYR A 4 1.773 8.120 8.125 1.00112.05 C ATOM 56 OH TYR A 4 2.716 7.152 8.370 1.00112.05 O ATOM 0 H TYR A 4 -3.014 12.592 6.637 1.00112.05 H new ATOM 0 HA TYR A 4 -2.384 9.896 6.154 1.00112.05 H new ATOM 0 HB2 TYR A 4 -0.794 11.792 6.571 1.00112.05 H new ATOM 0 HB3 TYR A 4 -1.261 11.764 8.260 1.00112.05 H new ATOM 0 HD1 TYR A 4 -0.113 9.337 5.628 1.00112.05 H new ATOM 0 HD2 TYR A 4 0.092 10.569 9.698 1.00112.05 H new ATOM 0 HE1 TYR A 4 1.573 7.604 6.062 1.00112.05 H new ATOM 0 HE2 TYR A 4 1.771 8.841 10.136 1.00112.05 H new ATOM 0 HH TYR A 4 3.593 7.464 8.063 1.00112.05 H new ATOM 66 N GLY A 5 -3.795 10.558 9.073 1.00 23.54 N ATOM 67 CA GLY A 5 -4.447 9.901 10.196 1.00 23.54 C ATOM 68 C GLY A 5 -5.511 8.938 9.713 1.00 23.54 C ATOM 69 O GLY A 5 -5.591 7.795 10.162 1.00 23.54 O ATOM 0 H GLY A 5 -3.867 11.575 9.064 1.00 23.54 H new ATOM 0 HA2 GLY A 5 -3.706 9.364 10.789 1.00 23.54 H new ATOM 0 HA3 GLY A 5 -4.897 10.649 10.849 1.00 23.54 H new ATOM 73 N THR A 6 -6.305 9.413 8.761 1.00 90.84 N ATOM 74 CA THR A 6 -7.355 8.627 8.152 1.00 90.84 C ATOM 75 C THR A 6 -6.755 7.532 7.290 1.00 90.84 C ATOM 76 O THR A 6 -7.271 6.425 7.242 1.00 90.84 O ATOM 77 CB THR A 6 -8.265 9.541 7.312 1.00 90.84 C ATOM 78 OG1 THR A 6 -8.914 10.499 8.155 1.00 90.84 O ATOM 79 CG2 THR A 6 -9.297 8.752 6.539 1.00 90.84 C ATOM 0 H THR A 6 -6.233 10.361 8.392 1.00 90.84 H new ATOM 0 HA THR A 6 -7.953 8.158 8.933 1.00 90.84 H new ATOM 0 HB THR A 6 -7.634 10.059 6.590 1.00 90.84 H new ATOM 0 HG1 THR A 6 -8.294 11.231 8.356 1.00 90.84 H new ATOM 0 HG21 THR A 6 -9.918 9.435 5.960 1.00 90.84 H new ATOM 0 HG22 THR A 6 -8.795 8.058 5.865 1.00 90.84 H new ATOM 0 HG23 THR A 6 -9.923 8.193 7.234 1.00 90.84 H new ATOM 87 N LEU A 7 -5.651 7.841 6.623 1.00 63.89 N ATOM 88 CA LEU A 7 -4.975 6.859 5.784 1.00 63.89 C ATOM 89 C LEU A 7 -4.676 5.608 6.589 1.00 63.89 C ATOM 90 O LEU A 7 -5.123 4.508 6.263 1.00 63.89 O ATOM 91 CB LEU A 7 -3.660 7.428 5.258 1.00 63.89 C ATOM 92 CG LEU A 7 -2.775 6.414 4.533 1.00 63.89 C ATOM 93 CD1 LEU A 7 -3.468 5.921 3.280 1.00 63.89 C ATOM 94 CD2 LEU A 7 -1.405 7.005 4.230 1.00 63.89 C ATOM 0 H LEU A 7 -5.206 8.759 6.646 1.00 63.89 H new ATOM 0 HA LEU A 7 -5.629 6.615 4.947 1.00 63.89 H new ATOM 0 HB2 LEU A 7 -3.881 8.250 4.578 1.00 63.89 H new ATOM 0 HB3 LEU A 7 -3.100 7.848 6.094 1.00 63.89 H new ATOM 0 HG LEU A 7 -2.613 5.556 5.186 1.00 63.89 H new ATOM 0 HD11 LEU A 7 -2.829 5.199 2.771 1.00 63.89 H new ATOM 0 HD12 LEU A 7 -4.411 5.445 3.549 1.00 63.89 H new ATOM 0 HD13 LEU A 7 -3.663 6.764 2.617 1.00 63.89 H new ATOM 0 HD21 LEU A 7 -0.795 6.264 3.714 1.00 63.89 H new ATOM 0 HD22 LEU A 7 -1.520 7.884 3.596 1.00 63.89 H new ATOM 0 HD23 LEU A 7 -0.918 7.291 5.162 1.00 63.89 H new ATOM 106 N LEU A 8 -3.926 5.806 7.659 1.00 67.93 N ATOM 107 CA LEU A 8 -3.562 4.727 8.545 1.00 67.93 C ATOM 108 C LEU A 8 -4.814 4.072 9.111 1.00 67.93 C ATOM 109 O LEU A 8 -4.881 2.857 9.241 1.00 67.93 O ATOM 110 CB LEU A 8 -2.671 5.264 9.663 1.00 67.93 C ATOM 111 CG LEU A 8 -1.162 5.332 9.353 1.00 67.93 C ATOM 112 CD1 LEU A 8 -0.887 5.766 7.916 1.00 67.93 C ATOM 113 CD2 LEU A 8 -0.459 6.267 10.326 1.00 67.93 C ATOM 0 H LEU A 8 -3.556 6.716 7.933 1.00 67.93 H new ATOM 0 HA LEU A 8 -3.006 3.970 7.991 1.00 67.93 H new ATOM 0 HB2 LEU A 8 -3.013 6.265 9.924 1.00 67.93 H new ATOM 0 HB3 LEU A 8 -2.812 4.639 10.545 1.00 67.93 H new ATOM 0 HG LEU A 8 -0.765 4.324 9.472 1.00 67.93 H new ATOM 0 HD11 LEU A 8 0.189 5.799 7.746 1.00 67.93 H new ATOM 0 HD12 LEU A 8 -1.342 5.054 7.227 1.00 67.93 H new ATOM 0 HD13 LEU A 8 -1.312 6.756 7.747 1.00 67.93 H new ATOM 0 HD21 LEU A 8 0.605 6.303 10.092 1.00 67.93 H new ATOM 0 HD22 LEU A 8 -0.883 7.267 10.240 1.00 67.93 H new ATOM 0 HD23 LEU A 8 -0.595 5.902 11.344 1.00 67.93 H new ATOM 125 N GLN A 9 -5.823 4.888 9.402 1.00 42.21 N ATOM 126 CA GLN A 9 -7.084 4.389 9.916 1.00 42.21 C ATOM 127 C GLN A 9 -7.774 3.533 8.850 1.00 42.21 C ATOM 128 O GLN A 9 -8.380 2.510 9.160 1.00 42.21 O ATOM 129 CB GLN A 9 -7.929 5.608 10.349 1.00 42.21 C ATOM 130 CG GLN A 9 -9.438 5.434 10.302 1.00 42.21 C ATOM 131 CD GLN A 9 -10.114 5.755 11.619 1.00 42.21 C ATOM 132 OE1 GLN A 9 -10.580 6.874 11.837 1.00 42.21 O ATOM 133 NE2 GLN A 9 -10.167 4.769 12.510 1.00 42.21 N ATOM 0 H GLN A 9 -5.786 5.901 9.288 1.00 42.21 H new ATOM 0 HA GLN A 9 -6.940 3.743 10.782 1.00 42.21 H new ATOM 0 HB2 GLN A 9 -7.647 5.875 11.368 1.00 42.21 H new ATOM 0 HB3 GLN A 9 -7.662 6.452 9.713 1.00 42.21 H new ATOM 0 HG2 GLN A 9 -9.848 6.078 9.524 1.00 42.21 H new ATOM 0 HG3 GLN A 9 -9.671 4.407 10.022 1.00 42.21 H new ATOM 0 HE21 GLN A 9 -9.768 3.857 12.286 1.00 42.21 H new ATOM 0 HE22 GLN A 9 -10.607 4.924 13.417 1.00 42.21 H new ATOM 142 N ASP A 10 -7.680 3.967 7.600 1.00 76.39 N ATOM 143 CA ASP A 10 -8.296 3.246 6.493 1.00 76.39 C ATOM 144 C ASP A 10 -7.724 1.844 6.349 1.00 76.39 C ATOM 145 O ASP A 10 -8.480 0.874 6.303 1.00 76.39 O ATOM 146 CB ASP A 10 -8.132 4.024 5.185 1.00 76.39 C ATOM 147 CG ASP A 10 -8.907 5.331 5.180 1.00 76.39 C ATOM 148 OD1 ASP A 10 -9.682 5.569 6.131 1.00 76.39 O ATOM 149 OD2 ASP A 10 -8.735 6.118 4.226 1.00 76.39 O ATOM 0 H ASP A 10 -7.183 4.815 7.327 1.00 76.39 H new ATOM 0 HA ASP A 10 -9.359 3.151 6.716 1.00 76.39 H new ATOM 0 HB2 ASP A 10 -7.075 4.232 5.021 1.00 76.39 H new ATOM 0 HB3 ASP A 10 -8.467 3.404 4.354 1.00 76.39 H new ATOM 154 N LEU A 11 -6.395 1.711 6.316 1.00140.58 N ATOM 155 CA LEU A 11 -5.803 0.387 6.228 1.00140.58 C ATOM 156 C LEU A 11 -6.098 -0.355 7.514 1.00140.58 C ATOM 157 O LEU A 11 -6.358 -1.552 7.492 1.00140.58 O ATOM 158 CB LEU A 11 -4.315 0.448 5.912 1.00140.58 C ATOM 159 CG LEU A 11 -3.411 0.890 7.053 1.00140.58 C ATOM 160 CD1 LEU A 11 -2.943 -0.326 7.843 1.00140.58 C ATOM 161 CD2 LEU A 11 -2.232 1.682 6.494 1.00140.58 C ATOM 0 H LEU A 11 -5.730 2.484 6.348 1.00140.58 H new ATOM 0 HA LEU A 11 -6.247 -0.159 5.396 1.00140.58 H new ATOM 0 HB2 LEU A 11 -3.993 -0.539 5.581 1.00140.58 H new ATOM 0 HB3 LEU A 11 -4.169 1.129 5.074 1.00140.58 H new ATOM 0 HG LEU A 11 -3.963 1.538 7.733 1.00140.58 H new ATOM 0 HD11 LEU A 11 -2.296 -0.003 8.659 1.00140.58 H new ATOM 0 HD12 LEU A 11 -3.808 -0.850 8.251 1.00140.58 H new ATOM 0 HD13 LEU A 11 -2.390 -0.997 7.185 1.00140.58 H new ATOM 0 HD21 LEU A 11 -1.585 1.998 7.312 1.00140.58 H new ATOM 0 HD22 LEU A 11 -1.666 1.055 5.806 1.00140.58 H new ATOM 0 HD23 LEU A 11 -2.602 2.560 5.964 1.00140.58 H new ATOM 173 N THR A 12 -6.134 0.387 8.631 1.00103.83 N ATOM 174 CA THR A 12 -6.485 -0.191 9.913 1.00103.83 C ATOM 175 C THR A 12 -7.902 -0.757 9.820 1.00103.83 C ATOM 176 O THR A 12 -8.197 -1.824 10.353 1.00103.83 O ATOM 177 CB THR A 12 -6.413 0.837 11.053 1.00103.83 C ATOM 178 OG1 THR A 12 -5.107 1.407 11.132 1.00103.83 O ATOM 179 CG2 THR A 12 -6.732 0.179 12.369 1.00103.83 C ATOM 0 H THR A 12 -5.923 1.385 8.661 1.00103.83 H new ATOM 0 HA THR A 12 -5.766 -0.977 10.142 1.00103.83 H new ATOM 0 HB THR A 12 -7.141 1.621 10.845 1.00103.83 H new ATOM 0 HG1 THR A 12 -5.114 2.299 10.725 1.00103.83 H new ATOM 0 HG21 THR A 12 -6.677 0.918 13.168 1.00103.83 H new ATOM 0 HG22 THR A 12 -7.737 -0.241 12.331 1.00103.83 H new ATOM 0 HG23 THR A 12 -6.013 -0.617 12.562 1.00103.83 H new ATOM 187 N ASN A 13 -8.766 -0.046 9.095 1.00 36.97 N ATOM 188 CA ASN A 13 -10.134 -0.505 8.888 1.00 36.97 C ATOM 189 C ASN A 13 -10.110 -1.813 8.100 1.00 36.97 C ATOM 190 O ASN A 13 -10.940 -2.696 8.311 1.00 36.97 O ATOM 191 CB ASN A 13 -10.965 0.548 8.151 1.00 36.97 C ATOM 192 CG ASN A 13 -11.139 1.822 8.957 1.00 36.97 C ATOM 193 OD1 ASN A 13 -10.915 1.838 10.168 1.00 36.97 O ATOM 194 ND2 ASN A 13 -11.546 2.895 8.288 1.00 36.97 N ATOM 0 H ASN A 13 -8.543 0.842 8.646 1.00 36.97 H new ATOM 0 HA ASN A 13 -10.601 -0.671 9.859 1.00 36.97 H new ATOM 0 HB2 ASN A 13 -10.485 0.786 7.202 1.00 36.97 H new ATOM 0 HB3 ASN A 13 -11.946 0.133 7.917 1.00 36.97 H new ATOM 0 HD21 ASN A 13 -11.685 3.779 8.778 1.00 36.97 H new ATOM 0 HD22 ASN A 13 -11.719 2.835 7.285 1.00 36.97 H new ATOM 201 N ASN A 14 -9.121 -1.937 7.208 1.00 84.59 N ATOM 202 CA ASN A 14 -8.955 -3.149 6.409 1.00 84.59 C ATOM 203 C ASN A 14 -7.966 -4.111 7.077 1.00 84.59 C ATOM 204 O ASN A 14 -7.650 -5.167 6.529 1.00 84.59 O ATOM 205 CB ASN A 14 -8.461 -2.798 5.002 1.00 84.59 C ATOM 206 CG ASN A 14 -9.268 -1.692 4.334 1.00 84.59 C ATOM 207 OD1 ASN A 14 -8.740 -0.951 3.506 1.00 84.59 O ATOM 208 ND2 ASN A 14 -10.547 -1.567 4.685 1.00 84.59 N ATOM 0 H ASN A 14 -8.427 -1.213 7.024 1.00 84.59 H new ATOM 0 HA ASN A 14 -9.926 -3.639 6.336 1.00 84.59 H new ATOM 0 HB2 ASN A 14 -7.416 -2.492 5.058 1.00 84.59 H new ATOM 0 HB3 ASN A 14 -8.498 -3.691 4.379 1.00 84.59 H new ATOM 0 HD21 ASN A 14 -11.123 -0.838 4.263 1.00 84.59 H new ATOM 0 HD22 ASN A 14 -10.951 -2.200 5.375 1.00 84.59 H new ATOM 215 N ILE A 15 -7.464 -3.725 8.251 1.00120.44 N ATOM 216 CA ILE A 15 -6.502 -4.515 8.979 1.00120.44 C ATOM 217 C ILE A 15 -7.167 -5.495 9.947 1.00120.44 C ATOM 218 O ILE A 15 -7.861 -5.097 10.883 1.00120.44 O ATOM 219 CB ILE A 15 -5.504 -3.559 9.709 1.00120.44 C ATOM 220 CG1 ILE A 15 -4.097 -4.063 9.563 1.00120.44 C ATOM 221 CG2 ILE A 15 -5.806 -3.321 11.187 1.00120.44 C ATOM 222 CD1 ILE A 15 -3.869 -5.395 10.228 1.00120.44 C ATOM 0 H ILE A 15 -7.721 -2.853 8.714 1.00120.44 H new ATOM 0 HA ILE A 15 -5.950 -5.133 8.270 1.00120.44 H new ATOM 0 HB ILE A 15 -5.627 -2.594 9.217 1.00120.44 H new ATOM 0 HG12 ILE A 15 -3.857 -4.148 8.503 1.00120.44 H new ATOM 0 HG13 ILE A 15 -3.410 -3.331 9.987 1.00120.44 H new ATOM 0 HG21 ILE A 15 -5.060 -2.646 11.607 1.00120.44 H new ATOM 0 HG22 ILE A 15 -6.796 -2.877 11.289 1.00120.44 H new ATOM 0 HG23 ILE A 15 -5.777 -4.270 11.722 1.00120.44 H new ATOM 0 HD11 ILE A 15 -2.833 -5.701 10.084 1.00120.44 H new ATOM 0 HD12 ILE A 15 -4.078 -5.310 11.294 1.00120.44 H new ATOM 0 HD13 ILE A 15 -4.531 -6.140 9.787 1.00120.44 H new ATOM 234 N THR A 16 -6.925 -6.776 9.731 1.00158.94 N ATOM 235 CA THR A 16 -7.462 -7.793 10.604 1.00158.94 C ATOM 236 C THR A 16 -6.492 -8.047 11.725 1.00158.94 C ATOM 237 O THR A 16 -5.298 -7.776 11.593 1.00158.94 O ATOM 238 CB THR A 16 -7.693 -9.125 9.885 1.00158.94 C ATOM 239 OG1 THR A 16 -6.446 -9.661 9.431 1.00158.94 O ATOM 240 CG2 THR A 16 -8.634 -8.955 8.720 1.00158.94 C ATOM 0 H THR A 16 -6.361 -7.132 8.959 1.00158.94 H new ATOM 0 HA THR A 16 -8.420 -7.423 10.968 1.00158.94 H new ATOM 0 HB THR A 16 -8.147 -9.819 10.593 1.00158.94 H new ATOM 0 HG1 THR A 16 -6.603 -10.513 8.974 1.00158.94 H new ATOM 0 HG21 THR A 16 -8.780 -9.916 8.227 1.00158.94 H new ATOM 0 HG22 THR A 16 -9.593 -8.581 9.079 1.00158.94 H new ATOM 0 HG23 THR A 16 -8.210 -8.245 8.010 1.00158.94 H new ATOM 248 N LEU A 17 -6.984 -8.606 12.811 1.00 50.69 N ATOM 249 CA LEU A 17 -6.114 -8.935 13.927 1.00 50.69 C ATOM 250 C LEU A 17 -5.068 -9.943 13.459 1.00 50.69 C ATOM 251 O LEU A 17 -3.909 -9.900 13.873 1.00 50.69 O ATOM 252 CB LEU A 17 -6.907 -9.496 15.104 1.00 50.69 C ATOM 253 CG LEU A 17 -6.093 -9.683 16.382 1.00 50.69 C ATOM 254 CD1 LEU A 17 -5.453 -8.364 16.795 1.00 50.69 C ATOM 255 CD2 LEU A 17 -6.972 -10.226 17.497 