USER MOD reduce.3.24.130724 H: found=0, std=0, add=1488, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1486 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 91 GLN : amide:sc= -0.0791 K(o=-2.2,f=-4.4) USER MOD Set 1.2: B 81 HIS : no HE2:sc= -2.08 K(o=-2.2,f=-4.5) USER MOD Set 2.1: B 50 ASN : amide:sc= -0.875 K(o=-1.2,f=-6.3!) USER MOD Set 2.2: B 54 HIS : no HD1:sc= -0.278 K(o=-1.2,f=-2.5) USER MOD Set 3.1: B 35 CYS SG : rot 180:sc= 0.0649 USER MOD Set 3.2: B 39 GLN : amide:sc= -3.91! C(o=-5.1!,f=-6.2!) USER MOD Set 3.3: B 43 HIS : no HD1:sc= -1.25! C(o=-5.1!,f=-5.8!) USER MOD Set 4.1: A 81 HIS : no HE2:sc= -0.7 K(o=-0.85,f=-4.1) USER MOD Set 4.2: B 91 GLN : amide:sc= -0.153 K(o=-0.85,f=-3.6) USER MOD Set 5.1: A 39 GLN : amide:sc= -2.95 X(o=-5.1,f=-5.5!) USER MOD Set 5.2: A 43 HIS :FLIP no HD1:sc= -2.15 F(o=-6.4!,f=-5.1) USER MOD Set 6.1: A 22 THR OG1 : rot -140:sc= 0 USER MOD Set 6.2: A 50 ASN : amide:sc= -0.695 K(o=-1.2,f=-5.2!) USER MOD Set 6.3: A 54 HIS : no HD1:sc= -0.48 K(o=-1.2,f=-2.2) USER MOD Single : A 24 CYS SG : rot -170:sc= -0.0571 USER MOD Single : A 35 CYS SG : rot -106:sc= 0.251 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0.589 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 73:sc= 1.26 USER MOD Single : A 53 ASN : amide:sc= 0.622 K(o=0.62,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot -110:sc= 0.115 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.21 K(o=0.21,f=-5.2!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.155 USER MOD Single : A 100 GLN : amide:sc= 0.113 K(o=0.11,f=-0.39) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0 USER MOD Single : B 24 CYS SG : rot -170:sc= -0.186 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 47 THR OG1 : rot 180:sc= 0.693 USER MOD Single : B 49 SER OG : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 106:sc= 1.22 USER MOD Single : B 53 ASN : amide:sc= -0.0347 K(o=-0.035,f=-1.3!) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot -110:sc= 0.128 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0.471 K(o=0.47,f=-5.1!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 98 THR OG1 : rot 180:sc= -0.124 USER MOD Single : B 100 GLN : amide:sc= 0.734 K(o=0.73,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 10 6.483 1.768 -10.333 1.00 0.00 N ATOM 2 CA ALA A 10 5.823 0.524 -10.002 1.00 0.00 C ATOM 3 C ALA A 10 4.971 0.623 -8.743 1.00 0.00 C ATOM 4 O ALA A 10 5.440 1.042 -7.677 1.00 0.00 O ATOM 5 CB ALA A 10 6.871 -0.584 -9.902 1.00 0.00 C ATOM 0 HA ALA A 10 5.121 0.283 -10.801 1.00 0.00 H new ATOM 0 HB1 ALA A 10 6.382 -1.526 -9.653 1.00 0.00 H new ATOM 0 HB2 ALA A 10 7.387 -0.684 -10.857 1.00 0.00 H new ATOM 0 HB3 ALA A 10 7.593 -0.333 -9.125 1.00 0.00 H new ATOM 11 N LEU A 11 3.748 0.100 -8.840 1.00 0.00 N ATOM 12 CA LEU A 11 2.883 -0.099 -7.678 