1.00 50.69 C ATOM 0 H LEU A 17 -7.967 -8.840 12.947 1.00 50.69 H new ATOM 0 HA LEU A 17 -5.622 -8.025 14.272 1.00 50.69 H new ATOM 0 HB2 LEU A 17 -7.742 -8.828 15.314 1.00 50.69 H new ATOM 0 HB3 LEU A 17 -7.332 -10.457 14.815 1.00 50.69 H new ATOM 0 HG LEU A 17 -5.301 -10.407 16.190 1.00 50.69 H new ATOM 0 HD11 LEU A 17 -4.875 -8.510 17.708 1.00 50.69 H new ATOM 0 HD12 LEU A 17 -4.794 -8.015 16.000 1.00 50.69 H new ATOM 0 HD13 LEU A 17 -6.231 -7.622 16.973 1.00 50.69 H new ATOM 0 HD21 LEU A 17 -6.376 -10.353 18.401 1.00 50.69 H new ATOM 0 HD22 LEU A 17 -7.784 -9.526 17.694 1.00 50.69 H new ATOM 0 HD23 LEU A 17 -7.387 -11.188 17.197 1.00 50.69 H new ATOM 267 N GLU A 18 -5.495 -10.835 12.563 1.00107.93 N ATOM 268 CA GLU A 18 -4.609 -11.841 12.001 1.00107.93 C ATOM 269 C GLU A 18 -3.578 -11.176 11.108 1.00107.93 C ATOM 270 O GLU A 18 -2.384 -11.468 11.191 1.00107.93 O ATOM 271 CB GLU A 18 -5.413 -12.852 11.182 1.00107.93 C ATOM 272 CG GLU A 18 -6.402 -13.661 12.004 1.00107.93 C ATOM 273 CD GLU A 18 -7.149 -14.690 11.172 1.00107.93 C ATOM 274 OE1 GLU A 18 -7.051 -14.636 9.927 1.00107.93 O ATOM 275 OE2 GLU A 18 -7.830 -15.551 11.768 1.00107.93 O ATOM 0 H GLU A 18 -6.453 -10.876 12.214 1.00107.93 H new ATOM 0 HA GLU A 18 -4.105 -12.360 12.816 1.00107.93 H new ATOM 0 HB2 GLU A 18 -5.954 -12.322 10.398 1.00107.93 H new ATOM 0 HB3 GLU A 18 -4.723 -13.535 10.687 1.00107.93 H new ATOM 0 HG2 GLU A 18 -5.871 -14.167 12.810 1.00107.93 H new ATOM 0 HG3 GLU A 18 -7.120 -12.986 12.470 1.00107.93 H new ATOM 282 N ASP A 19 -4.050 -10.265 10.262 1.00 35.40 N ATOM 283 CA ASP A 19 -3.171 -9.539 9.361 1.00 35.40 C ATOM 284 C ASP A 19 -2.140 -8.746 10.147 1.00 35.40 C ATOM 285 O ASP A 19 -0.970 -8.706 9.778 1.00 35.40 O ATOM 286 CB ASP A 19 -3.973 -8.608 8.448 1.00 35.40 C ATOM 287 CG ASP A 19 -4.708 -9.355 7.351 1.00 35.40 C ATOM 288 OD1 ASP A 19 -4.407 -10.549 7.135 1.00 35.40 O ATOM 289 OD2 ASP A 19 -5.587 -8.744 6.707 1.00 35.40 O ATOM 0 H ASP A 19 -5.036 -10.015 10.184 1.00 35.40 H new ATOM 0 HA ASP A 19 -2.651 -10.266 8.737 1.00 35.40 H new ATOM 0 HB2 ASP A 19 -4.693 -8.050 9.047 1.00 35.40 H new ATOM 0 HB3 ASP A 19 -3.300 -7.879 7.997 1.00 35.40 H new ATOM 294 N LEU A 20 -2.575 -8.124 11.245 1.00 45.47 N ATOM 295 CA LEU A 20 -1.664 -7.346 12.079 1.00 45.47 C ATOM 296 C LEU A 20 -0.505 -8.202 12.548 1.00 45.47 C ATOM 297 O LEU A 20 0.648 -7.812 12.419 1.00 45.47 O ATOM 298 CB LEU A 20 -2.387 -6.739 13.288 1.00 45.47 C ATOM 299 CG LEU A 20 -2.520 -5.215 13.269 1.00 45.47 C ATOM 300 CD1 LEU A 20 -3.061 -4.714 14.605 1.00 45.47 C ATOM 301 CD2 LEU A 20 -1.184 -4.544 12.926 1.00 45.47 C ATOM 0 H LEU A 20 -3.541 -8.144 11.572 1.00 45.47 H new ATOM 0 HA LEU A 20 -1.280 -6.530 11.467 1.00 45.47 H new ATOM 0 HB2 LEU A 20 -3.384 -7.174 13.351 1.00 45.47 H new ATOM 0 HB3 LEU A 20 -1.855 -7.030 14.193 1.00 45.47 H new ATOM 0 HG LEU A 20 -3.230 -4.944 12.487 1.00 45.47 H new ATOM 0 HD11 LEU A 20 -3.150 -3.628 14.577 1.00 45.47 H new ATOM 0 HD12 LEU A 20 -4.041 -5.154 14.789 1.00 45.47 H new ATOM 0 HD13 LEU A 20 -2.378 -5.001 15.405 1.00 45.47 H new ATOM 0 HD21 LEU A 20 -1.311 -3.461 12.920 1.00 45.47 H new ATOM 0 HD22 LEU A 20 -0.437 -4.818 13.672 1.00 45.47 H new ATOM 0 HD23 LEU A 20 -0.852 -4.875 11.942 1.00 45.47 H new ATOM 313 N GLU A 21 -0.813 -9.386 13.066 1.00 91.26 N ATOM 314 CA GLU A 21 0.229 -10.292 13.526 1.00 91.26 C ATOM 315 C GLU A 21 1.170 -10.635 12.381 1.00 91.26 C ATOM 316 O GLU A 21 2.344 -10.925 12.599 1.00 91.26 O ATOM 317 CB GLU A 21 -0.364 -11.567 14.114 1.00 91.26 C ATOM 318 CG GLU A 21 -1.262 -11.324 15.319 1.00 91.26 C ATOM 319 CD GLU A 21 -1.773 -12.608 15.946 1.00 91.26 C ATOM 320 OE1 GLU A 21 -1.597 -13.683 15.335 1.00 91.26 O ATOM 321 OE2 GLU A 21 -2.352 -12.538 17.052 1.00 91.26 O ATOM 0 H GLU A 21 -1.764 -9.737 13.177 1.00 91.26 H new ATOM 0 HA GLU A 21 0.789 -9.786 14.312 1.00 91.26 H new ATOM 0 HB2 GLU A 21 -0.937 -12.080 13.342 1.00 91.26 H new ATOM 0 HB3 GLU A 21 0.447 -12.234 14.405 1.00 91.26 H new ATOM 0 HG2 GLU A 21 -0.710 -10.755 16.067 1.00 91.26 H new ATOM 0 HG3 GLU A 21 -2.111 -10.712 15.015 1.00 91.26 H new ATOM 328 N GLN A 22 0.657 -10.562 11.154 1.00 87.96 N ATOM 329 CA GLN A 22 1.477 -10.829 9.986 1.00 87.96 C ATOM 330 C GLN A 22 2.413 -9.654 9.800 1.00 87.96 C ATOM 331 O GLN A 22 3.612 -9.821 9.574 1.00 87.96 O ATOM 332 CB GLN A 22 0.619 -11.055 8.741 1.00 87.96 C ATOM 333 CG GLN A 22 1.418 -11.523 7.537 1.00 87.96 C ATOM 334 CD GLN A 22 0.536 -11.886 6.356 1.00 87.96 C ATOM 335 OE1 GLN A 22 0.191 -13.050 6.160 1.00 87.96 O ATOM 336 NE2 GLN A 22 0.155 -10.885 5.568 1.00 87.96 N ATOM 0 H GLN A 22 -0.313 -10.322 10.949 1.00 87.96 H new ATOM 0 HA GLN A 22 2.049 -11.745 10.136 1.00 87.96 H new ATOM 0 HB2 GLN A 22 -0.150 -11.794 8.967 1.00 87.96 H new ATOM 0 HB3 GLN A 22 0.105 -10.127 8.489 1.00 87.96 H new ATOM 0 HG2 GLN A 22 2.113 -10.738 7.239 1.00 87.96 H new ATOM 0 HG3 GLN A 22 2.017 -12.389 7.818 1.00 87.96 H new ATOM 0 HE21 GLN A 22 0.464 -9.934 5.767 1.00 87.96 H new ATOM 0 HE22 GLN A 22 -0.446 -11.069 4.765 1.00 87.96 H new ATOM 345 N LEU A 23 1.855 -8.454 9.968 1.00 99.30 N ATOM 346 CA LEU A 23 2.629 -7.233 9.897 1.00 99.30 C ATOM 347 C LEU A 23 3.662 -7.269 11.014 1.00 99.30 C ATOM 348 O LEU A 23 4.849 -7.055 10.796 1.00 99.30 O ATOM 349 CB LEU A 23 1.706 -6.018 10.088 1.00 99.30 C ATOM 350 CG LEU A 23 0.528 -5.909 9.116 1.00 99.30 C ATOM 351 CD1 LEU A 23 -0.246 -4.619 9.356 1.00 99.30 C ATOM 352 CD2 LEU A 23 1.004 -5.994 7.669 1.00 99.30 C ATOM 0 H LEU A 23 0.863 -8.311 10.155 1.00 99.30 H new ATOM 0 HA LEU A 23 3.117 -7.150 8.926 1.00 99.30 H new ATOM 0 HB2 LEU A 23 1.312 -6.043 11.104 1.00 99.30 H new ATOM 0 HB3 LEU A 23 2.307 -5.113 10.001 1.00 99.30 H new ATOM 0 HG LEU A 23 -0.141 -6.750 9.298 1.00 99.30 H new ATOM 0 HD11 LEU A 23 -1.079 -4.559 8.656 1.00 99.30 H new ATOM 0 HD12 LEU A 23 -0.628 -4.608 10.377 1.00 99.30 H new ATOM 0 HD13 LEU A 23 0.415 -3.765 9.207 1.00 99.30 H new ATOM 0 HD21 LEU A 23 0.148 -5.914 6.999 1.00 99.30 H new ATOM 0 HD22 LEU A 23 1.700 -5.180 7.467 1.00 99.30 H new ATOM 0 HD23 LEU A 23 1.504 -6.949 7.506 1.00 99.30 H new ATOM 364 N LYS A 24 3.173 -7.594 12.210 1.00114.71 N ATOM 365 CA LYS A 24 4.009 -7.706 13.402 1.00114.71 C ATOM 366 C LYS A 24 5.109 -8.742 13.195 1.00114.71 C ATOM 367 O LYS A 24 6.251 -8.539 13.603 1.00114.71 O ATOM 368 CB LYS A 24 3.157 -8.114 14.610 1.00114.71 C ATOM 369 CG LYS A 24 2.145 -7.059 15.038 1.00114.71 C ATOM 370 CD LYS A 24 1.378 -7.490 16.285 1.00114.71 C ATOM 371 CE LYS A 24 -0.103 -7.702 15.997 1.00114.71 C ATOM 372 NZ LYS A 24 -0.797 -8.396 17.119 1.00114.71 N ATOM 0 H LYS A 24 2.186 -7.787 12.379 1.00114.71 H new ATOM 0 HA LYS A 24 4.465 -6.733 13.586 1.00114.71 H new ATOM 0 HB2 LYS A 24 2.627 -9.036 14.373 1.00114.71 H new ATOM 0 HB3 LYS A 24 3.817 -8.332 15.450 1.00114.71 H new ATOM 0 HG2 LYS A 24 2.660 -6.118 15.234 1.00114.71 H new ATOM 0 HG3 LYS A 24 1.444 -6.875 14.224 1.00114.71 H new ATOM 0 HD2 LYS A 24 1.808 -8.413 16.674 1.00114.71 H new ATOM 0 HD3 LYS A 24 1.492 -6.733 17.061 1.00114.71 H new ATOM 0 HE2 LYS A 24 -0.579 -6.738 15.817 1.00114.71 H new ATOM 0 HE3 LYS A 24 -0.215 -8.287 15.084 1.00114.71 H new ATOM 0 HZ1 LYS A 24 -1.587 -8.959 16.744 1.00114.71 H new ATOM 0 HZ2 LYS A 24 -0.126 -9.023 17.607 1.00114.71 H new ATOM 0 HZ3 LYS A 24 -1.163 -7.691 17.790 1.00114.71 H new ATOM 386 N SER A 25 4.755 -9.848 12.538 1.00 75.52 N ATOM 387 CA SER A 25 5.716 -10.915 12.258 1.00 75.52 C ATOM 388 C SER A 25 6.846 -10.355 11.415 1.00 75.52 C ATOM 389 O SER A 25 8.022 -10.641 11.637 1.00 75.52 O ATOM 390 CB SER A 25 5.035 -12.073 11.519 1.00 75.52 C ATOM 391 OG SER A 25 4.047 -12.686 12.329 1.00 75.52 O ATOM 0 H SER A 25 3.813 -10.028 12.191 1.00 75.52 H new ATOM 0 HA SER A 25 6.112 -11.297 13.199 1.00 75.52 H new ATOM 0 HB2 SER A 25 4.579 -11.704 10.601 1.00 75.52 H new ATOM 0 HB3 SER A 25 5.782 -12.812 11.229 1.00 75.52 H new ATOM 0 HG SER A 25 3.528 -11.995 12.791 1.00 75.52 H new ATOM 397 N ALA A 26 6.462 -9.514 10.473 1.00 32.46 N ATOM 398 CA ALA A 26 7.401 -8.842 9.608 1.00 32.46 C ATOM 399 C ALA A 26 8.111 -7.741 10.388 1.00 32.46 C ATOM 400 O ALA A 26 9.280 -7.443 10.147 1.00 32.46 O ATOM 401 CB ALA A 26 6.677 -8.281 8.396 1.00 32.46 C ATOM 0 H ALA A 26 5.486 -9.280 10.289 1.00 32.46 H new ATOM 0 HA ALA A 26 8.150 -9.550 9.253 1.00 32.46 H new ATOM 0 HB1 ALA A 26 7.392 -7.775 7.747 1.00 32.46 H new ATOM 0 HB2 ALA A 26 6.202 -9.094 7.848 1.00 32.46 H new ATOM 0 HB3 ALA A 26 5.917 -7.571 8.722 1.00 32.46 H new ATOM 407 N CYS A 27 7.380 -7.140 11.332 1.00 54.89 N ATOM 408 CA CYS A 27 7.928 -6.072 12.157 1.00 54.89 C ATOM 409 C CYS A 27 8.735 -6.605 13.324 1.00 54.89 C ATOM 410 O CYS A 27 9.276 -5.821 14.097 1.00 54.89 O ATOM 411 CB CYS A 27 6.834 -5.176 12.720 1.00 54.89 C ATOM 412 SG CYS A 27 5.748 -4.447 11.483 1.00 54.89 S ATOM 0 H CYS A 27 6.410 -7.378 11.539 1.00 54.89 H new ATOM 0 HA CYS A 27 8.577 -5.499 11.495 1.00 54.89 H new ATOM 0 HB2 CYS A 27 6.230 -5.757 13.417 1.00 54.89 H new ATOM 0 HB3 CYS A 27 7.299 -4.374 13.293 1.00 54.89 H new ATOM 0 HG CYS A 27 5.029 -3.514 12.033 1.00 54.89 H new ATOM 418 N LYS A 28 8.824 -7.926 13.482 1.00157.95 N ATOM 419 CA LYS A 28 9.583 -8.483 14.609 1.00157.95 C ATOM 420 C LYS A 28 10.984 -7.875 14.660 1.00157.95 C ATOM 421 O LYS A 28 11.548 -7.665 15.733 1.00157.95 O ATOM 422 CB LYS A 28 9.680 -10.004 14.495 1.00157.95 C ATOM 423 CG LYS A 28 8.334 -10.699 14.537 1.00157.95 C ATOM 424 CD LYS A 28 7.679 -10.553 15.900 1.00157.95 C ATOM 425 CE LYS A 28 6.344 -11.278 15.955 1.00157.95 C ATOM 426 NZ LYS A 28 6.160 -12.007 17.240 1.00157.95 N ATOM 0 H LYS A 28 8.395 -8.616 12.865 1.00157.95 H new ATOM 0 HA LYS A 28 9.055 -8.235 15.530 1.00157.95 H new ATOM 0 HB2 LYS A 28 10.183 -10.259 13.562 1.00157.95 H new ATOM 0 HB3 LYS A 28 10.301 -10.383 15.307 1.00157.95 H new ATOM 0 HG2 LYS A 28 7.682 -10.279 13.771 1.00157.95 H new ATOM 0 HG3 LYS A 28 8.461 -11.756 14.304 1.00157.95 H new ATOM 0 HD2 LYS A 28 8.342 -10.950 16.668 1.00157.95 H new ATOM 0 HD3 LYS A 28 7.530 -9.496 16.122 1.00157.95 H new ATOM 0 HE2 LYS A 28 5.535 -10.559 15.827 1.00157.95 H new ATOM 0 HE3 LYS A 28 6.279 -11.982 15.126 1.00157.95 H new ATOM 0 HZ1 LYS A 28 5.238 -12.488 17.237 1.00157.95 H new ATOM 0 HZ2 LYS A 28 6.917 -12.711 17.351 1.00157.95 H new ATOM 0 HZ3 LYS A 28 6.196 -11.332 18.030 1.00157.95 H new ATOM 440 N GLU A 29 11.520 -7.586 13.483 1.00243.70 N ATOM 441 CA GLU A 29 12.839 -6.986 13.363 1.00243.70 C ATOM 442 C GLU A 29 12.849 -5.490 13.707 1.00243.70 C ATOM 443 O GLU A 29 13.816 -4.995 14.288 1.00243.70 O ATOM 444 CB GLU A 29 13.369 -7.190 11.947 1.00243.70 C ATOM 445 CG GLU A 29 13.628 -8.648 11.612 1.00243.70 C ATOM 446 CD GLU A 29 14.728 -9.259 12.458 1.00243.70 C ATOM 447 OE1 GLU A 29 15.506 -8.494 13.068 1.00243.70 O ATOM 448 OE2 GLU A 29 14.814 -10.504 12.510 1.00243.70 O ATOM 0 H GLU A 29 11.056 -7.760 12.591 1.00243.70 H new ATOM 0 HA GLU A 29 13.483 -7.485 14.087 1.00243.70 H new ATOM 0 HB2 GLU A 29 12.652 -6.782 11.235 1.00243.70 H new ATOM 0 HB3 GLU A 29 14.294 -6.626 11.827 1.00243.70 H new ATOM 0 HG2 GLU A 29 12.709 -9.217 11.753 1.00243.70 H new ATOM 0 HG3 GLU A 29 13.897 -8.732 10.559 1.00243.70 H new ATOM 455 N ASP A 30 11.801 -4.762 13.307 1.00108.85 N ATOM 456 CA ASP A 30 11.750 -3.314 13.545 1.00108.85 C ATOM 457 C ASP A 30 11.001 -2.914 14.818 1.00108.85 C ATOM 458 O ASP A 30 11.411 -1.983 15.510 1.00108.85 O ATOM 459 CB ASP A 30 11.129 -2.605 12.338 1.00108.85 C ATOM 460 CG ASP A 30 12.025 -2.660 11.115 1.00108.85 C ATOM 461 OD1 ASP A 30 13.243 -2.882 11.282 1.00108.85 O ATOM 462 OD2 ASP A 30 11.509 -2.483 9.992 1.00108.85 O ATOM 0 H ASP A 30 10.988 -5.143 12.824 1.00108.85 H new ATOM 0 HA ASP A 30 12.784 -2.999 13.687 1.00108.85 H new ATOM 0 HB2 ASP A 30 10.169 -3.065 12.103 1.00108.85 H new ATOM 0 HB3 ASP A 30 10.930 -1.564 12.593 1.00108.85 H new ATOM 467 N ILE A 31 9.892 -3.582 15.109 1.00355.97 N ATOM 468 CA ILE A 31 9.090 -3.245 16.276 1.00355.97 C ATOM 469 C ILE A 31 9.241 -4.287 17.395 1.00355.97 C ATOM 470 O ILE A 31 9.183 -5.490 17.136 1.00355.97 O ATOM 471 CB ILE A 31 7.611 -3.053 15.864 1.00355.97 C ATOM 472 CG1 ILE A 31 6.910 -2.104 16.833 1.00355.97 C ATOM 473 CG2 ILE A 31 6.856 -4.370 15.716 1.00355.97 C ATOM 474 CD1 ILE A 31 6.420 -2.744 18.111 1.00355.97 C ATOM 0 H ILE A 31 9.529 -4.357 14.555 1.00355.97 H new ATOM 0 HA ILE A 31 9.458 -2.303 16.683 1.00355.97 H new ATOM 0 HB ILE A 31 7.609 -2.601 14.872 1.00355.97 H new ATOM 0 HG12 ILE A 31 7.597 -1.297 17.089 1.00355.97 H new ATOM 0 HG13 ILE A 31 6.061 -1.650 16.323 1.00355.97 H new ATOM 0 HG21 ILE A 31 5.825 -4.168 15.426 1.00355.97 H new ATOM 0 HG22 ILE A 31 7.335 -4.980 14.951 1.00355.97 H new ATOM 0 HG23 ILE A 31 6.867 -4.905 16.666 1.00355.97 H new ATOM 0 HD11 ILE A 31 5.937 -1.991 18.733 1.00355.97 H new ATOM 0 HD12 ILE A 31 5.705 -3.531 17.873 1.00355.97 H new ATOM 0 HD13 ILE A 31 7.265 -3.173 18.650 1.00355.97 H new ATOM 486 N PRO A 32 9.461 -3.840 18.654 1.00153.08 N ATOM 487 CA PRO A 32 9.648 -4.752 19.788 1.00153.08 C ATOM 488 C PRO A 32 8.443 -5.647 20.068 1.00153.08 C ATOM 489 O PRO A 32 7.293 -5.217 19.971 1.00153.08 O ATOM 490 CB PRO A 32 9.911 -3.817 20.975 1.00153.08 C ATOM 491 CG PRO A 32 9.365 -2.501 20.555 1.00153.08 C ATOM 492 CD PRO A 32 9.575 -2.429 19.072 1.00153.08 C ATOM 0 HA PRO A 32 10.458 -5.453 19.588 1.00153.08 H new ATOM 0 HB2 PRO A 32 9.420 -4.178 21.878 1.00153.08 H new ATOM 0 HB3 PRO A 32 10.976 -3.750 21.196 1.00153.08 H new ATOM 0 HG2 PRO A 32 8.307 -2.418 20.805 1.00153.08 H new ATOM 0 HG3 PRO A 32 9.878 -1.684 21.063 1.00153.08 H new ATOM 0 HD2 PRO A 32 8.826 -1.802 18.588 1.00153.08 H new ATOM 0 HD3 PRO A 32 10.550 -2.011 18.822 1.00153.08 H new ATOM 500 N SER A 33 8.729 -6.898 20.431 1.00 84.70 N ATOM 501 CA SER A 33 7.687 -7.871 20.745 1.00 84.70 C ATOM 502 C SER A 33 6.884 -7.439 21.966 1.00 84.70 C ATOM 503 O SER A 33 5.692 -7.722 22.071 1.00 84.70 O ATOM 504 CB SER A 33 8.304 -9.249 20.990 1.00 84.70 C ATOM 505 OG SER A 33 7.304 -10.248 21.062 1.00 84.70 O ATOM 0 H SER A 33 9.679 -7.261 20.514 1.00 84.70 H new ATOM 0 HA SER A 33 7.012 -7.927 19.891 1.00 84.70 H new ATOM 0 HB2 SER A 33 9.003 -9.486 20.188 1.00 84.70 H new ATOM 0 HB3 SER A 33 8.876 -9.235 21.917 1.00 84.70 H new ATOM 0 HG SER A 33 7.723 -11.120 21.218 1.00 84.70 H new ATOM 511 N GLU A 34 7.548 -6.746 22.886 1.00109.83 N ATOM 512 CA GLU A 34 6.902 -6.265 24.103 1.00109.83 C ATOM 513 C GLU A 34 5.731 -5.346 23.763 1.00109.83 C ATOM 514 O GLU A 34 4.786 -5.214 24.543 1.00109.83 O ATOM 515 CB GLU A 34 7.914 -5.525 24.979 1.00109.83 C ATOM 516 CG GLU A 34 7.388 -5.168 26.361 1.00109.83 C ATOM 517 CD GLU A 34 7.340 -6.361 27.297 1.00109.83 C ATOM 518 OE1 GLU A 34 8.021 -7.367 27.013 1.00109.83 O ATOM 519 OE2 GLU A 34 6.628 -6.283 28.322 1.00109.83 O ATOM 0 H GLU A 34 8.536 -6.504 22.812 1.00109.83 H new ATOM 0 HA GLU A 34 6.518 -7.124 24.653 1.00109.83 H new ATOM 0 HB2 GLU A 34 8.805 -6.143 25.089 1.00109.83 H new ATOM 0 HB3 GLU A 34 8.220 -4.611 24.470 1.00109.83 H new ATOM 0 HG2 GLU A 34 8.021 -4.395 26.797 1.00109.83 H new ATOM 0 HG3 GLU A 34 6.388 -4.746 26.266 1.00109.83 H new ATOM 526 N LYS A 35 5.798 -4.715 22.592 1.00 73.01 N ATOM 527 CA LYS A 35 4.745 -3.814 22.145 1.00 73.01 C ATOM 528 C LYS A 35 3.777 -4.532 21.212 1.00 73.01 C ATOM 529 O LYS A 35 2.600 -4.198 21.149 1.00 73.01 O ATOM 530 CB LYS A 35 5.368 -2.629 21.416 1.00 73.01 C ATOM 531 CG LYS A 35 6.358 -1.868 22.270 1.00 73.01 C ATOM 532 CD LYS A 35 5.654 -1.036 23.322 1.00 73.01 C ATOM 533 CE LYS A 35 6.649 -0.288 24.196 1.00 73.01 C ATOM 534 NZ LYS A 35 5.978 0.689 25.098 1.00 73.01 N ATOM 0 H LYS A 35 6.573 -4.813 21.937 1.00 73.01 H new ATOM 0 HA LYS A 35 4.192 -3.466 23.017 1.00 73.01 H new ATOM 0 HB2 LYS A 35 5.870 -2.985 20.516 1.00 73.01 H new ATOM 0 HB3 LYS A 35 4.578 -1.951 21.093 1.00 73.01 H new ATOM 0 HG2 LYS A 35 7.038 -2.569 22.753 1.00 73.01 H new ATOM 0 HG3 LYS A 35 6.965 -1.220 21.637 1.00 73.01 H new ATOM 0 HD2 LYS A 35 4.986 -0.324 22.838 1.00 73.01 H new ATOM 0 HD3 LYS A 35 5.035 -1.682 23.944 1.00 73.01 H new ATOM 0 HE2 LYS A 35 7.215 -1.003 24.793 1.00 73.01 H new ATOM 0 HE3 LYS A 35 7.365 0.236 23.563 1.00 73.01 H new ATOM 0 HZ1 LYS A 35 6.693 1.176 25.675 1.00 73.01 H new ATOM 0 HZ2 LYS A 35 5.458 1.387 24.529 1.00 73.01 H new ATOM 0 HZ3 LYS A 35 5.314 0.187 25.721 1.00 73.01 H new ATOM 548 N SER A 36 4.281 -5.530 20.497 1.00 80.12 N ATOM 549 CA SER A 36 3.461 -6.303 19.572 1.00 80.12 C ATOM 550 C SER A 36 2.261 -6.918 20.280 1.00 80.12 C ATOM 551 O SER A 36 1.197 -7.090 19.687 1.00 80.12 O ATOM 552 CB SER A 36 4.307 -7.393 18.926 1.00 80.12 C ATOM 553 OG SER A 36 3.544 -8.164 18.017 1.00 80.12 O ATOM 0 H SER A 36 5.257 -5.824 20.540 1.00 80.12 H new ATOM 0 HA SER A 36 3.085 -5.631 18.801 1.00 80.12 H new ATOM 0 HB2 SER A 36 5.150 -6.941 18.404 1.00 80.12 H new ATOM 0 HB3 SER A 36 4.721 -8.041 19.698 1.00 80.12 H new ATOM 0 HG SER A 36 4.112 -8.855 17.616 1.00 80.12 H new ATOM 559 N GLU A 37 2.441 -7.248 21.550 1.00 42.03 N ATOM 560 CA GLU A 37 1.376 -7.846 22.336 1.00 42.03 C ATOM 561 C GLU A 37 0.189 -6.894 22.469 1.00 42.03 C ATOM 562 O GLU A 37 -0.963 -7.323 22.424 1.00 42.03 O ATOM 563 CB GLU A 37 1.903 -8.243 23.712 1.00 42.03 C ATOM 564 CG GLU A 37 2.988 -9.307 23.648 1.00 42.03 C ATOM 565 CD GLU A 37 3.483 -9.730 25.020 1.00 42.03 C ATOM 566 OE1 GLU A 37 3.137 -9.055 26.014 1.00 42.03 O ATOM 567 OE2 GLU A 37 4.217 -10.736 25.100 1.00 42.03 O ATOM 0 H GLU A 37 3.315 -7.111 22.057 1.00 42.03 H new ATOM 0 HA GLU A 37 1.028 -8.740 21.819 1.00 42.03 H new ATOM 0 HB2 GLU A 37 2.298 -7.359 24.213 1.00 42.03 H new ATOM 0 HB3 GLU A 37 1.076 -8.611 24.319 1.00 42.03 H new ATOM 0 HG2 GLU A 37 2.603 -10.180 23.121 1.00 42.03 H new ATOM 0 HG3 GLU A 37 3.828 -8.928 23.065 1.00 42.03 H new ATOM 574 N GLU A 38 0.469 -5.599 22.616 1.00 75.99 N ATOM 575 CA GLU A 38 -0.602 -4.611 22.734 1.00 75.99 C ATOM 576 C GLU A 38 -1.058 -4.085 21.375 1.00 75.99 C ATOM 577 O GLU A 38 -1.959 -3.250 21.297 1.00 75.99 O ATOM 578 CB GLU A 38 -0.194 -3.443 23.639 1.00 75.99 C ATOM 579 CG GLU A 38 0.844 -2.508 23.030 1.00 75.99 C ATOM 580 CD GLU A 38 1.187 -1.348 23.945 1.00 75.99 C ATOM 581 OE1 GLU A 38 1.130 -1.529 25.179 1.00 75.99 O ATOM 582 OE2 GLU A 38 1.513 -0.259 23.427 1.00 75.99 O ATOM 0 H GLU A 38 1.413 -5.214 22.656 1.00 75.99 H new ATOM 0 HA GLU A 38 -1.445 -5.129 23.192 1.00 75.99 H new ATOM 0 HB2 GLU A 38 -1.084 -2.865 23.889 1.00 75.99 H new ATOM 0 HB3 GLU A 38 0.199 -3.843 24.573 1.00 75.99 H new ATOM 0 HG2 GLU A 38 1.750 -3.072 22.807 1.00 75.99 H new ATOM 0 HG3 GLU A 38 0.469 -2.121 22.083 1.00 75.99 H new ATOM 589 N ILE A 39 -0.444 -4.573 20.309 1.00131.16 N ATOM 590 CA ILE A 39 -0.806 -4.146 18.969 1.00131.16 C ATOM 591 C ILE A 39 -1.929 -5.013 18.417 1.00131.16 C ATOM 592 O ILE A 39 -1.746 -5.781 17.474 1.00131.16 O ATOM 593 CB ILE A 39 0.427 -4.140 18.035 1.00131.16 C ATOM 594 CG1 ILE A 39 1.379 -3.047 18.501 1.00131.16 C ATOM 595 CG2 ILE A 39 0.048 -3.908 16.577 1.00131.16 C ATOM 596 CD1 ILE A 39 2.716 -3.072 17.814 1.00131.16 C ATOM 0 H ILE A 39 0.306 -5.264 20.346 1.00131.16 H new ATOM 0 HA ILE A 39 -1.174 -3.121 19.021 1.00131.16 H new ATOM 0 HB ILE A 39 0.902 -5.119 18.088 1.00131.16 H new ATOM 0 HG12 ILE A 39 0.913 -2.076 18.333 1.00131.16 H new ATOM 0 HG13 ILE A 39 1.532 -3.145 19.576 1.00131.16 H new ATOM 0 HG21 ILE A 39 0.948 -3.913 15.962 1.00131.16 H new ATOM 0 HG22 ILE A 39 -0.623 -4.701 16.245 1.00131.16 H new ATOM 0 HG23 ILE A 39 -0.453 -2.945 16.480 1.00131.16 H new ATOM 0 HD11 ILE A 39 3.338 -2.264 18.199 1.00131.16 H new ATOM 0 HD12 ILE A 39 3.204 -4.028 18.003 1.00131.16 H new ATOM 0 HD13 ILE A 39 2.576 -2.942 16.741 1.00131.16 H new ATOM 608 N THR A 40 -3.097 -4.851 19.016 1.00160.31 N ATOM 609 CA THR A 40 -4.292 -5.582 18.602 1.00160.31 C ATOM 610 C THR A 40 -5.080 -4.805 17.540 1.00160.31 C ATOM 611 O THR A 40 -6.129 -5.254 17.077 1.00160.31 O ATOM 612 CB THR A 40 -5.210 -5.930 19.810 1.00160.31 C ATOM 613 OG1 THR A 40 -6.565 -6.112 19.374 1.00160.31 O ATOM 614 CG2 THR A 40 -5.171 -4.848 20.889 1.00160.31 C ATOM 0 H THR A 40 -3.248 -4.214 19.798 1.00160.31 H new ATOM 0 HA THR A 40 -3.951 -6.519 18.163 1.00160.31 H new ATOM 0 HB THR A 40 -4.831 -6.857 20.241 1.00160.31 H new ATOM 0 HG1 THR A 40 -6.581 -6.249 18.404 1.00160.31 H new ATOM 0 HG21 THR A 40 -5.826 -5.132 21.713 1.00160.31 H new ATOM 0 HG22 THR A 40 -4.151 -4.738 21.257 1.00160.31 H new ATOM 0 HG23 THR A 40 -5.508 -3.901 20.467 1.00160.31 H new ATOM 622 N THR A 41 -4.557 -3.646 17.154 1.00182.91 N ATOM 623 CA THR A 41 -5.172 -2.799 16.152 1.00182.91 C ATOM 624 C THR A 41 -4.124 -2.030 15.396 1.00182.91 C ATOM 625 O THR A 41 -3.096 -1.644 15.954 1.00182.91 O ATOM 626 CB THR A 41 -6.196 -1.791 16.750 1.00182.91 C ATOM 627 OG1 THR A 41 -6.268 -0.598 15.951 1.00182.91 O ATOM 628 CG2 THR A 41 -5.887 -1.397 18.199 1.00182.91 C ATOM 0 H THR A 41 -3.688 -3.270 17.534 1.00182.91 H new ATOM 0 HA THR A 41 -5.713 -3.469 15.484 1.00182.91 H new ATOM 0 HB THR A 41 -7.154 -2.311 16.744 1.00182.91 H new ATOM 0 HG1 THR A 41 -7.169 -0.217 16.013 1.00182.91 H new ATOM 0 HG21 THR A 41 -6.640 -0.693 18.553 1.00182.91 H new ATOM 0 HG22 THR A 41 -5.898 -2.287 18.828 1.00182.91 H new ATOM 0 HG23 THR A 41 -4.903 -0.931 18.247 1.00182.91 H new ATOM 636 N GLY A 42 -4.423 -1.741 14.137 1.00 66.60 N ATOM 637 CA GLY A 42 -3.518 -0.937 13.353 1.00 66.60 C ATOM 638 C GLY A 42 -3.393 0.426 14.002 1.00 66.60 C ATOM 639 O GLY A 42 -2.331 1.049 13.982 1.00 66.60 O ATOM 0 H GLY A 42 -5.267 -2.046 13.652 1.00 66.60 H new ATOM 0 HA2 GLY A 42 -2.542 -1.418 13.292 1.00 66.60 H new ATOM 0 HA3 GLY A 42 -3.888 -0.837 12.333 1.00 66.60 H new ATOM 643 N SER A 43 -4.492 0.852 14.641 1.00 41.24 N ATOM 644 CA SER A 43 -4.510 2.106 15.368 1.00 41.24 C ATOM 645 C SER A 43 -3.545 2.013 16.542 1.00 41.24 C ATOM 646 O SER A 43 -2.793 2.943 16.825 1.00 41.24 O ATOM 647 CB SER A 43 -5.922 2.426 15.864 1.00 41.24 C ATOM 648 OG SER A 43 -6.863 2.345 14.807 