1.00 0.00 C ATOM 13 C LEU A 11 3.451 -1.143 -6.707 1.00 0.00 C ATOM 14 O LEU A 11 3.171 -1.074 -5.511 1.00 0.00 O ATOM 15 CB LEU A 11 1.444 -0.366 -8.145 1.00 0.00 C ATOM 16 CG LEU A 11 1.176 -1.568 -9.080 1.00 0.00 C ATOM 17 CD1 LEU A 11 1.292 -2.940 -8.416 1.00 0.00 C ATOM 18 CD2 LEU A 11 -0.267 -1.443 -9.574 1.00 0.00 C ATOM 0 H LEU A 11 3.331 -0.196 -9.723 1.00 0.00 H new ATOM 0 HA LEU A 11 2.851 0.815 -7.085 1.00 0.00 H new ATOM 0 HB2 LEU A 11 0.827 -0.495 -7.256 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.089 0.532 -8.651 1.00 0.00 H new ATOM 0 HG LEU A 11 1.934 -1.526 -9.862 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.087 -3.718 -9.151 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.300 -3.069 -8.022 1.00 0.00 H new ATOM 0 HD13 LEU A 11 0.572 -3.012 -7.601 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.497 -2.275 -10.239 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -0.946 -1.461 -8.722 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -0.387 -0.503 -10.113 1.00 0.00 H new ATOM 30 N ALA A 12 4.323 -2.028 -7.207 1.00 0.00 N ATOM 31 CA ALA A 12 5.123 -2.929 -6.387 1.00 0.00 C ATOM 32 C ALA A 12 6.106 -2.094 -5.560 1.00 0.00 C ATOM 33 O ALA A 12 6.044 -2.118 -4.336 1.00 0.00 O ATOM 34 CB ALA A 12 5.833 -3.952 -7.287 1.00 0.00 C ATOM 0 H ALA A 12 4.490 -2.135 -8.207 1.00 0.00 H new ATOM 0 HA ALA A 12 4.494 -3.492 -5.697 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.431 -4.625 -6.672 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.090 -4.528 -7.839 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.482 -3.430 -7.990 1.00 0.00 H new ATOM 40 N ARG A 13 6.947 -1.275 -6.211 1.00 0.00 N ATOM 41 CA ARG A 13 7.922 -0.390 -5.552 1.00 0.00 C ATOM 42 C ARG A 13 7.296 0.539 -4.490 1.00 0.00 C ATOM 43 O ARG A 13 7.916 0.751 -3.447 1.00 0.00 O ATOM 44 CB ARG A 13 8.712 0.388 -6.620 1.00 0.00 C ATOM 45 CG ARG A 13 9.777 1.300 -5.994 1.00 0.00 C ATOM 46 CD ARG A 13 10.810 1.799 -7.008 1.00 0.00 C ATOM 47 NE ARG A 13 11.779 0.746 -7.346 1.00 0.00 N ATOM 48 CZ ARG A 13 12.987 0.898 -7.871 1.00 0.00 C ATOM 49 NH1 ARG A 13 13.520 2.069 -8.142 1.00 0.00 N ATOM 50 NH2 ARG A 13 13.697 -0.167 -8.136 1.00 0.00 N ATOM 0 H ARG A 13 6.969 -1.208 -7.229 1.00 0.00 H new ATOM 0 HA ARG A 13 8.611 -1.019 -4.989 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.191 -0.315 -7.301 1.00 0.00 H new ATOM 0 HB3 ARG A 13 8.024 0.989 -7.215 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.287 2.157 -5.532 1.00 0.00 H new ATOM 0 HG3 ARG A 13 10.289 0.758 -5.199 1.00 0.00 H new ATOM 0 HD2 ARG A 13 10.302 2.133 -7.913 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.336 2.662 -6.600 1.00 0.00 H new ATOM 0 HE ARG A 13 11.488 -0.213 -7.154 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.998 2.924 -7.948 1.00 0.00 H new ATOM 0 