1.00 41.24 O ATOM 0 H SER A 43 -5.373 0.339 14.663 1.00 41.24 H new ATOM 0 HA SER A 43 -4.200 2.911 14.702 1.00 41.24 H new ATOM 0 HB2 SER A 43 -6.199 1.731 16.656 1.00 41.24 H new ATOM 0 HB3 SER A 43 -5.941 3.426 16.297 1.00 41.24 H new ATOM 0 HG SER A 43 -7.758 2.552 15.149 1.00 41.24 H new ATOM 654 N ALA A 44 -3.575 0.861 17.214 1.00 31.60 N ATOM 655 CA ALA A 44 -2.700 0.613 18.355 1.00 31.60 C ATOM 656 C ALA A 44 -1.244 0.601 17.925 1.00 31.60 C ATOM 657 O ALA A 44 -0.355 1.011 18.670 1.00 31.60 O ATOM 658 CB ALA A 44 -3.046 -0.710 19.014 1.00 31.60 C ATOM 0 H ALA A 44 -4.197 0.086 16.985 1.00 31.60 H new ATOM 0 HA ALA A 44 -2.849 1.420 19.073 1.00 31.60 H new ATOM 0 HB1 ALA A 44 -2.383 -0.878 19.863 1.00 31.60 H new ATOM 0 HB2 ALA A 44 -4.079 -0.685 19.360 1.00 31.60 H new ATOM 0 HB3 ALA A 44 -2.924 -1.518 18.293 1.00 31.60 H new ATOM 664 N TRP A 45 -1.016 0.120 16.713 1.00 71.86 N ATOM 665 CA TRP A 45 0.323 0.036 16.162 1.00 71.86 C ATOM 666 C TRP A 45 0.766 1.388 15.689 1.00 71.86 C ATOM 667 O TRP A 45 1.810 1.887 16.100 1.00 71.86 O ATOM 668 CB TRP A 45 0.350 -0.937 14.998 1.00 71.86 C ATOM 669 CG TRP A 45 1.724 -1.188 14.475 1.00 71.86 C ATOM 670 CD1 TRP A 45 2.886 -1.278 15.188 1.00 71.86 C ATOM 671 CD2 TRP A 45 2.073 -1.370 13.110 1.00 71.86 C ATOM 672 NE1 TRP A 45 3.936 -1.504 14.335 1.00 71.86 N ATOM 673 CE2 TRP A 45 3.462 -1.562 13.055 1.00 71.86 C ATOM 674 CE3 TRP A 45 1.342 -1.390 11.929 1.00 71.86 C ATOM 675 CZ2 TRP A 45 4.134 -1.766 11.860 1.00 71.86 C ATOM 676 CZ3 TRP A 45 2.003 -1.598 10.743 1.00 71.86 C ATOM 677 CH2 TRP A 45 3.395 -1.782 10.711 1.00 71.86 C ATOM 0 H TRP A 45 -1.748 -0.220 16.090 1.00 71.86 H new ATOM 0 HA TRP A 45 0.999 -0.317 16.941 1.00 71.86 H new ATOM 0 HB2 TRP A 45 -0.090 -1.883 15.313 1.00 71.86 H new ATOM 0 HB3 TRP A 45 -0.273 -0.548 14.193 1.00 71.86 H new ATOM 0 HD1 TRP A 45 2.966 -1.185 16.261 1.00 71.86 H new ATOM 0 HE1 TRP A 45 4.912 -1.611 14.611 1.00 71.86 H new ATOM 0 HE3 TRP A 45 0.272 -1.244 11.943 1.00 71.86 H new ATOM 0 HZ2 TRP A 45 5.204 -1.907 11.838 1.00 71.86 H new ATOM 0 HZ3 TRP A 45 1.443 -1.620 9.820 1.00 71.86 H new ATOM 0 HH2 TRP A 45 3.889 -1.939 9.763 1.00 71.86 H new ATOM 688 N PHE A 46 -0.038 1.997 14.829 1.00 81.71 N ATOM 689 CA PHE A 46 0.280 3.310 14.324 1.00 81.71 C ATOM 690 C PHE A 46 0.466 4.283 15.478 1.00 81.71 C ATOM 691 O PHE A 46 1.370 5.100 15.461 1.00 81.71 O ATOM 692 CB PHE A 46 -0.828 3.802 13.410 1.00 81.71 C ATOM 693 CG PHE A 46 -0.920 3.059 12.113 1.00 81.71 C ATOM 694 CD1 PHE A 46 0.207 2.835 11.339 1.00 81.71 C ATOM 695 CD2 PHE A 46 -2.144 2.622 11.652 1.00 81.71 C ATOM 696 CE1 PHE A 46 0.108 2.180 10.125 1.00 81.71 C ATOM 697 CE2 PHE A 46 -2.252 1.981 10.437 1.00 81.71 C ATOM 698 CZ PHE A 46 -1.127 1.758 9.673 1.00 81.71 C ATOM 0 H PHE A 46 -0.908 1.600 14.473 1.00 81.71 H new ATOM 0 HA PHE A 46 1.208 3.250 13.756 1.00 81.71 H new ATOM 0 HB2 PHE A 46 -1.781 3.719 13.933 1.00 81.71 H new ATOM 0 HB3 PHE A 46 -0.670 4.860 13.201 1.00 81.71 H new ATOM 0 HD1 PHE A 46 1.171 3.175 11.687 1.00 81.71 H new ATOM 0 HD2 PHE A 46 -3.028 2.784 12.250 1.00 81.71 H new ATOM 0 HE1 PHE A 46 0.993 1.999 9.533 1.00 81.71 H new ATOM 0 HE2 PHE A 46 -3.218 1.653 10.083 1.00 81.71 H new ATOM 0 HZ PHE A 46 -1.211 1.254 8.722 1.00 81.71 H new ATOM 708 N SER A 47 -0.385 4.169 16.495 1.00 81.62 N ATOM 709 CA SER A 47 -0.275 5.040 17.661 1.00 81.62 C ATOM 710 C SER A 47 1.034 4.782 18.385 1.00 81.62 C ATOM 711 O SER A 47 1.720 5.722 18.789 1.00 81.62 O ATOM 712 CB SER A 47 -1.470 4.853 18.601 1.00 81.62 C ATOM 713 OG SER A 47 -2.687 5.156 17.940 1.00 81.62 O ATOM 0 H SER A 47 -1.147 3.493 16.536 1.00 81.62 H new ATOM 0 HA SER A 47 -0.283 6.076 17.321 1.00 81.62 H new ATOM 0 HB2 SER A 47 -1.495 3.825 18.964 1.00 81.62 H new ATOM 0 HB3 SER A 47 -1.356 5.496 19.473 1.00 81.62 H new ATOM 0 HG SER A 47 -3.163 4.325 17.734 1.00 81.62 H new ATOM 719 N PHE A 48 1.418 3.511 18.501 1.00 49.76 N ATOM 720 CA PHE A 48 2.685 3.174 19.119 1.00 49.76 C ATOM 721 C PHE A 48 3.796 3.732 18.223 1.00 49.76 C ATOM 722 O PHE A 48 4.712 4.416 18.679 1.00 49.76 O ATOM 723 CB PHE A 48 2.805 1.650 19.291 1.00 49.76 C ATOM 724 CG PHE A 48 4.220 1.184 19.241 1.00 49.76 C ATOM 725 CD1 PHE A 48 4.783 0.885 18.028 1.00 49.76 C ATOM 726 CD2 PHE A 48 4.990 1.127 20.379 1.00 49.76 C ATOM 727 CE1 PHE A 48 6.105 0.525 17.938 1.00 49.76 C ATOM 728 CE2 PHE A 48 6.316 0.755 20.308 1.00 49.76 C ATOM 729 CZ PHE A 48 6.878 0.453 19.082 1.00 49.76 C ATOM 0 H PHE A 48 0.873 2.712 18.177 1.00 49.76 H new ATOM 0 HA PHE A 48 2.764 3.610 20.115 1.00 49.76 H new ATOM 0 HB2 PHE A 48 2.362 1.358 20.243 1.00 49.76 H new ATOM 0 HB3 PHE A 48 2.233 1.152 18.508 1.00 49.76 H new ATOM 0 HD1 PHE A 48 4.180 0.933 17.133 1.00 49.76 H new ATOM 0 HD2 PHE A 48 4.553 1.375 21.335 1.00 49.76 H new ATOM 0 HE1 PHE A 48 6.540 0.299 16.976 1.00 49.76 H new ATOM 0 HE2 PHE A 48 6.913 0.700 21.207 1.00 49.76 H new ATOM 0 HZ PHE A 48 7.916 0.162 19.018 1.00 49.76 H new ATOM 739 N LEU A 49 3.666 3.435 16.931 1.00 52.14 N ATOM 740 CA LEU A 49 4.602 3.893 15.913 1.00 52.14 C ATOM 741 C LEU A 49 4.741 5.417 15.985 1.00 52.14 C ATOM 742 O LEU A 49 5.846 5.957 16.012 1.00 52.14 O ATOM 743 CB LEU A 49 4.075 3.471 14.532 1.00 52.14 C ATOM 744 CG LEU A 49 4.880 2.397 13.789 1.00 52.14 C ATOM 745 CD1 LEU A 49 5.244 1.246 14.715 1.00 52.14 C ATOM 746 CD2 LEU A 49 4.084 1.885 12.599 1.00 52.14 C ATOM 0 H LEU A 49 2.903 2.867 16.562 1.00 52.14 H new ATOM 0 HA LEU A 49 5.583 3.448 16.080 1.00 52.14 H new ATOM 0 HB2 LEU A 49 3.054 3.109 14.653 1.00 52.14 H new ATOM 0 HB3 LEU A 49 4.026 4.358 13.900 1.00 52.14 H new ATOM 0 HG LEU A 49 5.807 2.847 13.434 1.00 52.14 H new ATOM 0 HD11 LEU A 49 5.814 0.500 14.161 1.00 52.14 H new ATOM 0 HD12 LEU A 49 5.845 1.621 15.543 1.00 52.14 H new ATOM 0 HD13 LEU A 49 4.334 0.791 15.105 1.00 52.14 H new ATOM 0 HD21 LEU A 49 4.661 1.123 12.076 1.00 52.14 H new ATOM 0 HD22 LEU A 49 3.145 1.454 12.947 1.00 52.14 H new ATOM 0 HD23 LEU A 49 3.874 2.711 11.919 1.00 52.14 H new ATOM 758 N GLU A 50 3.592 6.097 16.039 1.00 63.10 N ATOM 759 CA GLU A 50 3.561 7.554 16.135 1.00 63.10 C ATOM 760 C GLU A 50 4.192 8.003 17.441 1.00 63.10 C ATOM 761 O GLU A 50 4.957 8.966 17.477 1.00 63.10 O ATOM 762 CB GLU A 50 2.129 8.095 16.036 1.00 63.10 C ATOM 763 CG GLU A 50 1.535 8.012 14.638 1.00 63.10 C ATOM 764 CD GLU A 50 0.163 8.653 14.545 1.00 63.10 C ATOM 765 OE1 GLU A 50 -0.450 8.907 15.603 1.00 63.10 O ATOM 766 OE2 GLU A 50 -0.297 8.907 13.411 1.00 63.10 O ATOM 0 H GLU A 50 2.671 5.658 16.018 1.00 63.10 H new ATOM 0 HA GLU A 50 4.131 7.955 15.297 1.00 63.10 H new ATOM 0 HB2 GLU A 50 1.492 7.539 16.724 1.00 63.10 H new ATOM 0 HB3 GLU A 50 2.120 9.135 16.363 1.00 63.10 H new ATOM 0 HG2 GLU A 50 2.208 8.500 13.932 1.00 63.10 H new ATOM 0 HG3 GLU A 50 1.464 6.966 14.340 1.00 63.10 H new ATOM 773 N SER A 51 3.885 7.274 18.511 1.00 75.02 N ATOM 774 CA SER A 51 4.445 7.576 19.827 1.00 75.02 C ATOM 775 C SER A 51 5.970 7.499 19.777 1.00 75.02 C ATOM 776 O SER A 51 6.665 8.180 20.531 1.00 75.02 O ATOM 777 CB SER A 51 3.904 6.608 20.881 1.00 75.02 C ATOM 778 OG SER A 51 2.497 6.712 20.998 1.00 75.02 O ATOM 0 H SER A 51 3.254 6.473 18.494 1.00 75.02 H new ATOM 0 HA SER A 51 4.148 8.587 20.104 1.00 75.02 H new ATOM 0 HB2 SER A 51 4.175 5.587 20.613 1.00 75.02 H new ATOM 0 HB3 SER A 51 4.368 6.819 21.844 1.00 75.02 H new ATOM 0 HG SER A 51 2.086 6.602 20.115 1.00 75.02 H new ATOM 784 N HIS A 52 6.479 6.669 18.869 1.00122.90 N ATOM 785 CA HIS A 52 7.911 6.500 18.691 1.00122.90 C ATOM 786 C HIS A 52 8.355 7.187 17.405 1.00122.90 C ATOM 787 O HIS A 52 7.559 7.857 16.746 1.00122.90 O ATOM 788 CB HIS A 52 8.262 5.013 18.639 1.00122.90 C ATOM 789 CG HIS A 52 8.094 4.327 19.947 1.00122.90 C ATOM 790 ND1 HIS A 52 9.109 3.664 20.599 1.00122.90 N ATOM 791 CD2 HIS A 52 7.005 4.212 20.723 1.00122.90 C ATOM 792 CE1 HIS A 52 8.645 3.164 21.731 1.00122.90 C ATOM 793 NE2 HIS A 52 7.367 3.485 21.830 1.00122.90 N ATOM 0 H HIS A 52 5.911 6.100 18.242 1.00122.90 H new ATOM 0 HA HIS A 52 8.430 6.953 19.535 1.00122.90 H new ATOM 0 HB2 HIS A 52 7.633 4.523 17.896 1.00122.90 H new ATOM 0 HB3 HIS A 52 9.294 4.901 18.307 1.00122.90 H new ATOM 0 HD2 HIS A 52 6.025 4.616 20.515 1.00122.90 H new ATOM 0 HE1 HIS A 52 9.212 2.592 22.451 1.00122.90 H new ATOM 0 HE2 HIS A 52 6.750 3.234 22.603 1.00122.90 H new ATOM 801 N ASN A 53 9.619 7.018 17.046 1.00225.56 N ATOM 802 CA ASN A 53 10.156 7.623 15.831 1.00225.56 C ATOM 803 C ASN A 53 10.063 6.660 14.652 1.00225.56 C ATOM 804 O ASN A 53 10.941 6.636 13.790 1.00225.56 O ATOM 805 CB ASN A 53 11.612 8.035 16.046 1.00225.56 C ATOM 806 CG ASN A 53 11.774 9.026 17.181 1.00225.56 C ATOM 807 OD1 ASN A 53 10.843 9.753 17.525 1.00225.56 O ATOM 808 ND2 ASN A 53 12.962 9.053 17.773 1.00225.56 N ATOM 0 H ASN A 53 10.294 6.467 17.577 1.00225.56 H new ATOM 0 HA ASN A 53 9.560 8.507 15.603 1.00225.56 H new ATOM 0 HB2 ASN A 53 12.210 7.148 16.255 1.00225.56 H new ATOM 0 HB3 ASN A 53 12.002 8.473 15.127 1.00225.56 H new ATOM 0 HD21 ASN A 53 13.132 9.695 18.547 1.00225.56 H new ATOM 0 HD22 ASN A 53 13.705 8.431 17.454 1.00225.56 H new ATOM 815 N LYS A 54 9.007 5.853 14.621 1.00217.59 N ATOM 816 CA LYS A 54 8.832 4.884 13.548 1.00217.59 C ATOM 817 C LYS A 54 7.851 5.363 12.489 1.00217.59 C ATOM 818 O LYS A 54 7.815 4.812 11.390 1.00217.59 O ATOM 819 CB LYS A 54 8.313 3.567 14.110 1.00217.59 C ATOM 820 CG LYS A 54 9.138 3.016 15.258 1.00217.59 C ATOM 821 CD LYS A 54 10.590 2.829 14.857 1.00217.59 C ATOM 822 CE LYS A 54 10.730 1.765 13.783 1.00217.59 C ATOM 823 NZ LYS A 54 12.110 1.206 13.728 1.00217.59 N ATOM 0 H LYS A 54 8.265 5.851 15.321 1.00217.59 H new ATOM 0 HA LYS A 54 9.810 4.753 13.085 1.00217.59 H new ATOM 0 HB2 LYS A 54 7.287 3.708 14.449 1.00217.59 H new ATOM 0 HB3 LYS A 54 8.285 2.828 13.309 1.00217.59 H new ATOM 0 HG2 LYS A 54 9.079 3.694 16.109 1.00217.59 H new ATOM 0 HG3 LYS A 54 8.722 2.062 15.581 1.00217.59 H new ATOM 0 HD2 LYS A 54 10.994 3.773 14.492 1.00217.59 H new ATOM 0 HD3 LYS A 54 11.178 2.547 15.731 1.00217.59 H new ATOM 0 HE2 LYS A 54 10.020 0.960 13.975 1.00217.59 H new ATOM 0 HE3 LYS A 54 10.473 2.192 12.814 1.00217.59 H new ATOM 0 HZ1 LYS A 54 12.162 0.483 12.982 1.00217.59 H new ATOM 0 HZ2 LYS A 54 12.785 1.969 13.519 1.00217.59 H new ATOM 0 HZ3 LYS A 54 12.347 0.775 14.644 1.00217.59 H new ATOM 837 N LEU A 55 7.046 6.371 12.801 1.00 97.75 N ATOM 838 CA LEU A 55 6.076 6.850 11.824 1.00 97.75 C ATOM 839 C LEU A 55 5.615 8.275 12.084 1.00 97.75 C ATOM 840 O LEU A 55 4.827 8.549 12.989 1.00 97.75 O ATOM 841 CB LEU A 55 4.874 5.916 11.793 1.00 97.75 C ATOM 842 CG LEU A 55 3.732 6.353 10.878 1.00 97.75 C ATOM 843 CD1 LEU A 55 3.002 5.150 10.305 1.00 97.75 C ATOM 844 CD2 LEU A 55 2.773 7.240 11.651 1.00 97.75 C ATOM 0 H LEU A 55 7.043 6.861 13.696 1.00 97.75 H new ATOM 0 HA LEU A 55 6.579 6.855 10.857 1.00 97.75 H new ATOM 0 HB2 LEU A 55 5.211 4.928 11.480 1.00 97.75 H new ATOM 0 HB3 LEU A 55 4.487 5.815 12.807 1.00 97.75 H new ATOM 0 HG LEU A 55 4.148 6.917 10.043 1.00 97.75 H new ATOM 0 HD11 LEU A 55 2.194 5.489 9.657 1.00 97.75 H new ATOM 0 HD12 LEU A 55 3.699 4.543 9.728 1.00 97.75 H new ATOM 0 HD13 LEU A 55 2.589 4.554 11.119 1.00 97.75 H new ATOM 0 HD21 LEU A 55 1.958 7.551 10.997 1.00 97.75 H new ATOM 0 HD22 LEU A 55 2.367 6.686 12.498 1.00 97.75 H new ATOM 0 HD23 LEU A 55 3.304 8.120 12.014 1.00 97.75 H new ATOM 856 N ASP A 56 6.087 9.159 11.224 1.00109.16 N ATOM 857 CA ASP A 56 5.718 10.567 11.255 1.00109.16 C ATOM 858 C ASP A 56 4.402 10.757 10.508 1.00109.16 C ATOM 859 O ASP A 56 3.778 9.783 10.098 1.00109.16 O ATOM 860 CB ASP A 56 6.821 11.431 10.638 1.00109.16 C ATOM 861 CG ASP A 56 8.106 11.395 11.443 1.00109.16 C ATOM 862 OD1 ASP A 56 8.068 10.943 12.607 1.00109.16 O ATOM 863 OD2 ASP A 56 9.152 11.820 10.909 1.00109.16 O ATOM 0 H ASP A 56 6.741 8.921 10.479 1.00109.16 H new ATOM 0 HA ASP A 56 5.592 10.882 12.291 1.00109.16 H new ATOM 0 HB2 ASP A 56 7.022 11.088 9.623 1.00109.16 H new ATOM 0 HB3 ASP A 56 6.472 12.461 10.563 1.00109.16 H new ATOM 868 N LYS A 57 3.999 12.005 10.295 1.00 65.03 N ATOM 869 CA LYS A 57 2.767 12.284 9.557 1.00 65.03 C ATOM 870 C LYS A 57 2.964 12.050 8.061 1.00 65.03 C ATOM 871 O LYS A 57 2.000 11.825 7.328 1.00 65.03 O ATOM 872 CB LYS A 57 2.263 13.714 9.808 1.00 65.03 C ATOM 873 CG LYS A 57 3.352 14.771 9.890 1.00 65.03 C ATOM 874 CD LYS A 57 4.290 14.715 8.703 1.00 65.03 C ATOM 875 CE LYS A 57 4.897 16.070 8.389 1.00 65.03 C ATOM 876 NZ LYS A 57 6.072 16.372 9.253 1.00 65.03 N ATOM 0 H LYS A 57 4.499 12.833 10.618 1.00 65.03 H new ATOM 0 HA LYS A 57 2.009 11.593 9.925 1.00 65.03 H new ATOM 0 HB2 LYS A 57 1.573 13.986 9.010 1.00 65.03 H new ATOM 0 HB3 LYS A 57 1.695 13.725 10.738 1.00 65.03 H new ATOM 0 HG2 LYS A 57 2.895 15.759 9.944 1.00 65.03 H new ATOM 0 HG3 LYS A 57 3.922 14.633 10.809 1.00 65.03 H new ATOM 0 HD2 LYS A 57 5.087 14.000 8.905 1.00 65.03 H new ATOM 0 HD3 LYS A 57 3.748 14.350 7.830 1.00 65.03 H new ATOM 0 HE2 LYS A 57 5.201 16.097 7.343 1.00 65.03 H new ATOM 0 HE3 LYS A 57 4.142 16.845 8.522 1.00 65.03 H new ATOM 0 HZ1 LYS A 57 6.455 17.306 9.004 1.00 65.03 H new ATOM 0 HZ2 LYS A 57 5.778 16.373 10.251 1.00 65.03 H new ATOM 0 HZ3 LYS A 57 6.805 15.648 9.108 1.00 65.03 H new ATOM 890 N ASP A 58 4.218 12.112 7.608 1.00165.72 N ATOM 891 CA ASP A 58 4.532 11.917 6.203 1.00165.72 C ATOM 892 C ASP A 58 5.454 10.711 5.990 1.00165.72 C ATOM 893 O ASP A 58 5.578 10.217 4.870 1.00165.72 O ATOM 894 CB ASP A 58 5.184 13.177 5.628 1.00165.72 C ATOM 895 CG ASP A 58 5.226 13.173 4.109 1.00165.72 C ATOM 896 OD1 ASP A 58 4.621 12.267 3.497 1.00165.72 O ATOM 897 OD2 ASP A 58 5.863 14.079 3.532 1.00165.72 O ATOM 0 H ASP A 58 5.029 12.296 8.199 1.00165.72 H new ATOM 0 HA ASP A 58 3.596 11.720 5.681 1.00165.72 H new ATOM 0 HB2 ASP A 58 4.635 14.054 5.970 1.00165.72 H new ATOM 0 HB3 ASP A 58 6.199 13.265 6.015 1.00165.72 H new ATOM 902 N ASN A 59 6.107 10.242 7.056 1.00 98.89 N ATOM 903 CA ASN A 59 7.011 9.098 6.941 1.00 98.89 C ATOM 904 C ASN A 59 6.272 7.792 7.157 1.00 98.89 C ATOM 905 O ASN A 59 5.884 7.448 8.274 1.00 98.89 O ATOM 906 CB ASN A 59 8.166 9.216 7.936 1.00 98.89 C ATOM 907 CG ASN A 59 9.121 10.338 7.578 1.00 98.89 C ATOM 908 OD1 ASN A 59 10.277 10.098 7.230 1.00 98.89 O ATOM 909 ND2 ASN A 59 8.642 11.573 7.657 1.00 98.89 N ATOM 0 H ASN A 59 6.028 10.631 7.996 1.00 98.89 H new ATOM 0 HA ASN A 59 7.417 9.100 5.930 1.00 98.89 H new ATOM 0 HB2 ASN A 59 7.766 9.387 8.935 1.00 98.89 H new ATOM 0 HB3 ASN A 59 8.712 8.273 7.969 1.00 98.89 H new ATOM 0 HD21 ASN A 59 9.238 12.367 7.425 1.00 98.89 H new ATOM 0 HD22 ASN A 59 7.677 11.728 7.950 1.00 98.89 H new ATOM 916 N LEU A 60 6.099 7.067 6.064 1.00196.24 N ATOM 917 CA LEU A 60 5.427 5.778 6.079 1.00196.24 C ATOM 918 C LEU A 60 6.294 4.707 5.411 1.00196.24 C ATOM 919 O LEU A 60 5.822 3.604 5.139 1.00196.24 O ATOM 920 CB LEU A 60 4.084 5.878 5.348 1.00196.24 C ATOM 921 CG LEU A 60 4.089 6.791 4.112 1.00196.24 C ATOM 922 CD1 LEU A 60 3.387 6.124 2.941 1.00196.24 C ATOM 923 CD2 LEU A 60 3.439 8.123 4.442 1.00196.24 C ATOM 0 H LEU A 60 6.421 7.356 5.140 1.00196.24 H new ATOM 0 HA LEU A 60 5.256 5.494 7.117 1.00196.24 H new ATOM 0 HB2 LEU A 60 3.778 4.878 5.042 1.00196.24 H new ATOM 0 HB3 LEU A 60 3.332 6.242 6.048 1.00196.24 H new ATOM 0 HG LEU A 60 5.124 6.972 3.821 1.00196.24 H new ATOM 0 HD11 LEU A 60 3.404 6.791 2.079 1.00196.24 H new ATOM 0 HD12 LEU A 60 3.899 5.195 2.691 1.00196.24 H new ATOM 0 HD13 LEU A 60 2.354 5.908 3.212 1.00196.24 H new ATOM 0 HD21 LEU A 60 3.449 8.761 3.558 1.00196.24 H new ATOM 0 HD22 LEU A 60 2.409 7.957 4.759 1.00196.24 H new ATOM 0 HD23 LEU A 60 3.992 8.608 5.246 1.00196.24 H new ATOM 935 N SER A 61 7.556 5.041 5.123 1.00 66.14 N ATOM 936 CA SER A 61 8.454 4.100 4.461 1.00 66.14 C ATOM 937 C SER A 61 8.598 2.793 5.239 1.00 66.14 C ATOM 938 O SER A 61 8.637 1.716 4.645 1.00 66.14 O ATOM 939 CB SER A 61 9.829 4.738 4.248 1.00 66.14 C ATOM 940 OG SER A 61 10.494 4.947 5.482 1.00 66.14 O ATOM 0 H SER A 61 7.972 5.947 5.337 1.00 66.14 H new ATOM 0 HA SER A 61 8.011 3.858 3.495 1.00 66.14 H new ATOM 0 HB2 SER A 61 10.436 4.096 3.609 1.00 66.14 H new ATOM 0 HB3 SER A 61 9.715 5.689 3.728 1.00 66.14 H new ATOM 0 HG SER A 61 11.370 5.354 5.317 1.00 66.14 H new ATOM 946 N TYR A 62 8.673 2.884 6.562 1.00 59.69 N ATOM 947 CA TYR A 62 8.808 1.692 7.391 1.00 59.69 C ATOM 948 C TYR A 62 7.524 0.871 7.380 1.00 59.69 C ATOM 949 O TYR A 62 7.574 -0.346 7.304 1.00 59.69 O ATOM 950 CB TYR A 62 9.211 2.084 8.831 1.00 59.69 C ATOM 951 CG TYR A 62 8.712 1.143 9.923 1.00 59.69 C ATOM 952 CD1 TYR A 62 8.984 -0.220 9.888 1.00 59.69 C ATOM 953 CD2 TYR A 62 7.945 1.627 10.970 1.00 59.69 C ATOM 954 CE1 TYR A 62 8.506 -1.066 10.870 1.00 59.69 C ATOM 955 CE2 TYR A 62 7.468 0.789 11.956 1.00 59.69 C ATOM 956 CZ TYR A 62 7.750 -0.557 11.903 1.00 59.69 C ATOM 957 OH TYR A 62 7.273 -1.398 12.885 1.00 59.69 O ATOM 0 H TYR A 62 8.643 3.762 7.080 1.00 59.69 H new ATOM 0 HA TYR A 62 9.598 1.068 6.974 1.00 59.69 H new ATOM 0 HB2 TYR A 62 10.298 2.135 8.886 1.00 59.69 H new ATOM 0 HB3 TYR A 62 8.834 3.086 9.037 1.00 59.69 H new ATOM 0 HD1 TYR A 62 9.578 -0.623 9.081 1.00 59.69 H new ATOM 0 HD2 TYR A 62 7.716 2.681 11.015 1.00 59.69 H new ATOM 0 HE1 TYR A 62 8.724 -2.123 10.828 1.00 59.69 H new ATOM 0 HE2 TYR A 62 6.876 1.187 12.766 1.00 59.69 H new ATOM 0 HH TYR A 62 7.047 -2.266 12.491 1.00 59.69 H new ATOM 967 N ILE A 63 6.387 1.540 7.483 1.00 95.89 N ATOM 968 CA ILE A 63 5.106 0.852 7.513 1.00 95.89 C ATOM 969 C ILE A 63 4.768 0.300 6.145 1.00 95.89 C ATOM 970 O ILE A 63 4.413 -0.869 6.001 1.00 95.89 O ATOM 971 CB ILE A 63 3.978 1.774 8.039 1.00 95.89 C ATOM 972 CG1 ILE A 63 3.425 2.723 6.968 1.00 95.89 C ATOM 973 CG2 ILE A 63 4.471 2.593 9.227 1.00 95.89 C ATOM 974 CD1 ILE A 63 2.222 3.490 7.447 1.00 95.89 C ATOM 0 H ILE A 63 6.325 2.556 7.547 1.00 95.89 H new ATOM 0 HA ILE A 63 5.190 0.016 8.208 1.00 95.89 H new ATOM 0 HB ILE A 63 3.165 1.115 8.343 1.00 95.89 H new ATOM 0 HG12 ILE A 63 4.205 3.424 6.670 1.00 95.89 H new ATOM 0 HG13 ILE A 63 3.157 2.149 6.081 1.00 95.89 H new ATOM 0 HG21 ILE A 63 3.667 3.236 9.585 1.00 95.89 H new ATOM 0 HG22 ILE A 63 4.783 1.922 10.027 1.00 95.89 H new ATOM 0 HG23 ILE A 63 5.317 3.208 8.919 1.00 95.89 H new ATOM 0 HD11 ILE A 63 1.869 4.147 6.652 1.00 95.89 H new ATOM 0 HD12 ILE A 63 1.430 2.792 7.719 1.00 95.89 H new ATOM 0 HD13 ILE A 63 2.494 4.087 8.317 1.00 95.89 H new ATOM 986 N GLU A 64 4.922 1.141 5.135 1.00 77.41 N ATOM 987 CA GLU A 64 4.676 0.729 3.760 1.00 77.41 C ATOM 988 C GLU A 64 5.490 -0.528 3.460 1.00 77.41 C ATOM 989 O GLU A 64 5.084 -1.379 2.674 1.00 77.41 O ATOM 990 CB GLU A 64 5.049 1.850 2.785 1.00 77.41 C ATOM 991 CG GLU A 64 4.641 1.563 1.347 1.00 77.41 C ATOM 992 CD GLU A 64 5.141 2.612 0.370 1.00 77.41 C ATOM 993 OE1 GLU A 64 5.903 3.508 0.792 1.00 77.41 O ATOM 994 OE2 GLU A 64 4.767 2.538 -0.820 1.00 77.41 O ATOM 0 H GLU A 64 5.216 2.112 5.240 1.00 77.41 H new ATOM 0 HA GLU A 64 3.615 0.514 3.635 1.00 77.41 H new ATOM 0 HB2 GLU A 64 4.576 2.777 3.111 1.00 77.41 H new ATOM 0 HB3 GLU A 64 6.126 2.011 2.824 1.00 77.41 H new ATOM 0 HG2 GLU A 64 5.027 0.587 1.053 1.00 77.41 H new ATOM 0 HG3 GLU A 64 3.554 1.507 1.287 1.00 77.41 H new ATOM 1001 N HIS A 65 6.628 -0.656 4.142 1.00 68.54 N ATOM 1002 CA HIS A 65 7.473 -1.828 3.991 1.00 68.54 C ATOM 1003 C HIS A 65 6.779 -3.027 4.606 1.00 68.54 C ATOM 1004 O HIS A 65 6.756 -4.108 4.025 1.00 68.54 O ATOM 1005 CB HIS A 65 8.839 -1.573 4.640 1.00 68.54 C ATOM 1006 CG HIS A 65 9.701 -2.786 4.805 1.00 68.54 C ATOM 1007 ND1 HIS A 65 10.453 -3.334 3.789 1.00 68.54 N ATOM 1008 CD2 HIS A 65 9.931 -3.547 5.898 1.00 68.54 C ATOM 1009 CE1 HIS A 65 11.111 -4.384 4.250 1.00 68.54 C ATOM 1010 NE2 HIS A 65 10.812 -4.534 5.528 1.00 68.54 N ATOM 0 H HIS A 65 6.980 0.038 4.801 1.00 68.54 H new ATOM 0 HA HIS A 65 7.642 -2.034 2.934 1.00 68.54 H new ATOM 0 HB2 HIS A 65 9.379 -0.842 4.038 1.00 68.54 H new ATOM 0 HB3 HIS A 65 8.680 -1.124 5.620 1.00 68.54 H new ATOM 0 HD2 HIS A 65 9.502 -3.406 6.879 1.00 68.54 H new ATOM 0 HE1 HIS A 65 11.779 -5.012 3.679 1.00 68.54 H new ATOM 0 HE2 HIS A 65 11.176 -5.264 6.140 1.00 68.54 H new ATOM 1018 N ILE A 66 6.196 -2.811 5.780 1.00 44.28 N ATOM 1019 CA ILE A 66 5.478 -3.860 6.483 1.00 44.28 C ATOM 1020 C ILE A 66 4.347 -4.374 5.624 1.00 44.28 C ATOM 1021 O ILE A 66 4.204 -5.578 5.406 1.00 44.28 O ATOM 1022 CB ILE A 66 4.919 -3.330 7.818 1.00 44.28 C ATOM 1023 CG1 ILE A 66 6.065 -2.755 8.645 1.00 44.28 C ATOM 1024 CG2 ILE A 66 4.170 -4.414 8.584 1.00 44.28 C ATOM 1025 CD1 ILE A 66 7.228 -3.689 8.821 1.00 44.28 C ATOM 0 H ILE A 66 6.209 -1.913 6.264 1.00 44.28 H new ATOM 0 HA ILE A 66 6.171 -4.675 6.692 1.00 44.28 H new ATOM 0 HB ILE A 66 4.196 -2.542 7.611 1.00 44.28 H new ATOM 0 HG12 ILE A 66 6.418 -1.840 8.169 1.00 44.28 H new ATOM 0 HG13 ILE A 66 5.685 -2.477 9.628 1.00 44.28 H new ATOM 0 HG21 ILE A 66 3.791 -4.003 9.519 1.00 44.28 H new ATOM 0 HG22 ILE A 66 3.336 -4.775 7.982 1.00 44.28 H new ATOM 0 HG23 ILE A 66 4.847 -5.241 8.799 1.00 44.28 H new ATOM 0 HD11 ILE A 66 7.998 -3.203 9.420 1.00 44.28 H new ATOM 0 HD12 ILE A 66 6.894 -4.595 9.326 1.00 44.28 H new ATOM 0 HD13 ILE A 66 7.638 -3.948 7.845 1.00 44.28 H new ATOM 1037 N PHE A 67 3.561 -3.442 5.116 1.00103.95 N ATOM 1038 CA PHE A 67 2.456 -3.786 4.252 1.00103.95 C ATOM 1039 C PHE A 67 2.973 -4.463 2.982 1.00103.95 C ATOM 1040 O PHE A 67 2.304 -5.326 2.414 1.00103.95 O ATOM 1041 CB PHE A 67 1.648 -2.534 3.935 1.00103.95 C ATOM 1042 CG PHE A 67 1.187 -1.851 5.186 1.00103.95 C ATOM 1043 CD1 PHE A 67 0.493 -2.562 6.150 1.00103.95 C ATOM 1044 CD2 PHE A 67 1.475 -0.519 5.417 1.00103.95 C ATOM 1045 CE1 PHE A 67 0.090 -1.955 7.320 1.00103.95 C ATOM 1046 CE2 PHE A 67 1.081 0.096 6.591 1.00103.95 C ATOM 1047 CZ PHE A 67 0.386 -0.629 7.543 1.00103.95 C ATOM 0 H PHE A 67 3.671 -2.443 5.289 1.00103.95 H new ATOM 0 HA PHE A 67 1.799 -4.494 4.757 1.00103.95 H new ATOM 0 HB2 PHE A 67 2.255 -1.847 3.346 1.00103.95 H new ATOM 0 HB3 PHE A 67 