HH12 ARG A 13 14.455 2.123 -8.546 1.00 0.00 H new ATOM 0 HH21 ARG A 13 13.319 -1.094 -7.939 1.00 0.00 H new ATOM 0 HH22 ARG A 13 14.629 -0.071 -8.540 1.00 0.00 H new ATOM 64 N LEU A 14 6.072 1.035 -4.722 1.00 0.00 N ATOM 65 CA LEU A 14 5.289 1.848 -3.782 1.00 0.00 C ATOM 66 C LEU A 14 5.065 1.082 -2.469 1.00 0.00 C ATOM 67 O LEU A 14 5.617 1.446 -1.427 1.00 0.00 O ATOM 68 CB LEU A 14 3.985 2.264 -4.506 1.00 0.00 C ATOM 69 CG LEU A 14 3.015 3.237 -3.799 1.00 0.00 C ATOM 70 CD1 LEU A 14 2.229 2.601 -2.645 1.00 0.00 C ATOM 71 CD2 LEU A 14 3.718 4.524 -3.350 1.00 0.00 C ATOM 0 H LEU A 14 5.583 0.875 -5.602 1.00 0.00 H new ATOM 0 HA LEU A 14 5.816 2.756 -3.489 1.00 0.00 H new ATOM 0 HB2 LEU A 14 4.266 2.713 -5.458 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.430 1.354 -4.734 1.00 0.00 H new ATOM 0 HG LEU A 14 2.276 3.501 -4.555 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.570 3.346 -2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.633 1.771 -3.025 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.924 2.234 -1.890 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.999 5.179 -2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 14 4.519 4.277 -2.654 1.00 0.00 H new ATOM 0 HD23 LEU A 14 4.136 5.032 -4.219 1.00 0.00 H new ATOM 83 N GLY A 15 4.327 -0.032 -2.514 1.00 0.00 N ATOM 84 CA GLY A 15 4.060 -0.813 -1.305 1.00 0.00 C ATOM 85 C GLY A 15 5.288 -1.550 -0.771 1.00 0.00 C ATOM 86 O GLY A 15 5.342 -1.824 0.419 1.00 0.00 O ATOM 0 H GLY A 15 3.909 -0.409 -3.365 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.679 -0.148 -0.529 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.274 -1.538 -1.517 1.00 0.00 H new ATOM 90 N ARG A 16 6.332 -1.763 -1.576 1.00 0.00 N ATOM 91 CA ARG A 16 7.620 -2.355 -1.168 1.00 0.00 C ATOM 92 C ARG A 16 8.403 -1.483 -0.180 1.00 0.00 C ATOM 93 O ARG A 16 9.483 -1.898 0.252 1.00 0.00 O ATOM 94 CB ARG A 16 8.492 -2.642 -2.408 1.00 0.00 C ATOM 95 CG ARG A 16 8.262 -4.015 -3.059 1.00 0.00 C ATOM 96 CD ARG A 16 8.719 -5.204 -2.203 1.00 0.00 C ATOM 97 NE ARG A 16 10.150 -5.127 -1.844 1.00 0.00 N ATOM 98 CZ ARG A 16 10.974 -6.139 -1.607 1.00 0.00 C ATOM 99 NH1 ARG A 16 10.578 -7.391 -1.694 1.00 0.00 N ATOM 100 NH2 ARG A 16 12.227 -5.881 -1.293 1.00 0.00 N ATOM 0 H ARG A 16 6.308 -1.521 -2.567 1.00 0.00 H new ATOM 0 HA ARG A 16 7.380 -3.284 -0.652 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.305 -1.868 -3.152 1.00 0.00 H new ATOM 0 HB3 ARG A 16 9.541 -2.563 -2.122 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.200 -4.127 -3.278 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.789 -4.045 -4.013 1.00 0.00 H new ATOM 0 HD2 ARG A 16 8.121 -5.243 -1.292 1.00 0.00 H new ATOM 0 HD3 ARG A 16 8.533 -6.131 -2.746 1.00 0.00 H new ATOM 0 HE ARG A 16 10.549 -4.191 -1.770 1.00 0.00 H new ATOM 0 HH11 ARG A 