0.785 -2.801 3.325 1.00103.95 H new ATOM 0 HD1 PHE A 67 0.265 -3.604 5.983 1.00103.95 H new ATOM 0 HD2 PHE A 67 2.014 0.048 4.672 1.00103.95 H new ATOM 0 HE1 PHE A 67 -0.457 -2.519 8.061 1.00103.95 H new ATOM 0 HE2 PHE A 67 1.314 1.136 6.764 1.00103.95 H new ATOM 0 HZ PHE A 67 0.075 -0.154 8.462 1.00103.95 H new ATOM 1057 N GLU A 68 4.182 -4.077 2.547 1.00 76.40 N ATOM 1058 CA GLU A 68 4.781 -4.671 1.354 1.00 76.40 C ATOM 1059 C GLU A 68 5.286 -6.076 1.644 1.00 76.40 C ATOM 1060 O GLU A 68 4.960 -7.020 0.924 1.00 76.40 O ATOM 1061 CB GLU A 68 5.928 -3.799 0.836 1.00 76.40 C ATOM 1062 CG GLU A 68 6.605 -4.361 -0.407 1.00 76.40 C ATOM 1063 CD GLU A 68 7.789 -3.527 -0.864 1.00 76.40 C ATOM 1064 OE1 GLU A 68 8.113 -2.527 -0.186 1.00 76.40 O ATOM 1065 OE2 GLU A 68 8.393 -3.873 -1.900 1.00 76.40 O ATOM 0 H GLU A 68 4.754 -3.365 3.001 1.00 76.40 H new ATOM 0 HA GLU A 68 4.010 -4.731 0.586 1.00 76.40 H new ATOM 0 HB2 GLU A 68 5.545 -2.803 0.612 1.00 76.40 H new ATOM 0 HB3 GLU A 68 6.672 -3.685 1.625 1.00 76.40 H new ATOM 0 HG2 GLU A 68 6.940 -5.378 -0.203 1.00 76.40 H new ATOM 0 HG3 GLU A 68 5.876 -4.422 -1.215 1.00 76.40 H new ATOM 1072 N ILE A 69 6.073 -6.219 2.706 1.00 33.63 N ATOM 1073 CA ILE A 69 6.591 -7.525 3.071 1.00 33.63 C ATOM 1074 C ILE A 69 5.453 -8.456 3.466 1.00 33.63 C ATOM 1075 O ILE A 69 5.524 -9.668 3.268 1.00 33.63 O ATOM 1076 CB ILE A 69 7.611 -7.447 4.204 1.00 33.63 C ATOM 1077 CG1 ILE A 69 6.996 -6.809 5.458 1.00 33.63 C ATOM 1078 CG2 ILE A 69 8.853 -6.697 3.730 1.00 33.63 C ATOM 1079 CD1 ILE A 69 8.023 -6.396 6.490 1.00 33.63 C ATOM 0 H ILE A 69 6.361 -5.456 3.319 1.00 33.63 H new ATOM 0 HA ILE A 69 7.101 -7.922 2.193 1.00 33.63 H new ATOM 0 HB ILE A 69 7.912 -8.457 4.483 1.00 33.63 H new ATOM 0 HG12 ILE A 69 6.416 -5.934 5.164 1.00 33.63 H new ATOM 0 HG13 ILE A 69 6.300 -7.515 5.911 1.00 33.63 H new ATOM 0 HG21 ILE A 69 9.578 -6.644 4.542 1.00 33.63 H new ATOM 0 HG22 ILE A 69 9.294 -7.223 2.883 1.00 33.63 H new ATOM 0 HG23 ILE A 69 8.575 -5.688 3.426 1.00 33.63 H new ATOM 0 HD11 ILE A 69 7.518 -5.953 7.349 1.00 33.63 H new ATOM 0 HD12 ILE A 69 8.587 -7.271 6.812 1.00 33.63 H new ATOM 0 HD13 ILE A 69 8.704 -5.666 6.053 1.00 33.63 H new ATOM 1091 N SER A 70 4.386 -7.864 3.988 1.00 80.34 N ATOM 1092 CA SER A 70 3.200 -8.615 4.375 1.00 80.34 C ATOM 1093 C SER A 70 2.390 -8.923 3.118 1.00 80.34 C ATOM 1094 O SER A 70 2.408 -8.147 2.164 1.00 80.34 O ATOM 1095 CB SER A 70 2.352 -7.810 5.362 1.00 80.34 C ATOM 1096 OG SER A 70 1.424 -8.642 6.034 1.00 80.34 O ATOM 0 H SER A 70 4.319 -6.860 4.154 1.00 80.34 H new ATOM 0 HA SER A 70 3.498 -9.542 4.865 1.00 80.34 H new ATOM 0 HB2 SER A 70 3.001 -7.322 6.089 1.00 80.34 H new ATOM 0 HB3 SER A 70 1.819 -7.022 4.830 1.00 80.34 H new ATOM 0 HG SER A 70 0.528 -8.251 5.970 1.00 80.34 H new ATOM 1102 N ARG A 71 1.717 -10.065 3.096 1.00144.05 N ATOM 1103 CA ARG A 71 0.951 -10.464 1.920 1.00144.05 C ATOM 1104 C ARG A 71 -0.436 -9.828 1.862 1.00144.05 C ATOM 1105 O ARG A 71 -1.445 -10.521 1.721 1.00144.05 O ATOM 1106 CB ARG A 71 0.853 -11.983 1.844 1.00144.05 C ATOM 1107 CG ARG A 71 2.207 -12.643 1.677 1.00144.05 C ATOM 1108 CD ARG A 71 2.885 -12.192 0.395 1.00144.05 C ATOM 1109 NE ARG A 71 2.061 -12.460 -0.783 1.00144.05 N ATOM 1110 CZ ARG A 71 2.380 -12.081 -2.019 1.00144.05 C ATOM 1111 NH1 ARG A 71 3.521 -11.441 -2.257 1.00144.05 N ATOM 1112 NH2 ARG A 71 1.559 -12.347 -3.025 1.00144.05 N ATOM 0 H ARG A 71 1.684 -10.727 3.871 1.00144.05 H new ATOM 0 HA ARG A 71 1.493 -10.093 1.050 1.00144.05 H new ATOM 0 HB2 ARG A 71 0.378 -12.359 2.750 1.00144.05 H new ATOM 0 HB3 ARG A 71 0.211 -12.261 1.008 1.00144.05 H new ATOM 0 HG2 ARG A 71 2.840 -12.401 2.531 1.00144.05 H new ATOM 0 HG3 ARG A 71 2.087 -13.726 1.666 1.00144.05 H new ATOM 0 HD2 ARG A 71 3.098 -11.125 0.453 1.00144.05 H new ATOM 0 HD3 ARG A 71 3.842 -12.703 0.292 1.00144.05 H new ATOM 0 HE ARG A 71 1.187 -12.969 -0.650 1.00144.05 H new ATOM 0 HH11 ARG A 71 4.161 -11.236 -1.489 1.00144.05 H new ATOM 0 HH12 ARG A 71 3.757 -11.155 -3.207 1.00144.05 H new ATOM 0 HH21 ARG A 71 0.684 -12.842 -2.852 1.00144.05 H new ATOM 0 HH22 ARG A 71 1.802 -12.057 -3.972 1.00144.05 H new ATOM 1126 N ARG A 72 -0.478 -8.504 1.938 1.00183.66 N ATOM 1127 CA ARG A 72 -1.733 -7.777 1.856 1.00183.66 C ATOM 1128 C ARG A 72 -1.536 -6.445 1.132 1.00183.66 C ATOM 1129 O ARG A 72 -1.490 -5.389 1.763 1.00183.66 O ATOM 1130 CB ARG A 72 -2.323 -7.536 3.238 1.00183.66 C ATOM 1131 CG ARG A 72 -3.817 -7.281 3.199 1.00183.66 C ATOM 1132 CD ARG A 72 -4.602 -8.541 2.887 1.00183.66 C ATOM 1133 NE ARG A 72 -5.386 -8.962 4.038 1.00183.66 N ATOM 1134 CZ ARG A 72 -6.499 -9.695 3.963 1.00183.66 C ATOM 1135 NH1 ARG A 72 -6.959 -10.114 2.789 1.00183.66 N ATOM 1136 NH2 ARG A 72 -7.155 -10.012 5.072 1.00183.66 N ATOM 0 H ARG A 72 0.345 -7.913 2.056 1.00183.66 H new ATOM 0 HA ARG A 72 -2.433 -8.389 1.288 1.00183.66 H new ATOM 0 HB2 ARG A 72 -2.122 -8.401 3.870 1.00183.66 H new ATOM 0 HB3 ARG A 72 -1.825 -6.683 3.698 1.00183.66 H new ATOM 0 HG2 ARG A 72 -4.141 -6.881 4.160 1.00183.66 H new ATOM 0 HG3 ARG A 72 -4.036 -6.523 2.447 1.00183.66 H new ATOM 0 HD2 ARG A 72 -5.262 -8.362 2.038 1.00183.66 H new ATOM 0 HD3 ARG A 72 -3.918 -9.338 2.597 1.00183.66 H new ATOM 0 HE ARG A 72 -5.064 -8.678 4.963 1.00183.66 H new ATOM 0 HH11 ARG A 72 -6.460 -9.876 1.932 1.00183.66 H new ATOM 0 HH12 ARG A 72 -7.811 -10.674 2.745 1.00183.66 H new ATOM 0 HH21 ARG A 72 -6.808 -9.696 5.978 1.00183.66 H new ATOM 0 HH22 ARG A 72 -8.006 -10.572 5.019 1.00183.66 H new ATOM 1150 N PRO A 73 -1.410 -6.473 -0.210 1.00130.67 N ATOM 1151 CA PRO A 73 -1.212 -5.258 -1.007 1.00130.67 C ATOM 1152 C PRO A 73 -2.380 -4.275 -0.912 1.00130.67 C ATOM 1153 O PRO A 73 -2.261 -3.127 -1.333 1.00130.67 O ATOM 1154 CB PRO A 73 -1.068 -5.777 -2.442 1.00130.67 C ATOM 1155 CG PRO A 73 -1.686 -7.128 -2.428 1.00130.67 C ATOM 1156 CD PRO A 73 -1.443 -7.682 -1.054 1.00130.67 C ATOM 0 HA PRO A 73 -0.349 -4.695 -0.652 1.00130.67 H new ATOM 0 HB2 PRO A 73 -1.572 -5.120 -3.151 1.00130.67 H new ATOM 0 HB3 PRO A 73 -0.021 -5.825 -2.741 1.00130.67 H new ATOM 0 HG2 PRO A 73 -2.753 -7.071 -2.642 1.00130.67 H new ATOM 0 HG3 PRO A 73 -1.242 -7.768 -3.191 1.00130.67 H new ATOM 0 HD2 PRO A 73 -2.235 -8.366 -0.749 1.00130.67 H new ATOM 0 HD3 PRO A 73 -0.506 -8.236 -1.002 1.00130.67 H new ATOM 1164 N ASP A 74 -3.513 -4.724 -0.372 1.00 56.92 N ATOM 1165 CA ASP A 74 -4.688 -3.864 -0.255 1.00 56.92 C ATOM 1166 C ASP A 74 -4.429 -2.695 0.693 1.00 56.92 C ATOM 1167 O ASP A 74 -4.798 -1.558 0.401 1.00 56.92 O ATOM 1168 CB ASP A 74 -5.881 -4.681 0.239 1.00 56.92 C ATOM 1169 CG ASP A 74 -6.245 -5.803 -0.714 1.00 56.92 C ATOM 1170 OD1 ASP A 74 -5.923 -5.691 -1.915 1.00 56.92 O ATOM 1171 OD2 ASP A 74 -6.852 -6.796 -0.258 1.00 56.92 O ATOM 0 H ASP A 74 -3.641 -5.670 -0.012 1.00 56.92 H new ATOM 0 HA ASP A 74 -4.909 -3.455 -1.241 1.00 56.92 H new ATOM 0 HB2 ASP A 74 -5.651 -5.100 1.219 1.00 56.92 H new ATOM 0 HB3 ASP A 74 -6.741 -4.023 0.367 1.00 56.92 H new ATOM 1176 N LEU A 75 -3.769 -2.970 1.812 1.00 72.53 N ATOM 1177 CA LEU A 75 -3.442 -1.920 2.773 1.00 72.53 C ATOM 1178 C LEU A 75 -2.341 -1.048 2.199 1.00 72.53 C ATOM 1179 O LEU A 75 -2.408 0.179 2.251 1.00 72.53 O ATOM 1180 CB LEU A 75 -2.973 -2.522 4.094 1.00 72.53 C ATOM 1181 CG LEU A 75 -4.034 -3.248 4.924 1.00 72.53 C ATOM 1182 CD1 LEU A 75 -4.691 -4.349 4.113 1.00 72.53 C ATOM 1183 CD2 LEU A 75 -3.376 -3.824 6.163 1.00 72.53 C ATOM 0 H LEU A 75 -3.451 -3.903 2.076 1.00 72.53 H new ATOM 0 HA LEU A 75 -4.336 -1.325 2.961 1.00 72.53 H new ATOM 0 HB2 LEU A 75 -2.165 -3.223 3.883 1.00 72.53 H new ATOM 0 HB3 LEU A 75 -2.550 -1.723 4.703 1.00 72.53 H new ATOM 0 HG LEU A 75 -4.811 -2.541 5.215 1.00 72.53 H new ATOM 0 HD11 LEU A 75 -5.442 -4.852 4.723 1.00 72.53 H new ATOM 0 HD12 LEU A 75 -5.168 -3.918 3.233 1.00 72.53 H new ATOM 0 HD13 LEU A 75 -3.936 -5.070 3.800 1.00 72.53 H new ATOM 0 HD21 LEU A 75 -4.123 -4.344 6.763 1.00 72.53 H new ATOM 0 HD22 LEU A 75 -2.595 -4.525 5.868 1.00 72.53 H new ATOM 0 HD23 LEU A 75 -2.937 -3.017 6.750 1.00 72.53 H new ATOM 1195 N LEU A 76 -1.331 -1.705 1.628 1.00 57.08 N ATOM 1196 CA LEU A 76 -0.213 -1.007 1.011 1.00 57.08 C ATOM 1197 C LEU A 76 -0.718 -0.056 -0.061 1.00 57.08 C ATOM 1198 O LEU A 76 -0.252 1.071 -0.179 1.00 57.08 O ATOM 1199 CB LEU A 76 0.756 -2.001 0.378 1.00 57.08 C ATOM 1200 CG LEU A 76 2.042 -1.372 -0.169 1.00 57.08 C ATOM 1201 CD1 LEU A 76 3.222 -1.722 0.711 1.00 57.08 C ATOM 1202 CD2 LEU A 76 2.293 -1.809 -1.605 1.00 57.08 C ATOM 0 H LEU A 76 -1.268 -2.722 1.582 1.00 57.08 H new ATOM 0 HA LEU A 76 0.306 -0.444 1.787 1.00 57.08 H new ATOM 0 HB2 LEU A 76 1.022 -2.754 1.120 1.00 57.08 H new ATOM 0 HB3 LEU A 76 0.246 -2.520 -0.434 1.00 57.08 H new ATOM 0 HG LEU A 76 1.919 -0.289 -0.163 1.00 57.08 H new ATOM 0 HD11 LEU A 76 4.126 -1.266 0.306 1.00 57.08 H new ATOM 0 HD12 LEU A 76 3.047 -1.348 1.720 1.00 57.08 H new ATOM 0 HD13 LEU A 76 3.344 -2.805 0.742 1.00 57.08 H new ATOM 0 HD21 LEU A 76 3.211 -1.349 -1.970 1.00 57.08 H new ATOM 0 HD22 LEU A 76 2.390 -2.894 -1.643 1.00 57.08 H new ATOM 0 HD23 LEU A 76 1.457 -1.497 -2.232 1.00 57.08 H new ATOM 1214 N THR A 77 -1.690 -0.531 -0.835 1.00 38.46 N ATOM 1215 CA THR A 77 -2.286 0.254 -1.895 1.00 38.46 C ATOM 1216 C THR A 77 -2.842 1.567 -1.359 1.00 38.46 C ATOM 1217 O THR A 77 -2.648 2.613 -1.961 1.00 38.46 O ATOM 1218 CB THR A 77 -3.412 -0.545 -2.577 1.00 38.46 C ATOM 1219 OG1 THR A 77 -2.872 -1.694 -3.239 1.00 38.46 O ATOM 1220 CG2 THR A 77 -4.184 0.305 -3.572 1.00 38.46 C ATOM 0 H THR A 77 -2.081 -1.468 -0.740 1.00 38.46 H new ATOM 0 HA THR A 77 -1.508 0.480 -2.624 1.00 38.46 H new ATOM 0 HB THR A 77 -4.105 -0.863 -1.798 1.00 38.46 H new ATOM 0 HG1 THR A 77 -2.373 -2.238 -2.595 1.00 38.46 H new ATOM 0 HG21 THR A 77 -4.969 -0.295 -4.031 1.00 38.46 H new ATOM 0 HG22 THR A 77 -4.632 1.154 -3.055 1.00 38.46 H new ATOM 0 HG23 THR A 77 -3.506 0.667 -4.344 1.00 38.46 H new ATOM 1228 N MET A 78 -3.540 1.506 -0.232 1.00 70.15 N ATOM 1229 CA MET A 78 -4.109 2.711 0.349 1.00 70.15 C ATOM 1230 C MET A 78 -3.003 3.664 0.756 1.00 70.15 C ATOM 1231 O MET A 78 -3.102 4.873 0.548 1.00 70.15 O ATOM 1232 CB MET A 78 -4.992 2.369 1.547 1.00 70.15 C ATOM 1233 CG MET A 78 -6.268 1.644 1.155 1.00 70.15 C ATOM 1234 SD MET A 78 -7.422 1.480 2.531 1.00 70.15 S ATOM 1235 CE MET A 78 -8.932 1.068 1.660 1.00 70.15 C ATOM 0 H MET A 78 -3.723 0.649 0.290 1.00 70.15 H new ATOM 0 HA MET A 78 -4.732 3.198 -0.401 1.00 70.15 H new ATOM 0 HB2 MET A 78 -4.427 1.749 2.243 1.00 70.15 H new ATOM 0 HB3 MET A 78 -5.250 3.287 2.075 1.00 70.15 H new ATOM 0 HG2 MET A 78 -6.753 2.183 0.341 1.00 70.15 H new ATOM 0 HG3 MET A 78 -6.017 0.653 0.776 1.00 70.15 H new ATOM 0 HE1 MET A 78 -9.771 1.092 2.355 1.00 70.15 H new ATOM 0 HE2 MET A 78 -9.101 1.792 0.863 1.00 70.15 H new ATOM 0 HE3 MET A 78 -8.844 0.070 1.231 1.00 70.15 H new ATOM 1245 N VAL A 79 -1.941 3.102 1.309 1.00 44.32 N ATOM 1246 CA VAL A 79 -0.795 3.885 1.729 1.00 44.32 C ATOM 1247 C VAL A 79 -0.079 4.439 0.508 1.00 44.32 C ATOM 1248 O VAL A 79 0.285 5.613 0.457 1.00 44.32 O ATOM 1249 CB VAL A 79 0.178 3.023 2.559 1.00 44.32 C ATOM 1250 CG1 VAL A 79 1.275 3.874 3.178 1.00 44.32 C ATOM 1251 CG2 VAL A 79 -0.578 2.234 3.622 1.00 44.32 C ATOM 0 H VAL A 79 -1.851 2.100 1.477 1.00 44.32 H new ATOM 0 HA VAL A 79 -1.145 4.709 2.351 1.00 44.32 H new ATOM 0 HB VAL A 79 0.658 2.311 1.888 1.00 44.32 H new ATOM 0 HG11 VAL A 79 1.945 3.239 3.757 1.00 44.32 H new ATOM 0 HG12 VAL A 79 1.838 4.372 2.389 1.00 44.32 H new ATOM 0 HG13 VAL A 79 0.829 4.623 3.833 1.00 44.32 H new ATOM 0 HG21 VAL A 79 0.125 1.632 4.197 1.00 44.32 H new ATOM 0 HG22 VAL A 79 -1.095 2.924 4.289 1.00 44.32 H new ATOM 0 HG23 VAL A 79 -1.306 1.581 3.141 1.00 44.32 H new ATOM 1261 N VAL A 80 0.095 3.577 -0.480 1.00 90.77 N ATOM 1262 CA VAL A 80 0.741 3.943 -1.728 1.00 90.77 C ATOM 1263 C VAL A 80 -0.095 4.963 -2.501 1.00 90.77 C ATOM 1264 O VAL A 80 0.403 6.011 -2.908 1.00 90.77 O ATOM 1265 CB VAL A 80 0.952 2.684 -2.602 1.00 90.77 C ATOM 1266 CG1 VAL A 80 1.557 3.050 -3.950 1.00 90.77 C ATOM 1267 CG2 VAL A 80 1.822 1.664 -1.872 1.00 90.77 C ATOM 0 H VAL A 80 -0.208 2.604 -0.439 1.00 90.77 H new ATOM 0 HA VAL A 80 1.705 4.392 -1.490 1.00 90.77 H new ATOM 0 HB VAL A 80 -0.022 2.231 -2.787 1.00 90.77 H new ATOM 0 HG11 VAL A 80 1.695 2.147 -4.544 1.00 90.77 H new ATOM 0 HG12 VAL A 80 0.889 3.732 -4.476 1.00 90.77 H new ATOM 0 HG13 VAL A 80 2.522 3.534 -3.797 1.00 90.77 H new ATOM 0 HG21 VAL A 80 1.959 0.785 -2.502 1.00 90.77 H new ATOM 0 HG22 VAL A 80 2.793 2.107 -1.650 1.00 90.77 H new ATOM 0 HG23 VAL A 80 1.336 1.371 -0.942 1.00 90.77 H new ATOM 1277 N ASP A 81 -1.364 4.640 -2.705 1.00 37.97 N ATOM 1278 CA ASP A 81 -2.267 5.516 -3.432 1.00 37.97 C ATOM 1279 C ASP A 81 -2.414 6.843 -2.710 1.00 37.97 C ATOM 1280 O ASP A 81 -2.475 7.900 -3.337 1.00 37.97 O ATOM 1281 CB ASP A 81 -3.635 4.853 -3.613 1.00 37.97 C ATOM 1282 CG ASP A 81 -3.584 3.651 -4.540 1.00 37.97 C ATOM 1283 OD1 ASP A 81 -2.531 3.434 -5.178 1.00 37.97 O ATOM 1284 OD2 ASP A 81 -4.599 2.928 -4.631 1.00 37.97 O ATOM 0 H ASP A 81 -1.791 3.774 -2.375 1.00 37.97 H new ATOM 0 HA ASP A 81 -1.843 5.702 -4.419 1.00 37.97 H new ATOM 0 HB2 ASP A 81 -4.015 4.541 -2.640 1.00 37.97 H new ATOM 0 HB3 ASP A 81 -4.339 5.584 -4.011 1.00 37.97 H new ATOM 1289 N TYR A 82 -2.457 6.786 -1.382 1.00130.70 N ATOM 1290 CA TYR A 82 -2.577 7.987 -0.586 1.00130.70 C ATOM 1291 C TYR A 82 -1.365 8.879 -0.783 1.00130.70 C ATOM 1292 O TYR A 82 -1.488 10.098 -0.902 1.00130.70 O ATOM 1293 CB TYR A 82 -2.721 7.604 0.884 1.00130.70 C ATOM 1294 CG TYR A 82 -2.450 8.729 1.857 1.00130.70 C ATOM 1295 CD1 TYR A 82 -1.144 9.093 2.166 1.00130.70 C ATOM 1296 CD2 TYR A 82 -3.481 9.413 2.472 1.00130.70 C ATOM 1297 CE1 TYR A 82 -0.880 10.108 3.058 1.00130.70 C ATOM 1298 CE2 TYR A 82 -3.222 10.420 3.364 1.00130.70 C ATOM 1299 CZ TYR A 82 -1.923 10.769 3.657 1.00130.70 C ATOM 1300 OH TYR A 82 -1.672 11.783 4.550 1.00130.70 O ATOM 0 H TYR A 82 -2.410 5.921 -0.843 1.00130.70 H new ATOM 0 HA TYR A 82 -3.460 8.541 -0.904 1.00130.70 H new ATOM 0 HB2 TYR A 82 -3.732 7.232 1.052 1.00130.70 H new ATOM 0 HB3 TYR A 82 -2.039 6.782 1.100 1.00130.70 H new ATOM 0 HD1 TYR A 82 -0.323 8.571 1.698 1.00130.70 H new ATOM 0 HD2 TYR A 82 -4.504 9.150 2.247 1.00130.70 H new ATOM 0 HE1 TYR A 82 0.140 10.382 3.285 1.00130.70 H new ATOM 0 HE2 TYR A 82 -4.040 10.942 3.839 1.00130.70 H new ATOM 0 HH TYR A 82 -0.830 12.226 4.314 1.00130.70 H new ATOM 1310 N ARG A 83 -0.186 8.264 -0.800 1.00265.02 N ATOM 1311 CA ARG A 83 1.056 9.003 -0.965 1.00265.02 C ATOM 1312 C ARG A 83 0.949 9.943 -2.151 1.00265.02 C ATOM 1313 O ARG A 83 1.245 11.115 -2.032 1.00265.02 O ATOM 1314 CB ARG A 83 2.223 8.012 -1.141 1.00265.02 C ATOM 1315 CG ARG A 83 3.486 8.601 -1.773 1.00265.02 C ATOM 1316 CD ARG A 83 3.698 8.050 -3.176 1.00265.02 C ATOM 1317 NE ARG A 83 5.068 8.255 -3.643 1.00265.02 N ATOM 1318 CZ ARG A 83 5.455 8.111 -4.910 1.00265.02 C ATOM 1319 NH1 ARG A 83 4.581 7.774 -5.852 1.00265.02 N ATOM 1320 NH2 ARG A 83 6.724 8.312 -5.238 1.00265.02 N ATOM 0 H ARG A 83 -0.067 7.256 -0.701 1.00265.02 H new ATOM 0 HA ARG A 83 1.246 9.606 -0.077 1.00265.02 H new ATOM 0 HB2 ARG A 83 2.481 7.602 -0.165 1.00265.02 H new ATOM 0 HB3 ARG A 83 1.882 7.179 -1.756 1.00265.02 H new ATOM 0 HG2 ARG A 83 3.405 9.687 -1.813 1.00265.02 H new ATOM 0 HG3 ARG A 83 4.351 8.368 -1.152 1.00265.02 H new ATOM 0 HD2 ARG A 83 3.467 6.985 -3.186 1.00265.02 H new ATOM 0 HD3 ARG A 83 3.004 8.533 -3.864 1.00265.02 H new ATOM 0 HE ARG A 83 5.772 8.525 -2.956 1.00265.02 H new ATOM 0 HH11 ARG A 83 3.602 7.623 -5.609 1.00265.02 H new ATOM 0 HH12 ARG A 83 4.889 7.667 -6.818 1.00265.02 H new ATOM 0 HH21 ARG A 83 7.400 8.576 -4.522 1.00265.02 H new ATOM 0 HH22 ARG A 83 7.024 8.203 -6.207 1.00265.02 H new ATOM 1334 N THR A 84 0.504 9.420 -3.271 1.00259.68 N ATOM 1335 CA THR A 84 0.347 10.210 -4.467 1.00259.68 C ATOM 1336 C THR A 84 -0.841 11.175 -4.385 1.00259.68 C ATOM 1337 O THR A 84 -0.755 12.312 -4.850 1.00259.68 O ATOM 1338 CB THR A 84 0.158 9.291 -5.675 1.00259.68 C ATOM 1339 OG1 THR A 84 1.274 8.401 -5.798 1.00259.68 O ATOM 1340 CG2 THR A 84 0.006 10.107 -6.937 1.00259.68 C ATOM 0 H THR A 84 0.242 8.440 -3.377 1.00259.68 H new ATOM 0 HA THR A 84 1.253 10.806 -4.574 1.00259.68 H new ATOM 0 HB THR A 84 -0.748 8.704 -5.526 1.00259.68 H new ATOM 0 HG1 THR A 84 1.142 7.816 -6.573 1.00259.68 H new ATOM 0 HG21 THR A 84 -0.128 9.439 -7.788 1.00259.68 H new ATOM 0 HG22 THR A 84 -0.863 10.758 -6.847 1.00259.68 H new ATOM 0 HG23 THR A 84 0.899 10.713 -7.088 1.00259.68 H new ATOM 1348 N ARG A 85 -1.957 10.702 -3.849 1.00220.68 N ATOM 1349 CA ARG A 85 -3.160 11.523 -3.781 1.00220.68 C ATOM 1350 C ARG A 85 -2.966 12.740 -2.879 1.00220.68 C ATOM 1351 O ARG A 85 -3.300 13.862 -3.258 1.00220.68 O ATOM 1352 CB ARG A 85 -4.354 10.667 -3.324 1.00220.68 C ATOM 1353 CG ARG A 85 -4.591 10.622 -1.823 1.00220.68 C ATOM 1354 CD ARG A 85 -5.616 9.570 -1.489 1.00220.68 C ATOM 1355 NE ARG A 85 -6.984 10.079 -1.584 1.00220.68 N ATOM 1356 CZ ARG A 85 -8.061 9.306 -1.731 1.00220.68 C ATOM 1357 NH1 ARG A 85 -7.940 7.985 -1.806 1.00220.68 N ATOM 1358 NH2 ARG A 85 -9.266 9.857 -1.803 1.00220.68 N ATOM 0 H ARG A 85 -2.056 9.765 -3.459 1.00220.68 H new ATOM 0 HA ARG A 85 -3.369 11.906 -4.780 1.00220.68 H new ATOM 0 HB2 ARG A 85 -5.256 11.046 -3.805 1.00220.68 H new ATOM 0 HB3 ARG A 85 -4.206 9.648 -3.682 1.00220.68 H new ATOM 0 HG2 ARG A 85 -3.656 10.406 -1.306 1.00220.68 H new ATOM 0 HG3 ARG A 85 -4.931 11.596 -1.472 1.00220.68 H new ATOM 0 HD2 ARG A 85 -5.498 8.723 -2.165 1.00220.68 H new ATOM 0 HD3 ARG A 85 -5.438 9.199 -0.480 1.00220.68 H new ATOM 0 HE ARG A 85 -7.123 11.088 -1.535 1.00220.68 H new ATOM 0 HH11 ARG A 85 -7.017 7.553 -1.751 1.00220.68 H new ATOM 0 HH12 ARG A 85 -8.770 7.402 -1.918 1.00220.68 H new ATOM 0 HH21 ARG A 85 -9.368 10.870 -1.746 1.00220.68 H new ATOM 0 HH22 ARG A 85 -10.091 9.267 -1.915 1.00220.68 H new ATOM 1372 N VAL A 86 -2.408 12.516 -1.698 1.00 63.58 N ATOM 1373 CA VAL A 86 -2.158 13.609 -0.774 1.00 63.58 C ATOM 1374 C VAL A 86 -0.988 14.441 -1.292 1.00 63.58 C ATOM 1375 O VAL A 86 -0.932 15.646 -1.088 1.00 63.58 O ATOM 1376 CB VAL A 86 -1.905 13.101 0.662 1.00 63.58 C ATOM 1377 CG1 VAL A 86 -1.492 14.234 1.596 1.00 63.58 C ATOM 1378 CG2 VAL A 86 -3.163 12.419 1.180 1.00 63.58 C ATOM 0 H VAL A 86 -2.123 11.597 -1.361 1.00 63.58 H new ATOM 0 HA VAL A 86 -3.047 14.237 -0.721 1.00 63.58 H new ATOM 0 HB VAL A 86 -1.081 12.387 0.636 1.00 63.58 H new ATOM 0 HG11 VAL A 86 -1.323 13.837 2.597 1.00 63.58 H new ATOM 0 HG12 VAL A 86 -0.574 14.693 1.228 1.00 63.58 H new ATOM 0 HG13 VAL A 86 -2.283 14.983 1.632 1.00 63.58 H new ATOM 0 HG21 VAL A 86 -2.990 12.058 2.194 1.00 63.58 H new ATOM 0 HG22 VAL A 86 -3.988 13.132 1.184 1.00 63.58 H new ATOM 0 HG23 VAL A 86 -3.413 11.578 0.533 1.00 63.58 H new ATOM 1583 N LEU A 99 18.154 19.806 0.811 1.00281.45 N ATOM 1584 CA LEU A 99 18.953 20.830 1.459 1.00281.45 C ATOM 1585 C LEU A 99 18.471 21.089 2.882 1.00281.45 C ATOM 1586 O LEU A 99 17.273 21.223 3.123 1.00281.45 O ATOM 1587 CB LEU A 99 18.881 22.114 0.646 1.00281.45 C ATOM 1588 CG LEU A 99 19.681 22.092 -0.653 1.00281.45 C ATOM 1589 CD1 LEU A 99 21.118 21.673 -0.396 1.00281.45 C ATOM 1590 CD2 LEU A 99 19.024 21.176 -1.673 1.00281.45 C ATOM 0 HA LEU A 99 19.985 20.482 1.513 1.00281.45 H new ATOM 0 HB2 LEU A 99 17.837 22.321 0.410 1.00281.45 H new ATOM 0 HB3 LEU A 99 19.238 22.939 1.263 1.00281.45 H new ATOM 0 HG LEU A 99 19.693 23.102 -1.062 1.00281.45 H new ATOM 0 HD11 LEU A 99 21.668 21.665 -1.337 1.00281.45 H new ATOM 0 HD12 LEU A 99 21.585 22.378 0.292 1.00281.45 H new ATOM 0 HD13 LEU A 99 21.133 20.675 0.042 1.00281.45 H new ATOM 0 HD21 LEU A 99 19.610 21.175 -2.592 1.00281.45 H new ATOM 0 HD22 LEU A 99 18.974 20.163 -1.273 1.00281.45 H new ATOM 0 HD23 LEU A 99 18.016 21.532 -1.886 1.00281.45 H new ATOM 1602 N THR A 100 19.402 21.145 3.829 1.00235.89 N ATOM 1603 CA THR A 100 19.041 21.387 5.218 1.00235.89 C ATOM 1604 C THR A 100 19.211 22.863 5.612 1.00235.89 C ATOM 1605 O THR A 100 18.272 23.651 5.493 1.00235.89 O ATOM 1606 CB THR A 100 19.839 20.481 6.179 1.00235.89 C ATOM 1607 OG1 THR A 100 21.235 20.794 6.111 1.00235.89 O ATOM 1608 CG2 THR A 100 19.632 19.016 5.832 1.00235.89 C ATOM 0 H THR A 100 20.401 21.027 3.661 1.00235.89 H new ATOM 0 HA THR A 100 17.984 21.137 5.309 1.00235.89 H new ATOM 0 HB THR A 100 19.477 20.659 7.192 1.00235.89 H new ATOM 0 HG1 THR A 100 21.723 20.259 6.772 1.00235.89 H new ATOM 0 HG21 THR A 100 20.203 18.395 6.522 1.00235.89 H new ATOM 0 HG22 THR A 100 18.573 18.769 5.913 1.00235.89 H new ATOM 0 HG23 THR A 100 19.971 18.832 4.812 1.00235.89 H new ATOM 1616 N ARG A 101 20.403 23.234 6.087 1.00326.00 N ATOM 1617 CA ARG A 101 20.671 24.610 6.501 1.00326.00 C ATOM 1618 C ARG A 101 21.296 25.418 5.366 1.00326.00 C ATOM 1619 O ARG A 101 22.431 25.888 5.471 1.00326.00 O ATOM 1620 CB ARG A 101 21.589 24.624 7.726 1.00326.00 C ATOM 1621 CG ARG A 101 21.153 23.663 8.820 1.00326.00 C ATOM 1622 CD ARG A 101 21.650 22.254 8.549 1.00326.00 C ATOM 1623 NE ARG A 101 22.132 21.591 9.759 1.00326.00 N ATOM 1624 CZ ARG A 101 21.357 21.264 10.793 1.00326.00 C ATOM 1625 NH1 ARG A 101 20.055 21.530 10.775 1.00326.00 N ATOM 1626 NH2 ARG A 101 21.886 20.663 11.849 1.00326.00 N ATOM 0 H ARG A 101 21.195 22.601 6.194 1.00326.00 H new ATOM 0 HA ARG A 101 19.720 25.074 6.762 1.00326.00 H new ATOM 0 HB2 ARG A 101 22.602 24.371 7.414 1.00326.00 H new ATOM 0 HB3 ARG A 101 21.623 25.635 8.133 1.00326.00 H new ATOM 0 HG2 ARG A 101 21.534 24.006 9.782 1.00326.00 H new ATOM 0 HG3 ARG A 101 20.065 23.660 8.891 1.00326.00 H new ATOM 0 HD2 ARG A 101 20.844 21.665 8.112 1.00326.00 H new ATOM 0 HD3 ARG A 101 22.453 22.290 7.813 1.00326.00 H new ATOM 0 HE ARG A 101 23.125 21.364 9.816 1.00326.00 H new ATOM 0 HH11 ARG A 101 19.639 21.989 9.964 1.00326.00 H new ATOM 0 HH12 ARG A 101 19.471 21.275 11.572 1.00326.00 H new ATOM 0 HH21 ARG A 101 22.884 20.452 11.869 1.00326.00 H new ATOM 0 HH22 ARG A 