16 9.614 -7.604 -1.950 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.235 -8.148 -1.506 1.00 0.00 H new ATOM 0 HH21 ARG A 16 12.550 -4.915 -1.235 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.874 -6.647 -1.108 1.00 0.00 H new ATOM 114 N ALA A 17 7.919 -0.281 0.146 1.00 0.00 N ATOM 115 CA ALA A 17 8.449 0.543 1.221 1.00 0.00 C ATOM 116 C ALA A 17 7.368 1.243 2.079 1.00 0.00 C ATOM 117 O ALA A 17 7.745 1.812 3.098 1.00 0.00 O ATOM 118 CB ALA A 17 9.515 1.466 0.617 1.00 0.00 C ATOM 0 H ALA A 17 7.134 0.149 -0.343 1.00 0.00 H new ATOM 0 HA ALA A 17 8.926 -0.089 1.970 1.00 0.00 H new ATOM 0 HB1 ALA A 17 9.934 2.099 1.399 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.308 0.864 0.174 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.061 2.091 -0.152 1.00 0.00 H new ATOM 124 N LEU A 18 6.064 1.190 1.745 1.00 0.00 N ATOM 125 CA LEU A 18 5.007 1.577 2.702 1.00 0.00 C ATOM 126 C LEU A 18 4.561 0.350 3.528 1.00 0.00 C ATOM 127 O LEU A 18 4.226 0.506 4.697 1.00 0.00 O ATOM 128 CB LEU A 18 3.825 2.268 1.977 1.00 0.00 C ATOM 129 CG LEU A 18 4.044 3.789 1.728 1.00 0.00 C ATOM 130 CD1 LEU A 18 3.707 4.165 0.283 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.205 4.695 2.659 1.00 0.00 C ATOM 0 H LEU A 18 5.720 0.888 0.834 1.00 0.00 H new ATOM 0 HA LEU A 18 5.411 2.310 3.400 1.00 0.00 H new ATOM 0 HB2 LEU A 18 3.658 1.773 1.020 1.00 0.00 H new ATOM 0 HB3 LEU A 18 2.919 2.133 2.568 1.00 0.00 H new ATOM 0 HG LEU A 18 5.099 3.959 1.941 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.869 5.233 0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 18 4.348 3.605 -0.398 1.00 0.00 H new ATOM 0 HD13 LEU A 18 2.664 3.925 0.079 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.408 5.741 2.429 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.145 4.490 2.508 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.469 4.494 3.697 1.00 0.00 H new ATOM 143 N ALA A 19 4.599 -0.865 2.964 1.00 0.00 N ATOM 144 CA ALA A 19 4.149 -2.098 3.619 1.00 0.00 C ATOM 145 C ALA A 19 5.310 -2.843 4.300 1.00 0.00 C ATOM 146 O ALA A 19 5.828 -3.837 3.794 1.00 0.00 O ATOM 147 CB ALA A 19 3.408 -2.945 2.584 1.00 0.00 C ATOM 0 H ALA A 19 4.951 -1.020 2.019 1.00 0.00 H new ATOM 0 HA ALA A 19 3.461 -1.862 4.431 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.063 -3.869 3.049 1.00 0.00 H new ATOM 0 HB2 ALA A 19 2.551 -2.388 2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.080 -3.183 1.760 1.00 0.00 H new ATOM 153 N ASP A 20 5.727 -2.317 5.449 1.00 0.00 N ATOM 154 CA ASP A 20 6.888 -2.744 6.236 1.00 0.00 C ATOM 155 C ASP A 20 6.831 -2.174 7.674 1.00 0.00 C ATOM 156 O ASP A 20 6.482 -0.997 7.838 1.00 0.00 O ATOM 157 CB ASP A 20 8.161 -2.293 5.501 1.00 0.00 C ATOM 158 CG ASP A 20 9.434 -2.349 6.352 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.662 -1.435 