101 21.295 20.412 12.642 1.00326.00 H new ATOM 1640 N ILE A 102 20.561 25.564 4.274 1.00164.55 N ATOM 1641 CA ILE A 102 21.057 26.299 3.117 1.00164.55 C ATOM 1642 C ILE A 102 20.438 27.695 3.039 1.00164.55 C ATOM 1643 O ILE A 102 19.429 27.892 2.370 1.00164.55 O ATOM 1644 CB ILE A 102 20.791 25.519 1.806 1.00164.55 C ATOM 1645 CG1 ILE A 102 21.593 24.224 1.806 1.00164.55 C ATOM 1646 CG2 ILE A 102 21.137 26.346 0.572 1.00164.55 C ATOM 1647 CD1 ILE A 102 21.159 23.244 2.865 1.00164.55 C ATOM 0 H ILE A 102 19.621 25.185 4.163 1.00164.55 H new ATOM 0 HA ILE A 102 22.134 26.411 3.239 1.00164.55 H new ATOM 0 HB ILE A 102 19.725 25.294 1.763 1.00164.55 H new ATOM 0 HG12 ILE A 102 21.504 23.752 0.828 1.00164.55 H new ATOM 0 HG13 ILE A 102 22.647 24.460 1.951 1.00164.55 H new ATOM 0 HG21 ILE A 102 20.936 25.762 -0.326 1.00164.55 H new ATOM 0 HG22 ILE A 102 20.530 27.252 0.559 1.00164.55 H new ATOM 0 HG23 ILE A 102 22.193 26.617 0.600 1.00164.55 H new ATOM 0 HD11 ILE A 102 21.774 22.346 2.804 1.00164.55 H new ATOM 0 HD12 ILE A 102 21.275 23.697 3.850 1.00164.55 H new ATOM 0 HD13 ILE A 102 20.114 22.978 2.708 1.00164.55 H new ATOM 1659 N PRO A 103 21.041 28.688 3.711 1.00 72.69 N ATOM 1660 CA PRO A 103 20.536 30.064 3.692 1.00 72.69 C ATOM 1661 C PRO A 103 20.540 30.673 2.289 1.00 72.69 C ATOM 1662 O PRO A 103 19.818 31.632 2.023 1.00 72.69 O ATOM 1663 CB PRO A 103 21.504 30.813 4.605 1.00 72.69 C ATOM 1664 CG PRO A 103 22.734 29.981 4.628 1.00 72.69 C ATOM 1665 CD PRO A 103 22.260 28.564 4.529 1.00 72.69 C ATOM 0 HA PRO A 103 19.497 30.117 4.017 1.00 72.69 H new ATOM 0 HB2 PRO A 103 21.711 31.813 4.224 1.00 72.69 H new ATOM 0 HB3 PRO A 103 21.090 30.932 5.606 1.00 72.69 H new ATOM 0 HG2 PRO A 103 23.394 30.233 3.798 1.00 72.69 H new ATOM 0 HG3 PRO A 103 23.300 30.142 5.545 1.00 72.69 H new ATOM 0 HD2 PRO A 103 23.002 27.921 4.056 1.00 72.69 H new ATOM 0 HD3 PRO A 103 22.048 28.138 5.510 1.00 72.69 H new ATOM 1673 N SER A 104 21.351 30.109 1.391 1.00159.85 N ATOM 1674 CA SER A 104 21.430 30.607 0.016 1.00159.85 C ATOM 1675 C SER A 104 20.274 30.084 -0.848 1.00159.85 C ATOM 1676 O SER A 104 20.114 30.502 -1.995 1.00159.85 O ATOM 1677 CB SER A 104 22.765 30.209 -0.615 1.00159.85 C ATOM 1678 OG SER A 104 23.844 30.906 -0.017 1.00159.85 O ATOM 0 H SER A 104 21.958 29.313 1.589 1.00159.85 H new ATOM 0 HA SER A 104 21.354 31.694 0.058 1.00159.85 H new ATOM 0 HB2 SER A 104 22.917 29.135 -0.504 1.00159.85 H new ATOM 0 HB3 SER A 104 22.741 30.419 -1.684 1.00159.85 H new ATOM 0 HG SER A 104 24.685 30.631 -0.438 1.00159.85 H new ATOM 1684 N ALA A 105 19.466 29.181 -0.292 1.00293.58 N ATOM 1685 CA ALA A 105 18.326 28.620 -1.007 1.00293.58 C ATOM 1686 C ALA A 105 17.134 28.526 -0.070 1.00293.58 C ATOM 1687 O ALA A 105 16.106 29.170 -0.279 1.00293.58 O ATOM 1688 CB ALA A 105 18.672 27.247 -1.566 1.00293.58 C ATOM 0 H ALA A 105 19.583 28.823 0.656 1.00293.58 H new ATOM 0 HA ALA A 105 18.073 29.273 -1.842 1.00293.58 H new ATOM 0 HB1 ALA A 105 17.810 26.842 -2.097 1.00293.58 H new ATOM 0 HB2 ALA A 105 19.513 27.336 -2.254 1.00293.58 H new ATOM 0 HB3 ALA A 105 18.941 26.578 -0.748 1.00293.58 H new ATOM 1694 N LYS A 106 17.300 27.739 0.985 1.00328.40 N ATOM 1695 CA LYS A 106 16.266 27.573 1.990 1.00328.40 C ATOM 1696 C LYS A 106 16.352 28.723 2.982 1.00328.40 C ATOM 1697 O LYS A 106 17.449 29.120 3.378 1.00328.40 O ATOM 1698 CB LYS A 106 16.449 26.247 2.724 1.00328.40 C ATOM 1699 CG LYS A 106 16.553 25.048 1.800 1.00328.40 C ATOM 1700 CD LYS A 106 16.473 23.746 2.573 1.00328.40 C ATOM 1701 CE LYS A 106 15.163 23.623 3.338 1.00328.40 C ATOM 1702 NZ LYS A 106 14.737 22.203 3.505 1.00328.40 N ATOM 0 H LYS A 106 18.149 27.203 1.165 1.00328.40 H new ATOM 0 HA LYS A 106 15.289 27.571 1.506 1.00328.40 H new ATOM 0 HB2 LYS A 106 17.349 26.302 3.336 1.00328.40 H new ATOM 0 HB3 LYS A 106 15.610 26.099 3.404 1.00328.40 H new ATOM 0 HG2 LYS A 106 15.752 25.085 1.062 1.00328.40 H new ATOM 0 HG3 LYS A 106 17.494 25.090 1.251 1.00328.40 H new ATOM 0 HD2 LYS A 106 16.572 22.907 1.884 1.00328.40 H new ATOM 0 HD3 LYS A 106 17.308 23.685 3.270 1.00328.40 H new ATOM 0 HE2 LYS A 106 15.273 24.085 4.319 1.00328.40 H new ATOM 0 HE3 LYS A 106 14.384 24.174 2.811 1.00328.40 H new ATOM 0 HZ1 LYS A 106 14.300 22.079 4.441 1.00328.40 H new ATOM 0 HZ2 LYS A 106 14.047 21.958 2.766 1.00328.40 H new ATOM 0 HZ3 LYS A 106 15.566 21.580 3.425 1.00328.40 H new ATOM 1716 N LYS A 107 15.211 29.275 3.375 1.00281.61 N ATOM 1717 CA LYS A 107 15.214 30.393 4.310 1.00281.61 C ATOM 1718 C LYS A 107 14.933 29.960 5.742 1.00281.61 C ATOM 1719 O LYS A 107 14.073 29.120 6.007 1.00281.61 O ATOM 1720 CB LYS A 107 14.202 31.459 3.905 1.00281.61 C ATOM 1721 CG LYS A 107 14.457 32.057 2.534 1.00281.61 C ATOM 1722 CD LYS A 107 13.439 33.135 2.205 1.00281.61 C ATOM 1723 CE LYS A 107 13.608 34.353 3.100 1.00281.61 C ATOM 1724 NZ LYS A 107 13.389 35.622 2.350 1.00281.61 N ATOM 0 H LYS A 107 14.286 28.974 3.067 1.00281.61 H new ATOM 0 HA LYS A 107 16.220 30.810 4.270 1.00281.61 H new ATOM 0 HB2 LYS A 107 13.203 31.023 3.921 1.00281.61 H new ATOM 0 HB3 LYS A 107 14.213 32.257 4.647 1.00281.61 H new ATOM 0 HG2 LYS A 107 15.461 32.479 2.500 1.00281.61 H new ATOM 0 HG3 LYS A 107 14.416 31.272 1.779 1.00281.61 H new ATOM 0 HD2 LYS A 107 13.546 33.431 1.162 1.00281.61 H new ATOM 0 HD3 LYS A 107 12.432 32.734 2.321 1.00281.61 H new ATOM 0 HE2 LYS A 107 12.904 34.295 3.930 1.00281.61 H new ATOM 0 HE3 LYS A 107 14.610 34.353 3.530 1.00281.61 H new ATOM 0 HZ1 LYS A 107 13.512 36.431 2.992 1.00281.61 H new ATOM 0 HZ2 LYS A 107 14.077 35.689 1.573 1.00281.61 H new ATOM 0 HZ3 LYS A 107 12.425 35.633 1.961 1.00281.61 H new ATOM 1738 N TYR A 108 15.662 30.586 6.653 1.00309.62 N ATOM 1739 CA TYR A 108 15.534 30.354 8.090 1.00309.62 C ATOM 1740 C TYR A 108 14.082 30.447 8.544 1.00309.62 C ATOM 1741 O TYR A 108 13.283 31.170 7.949 1.00309.62 O ATOM 1742 CB TYR A 108 16.332 31.427 8.819 1.00309.62 C ATOM 1743 CG TYR A 108 15.889 32.822 8.426 1.00309.62 C ATOM 1744 CD1 TYR A 108 16.446 33.462 7.327 1.00309.62 C ATOM 1745 CD2 TYR A 108 14.900 33.486 9.138 1.00309.62 C ATOM 1746 CE1 TYR A 108 16.038 34.723 6.952 1.00309.62 C ATOM 1747 CE2 TYR A 108 14.483 34.752 8.770 1.00309.62 C ATOM 1748 CZ TYR A 108 15.057 35.368 7.677 1.00309.62 C ATOM 1749 OH TYR A 108 14.648 36.628 7.307 1.00309.62 O ATOM 0 H TYR A 108 16.370 31.280 6.415 1.00309.62 H new ATOM 0 HA TYR A 108 15.903 29.353 8.314 1.00309.62 H new ATOM 0 HB2 TYR A 108 16.216 31.298 9.895 1.00309.62 H new ATOM 0 HB3 TYR A 108 17.392 31.306 8.596 1.00309.62 H new ATOM 0 HD1 TYR A 108 17.214 32.962 6.755 1.00309.62 H new ATOM 0 HD2 TYR A 108 14.449 33.006 9.994 1.00309.62 H new ATOM 0 HE1 TYR A 108 16.484 35.205 6.094 1.00309.62 H new ATOM 0 HE2 TYR A 108 13.712 35.256 9.335 1.00309.62 H new ATOM 0 HH TYR A 108 14.748 36.733 6.338 1.00309.62 H new ATOM 1759 N LYS A 109 13.752 29.738 9.616 1.00276.51 N ATOM 1760 CA LYS A 109 12.399 29.777 10.154 1.00276.51 C ATOM 1761 C LYS A 109 12.311 30.655 11.392 1.00276.51 C ATOM 1762 O LYS A 109 11.286 30.671 12.072 1.00276.51 O ATOM 1763 CB LYS A 109 11.917 28.379 10.481 1.00276.51 C ATOM 1764 CG LYS A 109 12.142 27.396 9.349 1.00276.51 C ATOM 1765 CD LYS A 109 11.838 25.971 9.782 1.00276.51 C ATOM 1766 CE LYS A 109 12.659 25.578 11.004 1.00276.51 C ATOM 1767 NZ LYS A 109 13.220 24.201 10.887 1.00276.51 N ATOM 0 H LYS A 109 14.397 29.134 10.126 1.00276.51 H new ATOM 0 HA LYS A 109 11.757 30.209 9.387 1.00276.51 H new ATOM 0 HB2 LYS A 109 12.432 28.022 11.373 1.00276.51 H new ATOM 0 HB3 LYS A 109 10.854 28.413 10.719 1.00276.51 H new ATOM 0 HG2 LYS A 109 11.510 27.663 8.502 1.00276.51 H new ATOM 0 HG3 LYS A 109 13.175 27.462 9.008 1.00276.51 H new ATOM 0 HD2 LYS A 109 10.776 25.876 10.009 1.00276.51 H new ATOM 0 HD3 LYS A 109 12.052 25.286 8.962 1.00276.51 H new ATOM 0 HE2 LYS A 109 13.473 26.290 11.137 1.00276.51 H new ATOM 0 HE3 LYS A 109 12.034 25.639 11.895 1.00276.51 H new ATOM 0 HZ1 LYS A 109 13.771 23.977 11.740 1.00276.51 H new ATOM 0 HZ2 LYS A 109 12.443 23.517 10.787 1.00276.51 H new ATOM 0 HZ3 LYS A 109 13.838 24.148 10.052 1.00276.51 H new ATOM 1781 N ASP A 110 13.365 31.420 11.665 1.00203.92 N ATOM 1782 CA ASP A 110 13.365 32.333 12.802 1.00203.92 C ATOM 1783 C ASP A 110 12.166 33.276 12.706 1.00203.92 C ATOM 1784 O ASP A 110 11.681 33.791 13.712 1.00203.92 O ATOM 1785 CB ASP A 110 14.665 33.138 12.846 1.00203.92 C ATOM 1786 CG ASP A 110 15.861 32.290 13.238 1.00203.92 C ATOM 1787 OD1 ASP A 110 15.653 31.207 13.826 1.00203.92 O ATOM 1788 OD2 ASP A 110 17.003 32.711 12.961 1.00203.92 O ATOM 0 H ASP A 110 14.225 31.425 11.117 1.00203.92 H new ATOM 0 HA ASP A 110 13.291 31.750 13.720 1.00203.92 H new ATOM 0 HB2 ASP A 110 14.845 33.585 11.868 1.00203.92 H new ATOM 0 HB3 ASP A 110 14.557 33.958 13.556 1.00203.92 H new ATOM 1793 N ILE A 111 11.677 33.468 11.478 1.00 50.97 N ATOM 1794 CA ILE A 111 10.522 34.304 11.234 1.00 50.97 C ATOM 1795 C ILE A 111 9.261 33.490 11.533 1.00 50.97 C ATOM 1796 O ILE A 111 9.296 32.260 11.526 1.00 50.97 O ATOM 1797 CB ILE A 111 10.556 34.866 9.778 1.00 50.97 C ATOM 1798 CG1 ILE A 111 11.317 36.193 9.760 1.00 50.97 C ATOM 1799 CG2 ILE A 111 9.166 35.048 9.170 1.00 50.97 C ATOM 1800 CD1 ILE A 111 11.712 36.646 8.371 1.00 50.97 C ATOM 0 H ILE A 111 12.074 33.047 10.638 1.00 50.97 H new ATOM 0 HA ILE A 111 10.526 35.172 11.893 1.00 50.97 H new ATOM 0 HB ILE A 111 11.068 34.127 9.161 1.00 50.97 H new ATOM 0 HG12 ILE A 111 10.699 36.963 10.222 1.00 50.97 H new ATOM 0 HG13 ILE A 111 12.215 36.096 10.370 1.00 50.97 H new ATOM 0 HG21 ILE A 111 9.260 35.441 8.158 1.00 50.97 H new ATOM 0 HG22 ILE A 111 8.654 34.086 9.139 1.00 50.97 H new ATOM 0 HG23 ILE A 111 8.591 35.746 9.779 1.00 50.97 H new ATOM 0 HD11 ILE A 111 12.248 37.593 8.436 1.00 50.97 H new ATOM 0 HD12 ILE A 111 12.356 35.895 7.913 1.00 50.97 H new ATOM 0 HD13 ILE A 111 10.817 36.776 7.762 1.00 50.97 H new ATOM 1812 N ILE A 112 8.164 34.172 11.826 1.00108.96 N ATOM 1813 CA ILE A 112 6.926 33.483 12.158 1.00108.96 C ATOM 1814 C ILE A 112 6.092 33.175 10.925 1.00108.96 C ATOM 1815 O ILE A 112 5.575 34.076 10.265 1.00108.96 O ATOM 1816 CB ILE A 112 6.062 34.314 13.133 1.00108.96 C ATOM 1817 CG1 ILE A 112 6.885 34.756 14.351 1.00108.96 C ATOM 1818 CG2 ILE A 112 4.833 33.522 13.570 1.00108.96 C ATOM 1819 CD1 ILE A 112 7.632 33.629 15.034 1.00108.96 C ATOM 0 H ILE A 112 8.105 35.190 11.841 1.00108.96 H new ATOM 0 HA ILE A 112 7.224 32.547 12.631 1.00108.96 H new ATOM 0 HB ILE A 112 5.724 35.209 12.610 1.00108.96 H new ATOM 0 HG12 ILE A 112 7.602 35.514 14.036 1.00108.96 H new ATOM 0 HG13 ILE A 112 6.219 35.227 15.074 1.00108.96 H new ATOM 0 HG21 ILE A 112 4.237 34.124 14.256 1.00108.96 H new ATOM 0 HG22 ILE A 112 4.234 33.269 12.696 1.00108.96 H new ATOM 0 HG23 ILE A 112 5.149 32.607 14.071 1.00108.96 H new ATOM 0 HD11 ILE A 112 8.188 34.024 15.884 1.00108.96 H new ATOM 0 HD12 ILE A 112 6.921 32.880 15.382 1.00108.96 H new ATOM 0 HD13 ILE A 112 8.325 33.171 14.328 1.00108.96 H new