7.174 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.283 -3.209 6.047 1.00 0.00 O ATOM 0 H ASP A 20 5.237 -1.535 5.884 1.00 0.00 H new ATOM 0 HA ASP A 20 6.889 -3.830 6.334 1.00 0.00 H new ATOM 0 HB2 ASP A 20 8.299 -2.920 4.620 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.019 -1.272 5.147 1.00 0.00 H new ATOM 165 N PRO A 21 7.217 -2.969 8.699 1.00 0.00 N ATOM 166 CA PRO A 21 7.054 -2.660 10.124 1.00 0.00 C ATOM 167 C PRO A 21 7.607 -1.284 10.504 1.00 0.00 C ATOM 168 O PRO A 21 6.857 -0.419 10.958 1.00 0.00 O ATOM 169 CB PRO A 21 7.794 -3.787 10.874 1.00 0.00 C ATOM 170 CG PRO A 21 8.799 -4.287 9.832 1.00 0.00 C ATOM 171 CD PRO A 21 7.928 -4.239 8.585 1.00 0.00 C ATOM 0 HA PRO A 21 5.997 -2.613 10.387 1.00 0.00 H new ATOM 0 HB2 PRO A 21 8.292 -3.417 11.771 1.00 0.00 H new ATOM 0 HB3 PRO A 21 7.113 -4.577 11.190 1.00 0.00 H new ATOM 0 HG2 PRO A 21 9.675 -3.643 9.754 1.00 0.00 H new ATOM 0 HG3 PRO A 21 9.161 -5.292 10.050 1.00 0.00 H new ATOM 0 HD2 PRO A 21 8.529 -4.280 7.677 1.00 0.00 H new ATOM 0 HD3 PRO A 21 7.237 -5.081 8.548 1.00 0.00 H new ATOM 179 N THR A 22 8.912 -1.066 10.301 1.00 0.00 N ATOM 180 CA THR A 22 9.578 0.160 10.744 1.00 0.00 C ATOM 181 C THR A 22 9.297 1.301 9.776 1.00 0.00 C ATOM 182 O THR A 22 9.255 2.454 10.198 1.00 0.00 O ATOM 183 CB THR A 22 11.092 -0.043 10.914 1.00 0.00 C ATOM 184 OG1 THR A 22 11.394 -1.295 11.486 1.00 0.00 O ATOM 185 CG2 THR A 22 11.680 1.034 11.833 1.00 0.00 C ATOM 0 H THR A 22 9.529 -1.728 9.830 1.00 0.00 H new ATOM 0 HA THR A 22 9.170 0.420 11.721 1.00 0.00 H new ATOM 0 HB THR A 22 11.524 0.017 9.915 1.00 0.00 H new ATOM 0 HG1 THR A 22 12.127 -1.193 12.128 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.753 0.874 11.941 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.502 2.018 11.400 1.00 0.00 H new ATOM 0 HG23 THR A 22 11.204 0.977 12.812 1.00 0.00 H new ATOM 193 N ARG A 23 9.115 1.031 8.477 1.00 0.00 N ATOM 194 CA ARG A 23 8.970 2.086 7.469 1.00 0.00 C ATOM 195 C ARG A 23 7.663 2.867 7.584 1.00 0.00 C ATOM 196 O ARG A 23 7.737 4.079 7.402 1.00 0.00 O ATOM 197 CB ARG A 23 9.228 1.564 6.054 1.00 0.00 C ATOM 198 CG ARG A 23 10.743 1.449 5.816 1.00 0.00 C ATOM 199 CD ARG A 23 11.082 0.809 4.466 1.00 0.00 C ATOM 200 NE ARG A 23 11.071 -0.659 4.501 1.00 0.00 N ATOM 201 CZ ARG A 23 11.397 -1.448 3.484 1.00 0.00 C ATOM 202 NH1 ARG A 23 11.774 -0.958 2.328 1.00 0.00 N ATOM 203 NH2 ARG A 23 11.351 -2.749 3.605 1.00 0.00 N ATOM 0 H ARG A 23 9.065 0.085 8.099 1.00 0.00 H new ATOM 0 HA ARG A 23 9.751 2.815 7.684 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.754 0.591 5.922 1.00 0.00 H new ATOM 0 HB3 ARG A 23 8.784 2.237 5.320 1.00 0.00 H new ATOM 0 HG2 ARG A 23 11.191 2.441 5.866 1.00 0.00 H new ATOM 0 HG3 ARG A 23 11.189 0.858 6.616 1.00 0.00 H new ATOM 0 HD2 ARG A 23 10.367 1.153 3.719 1.00 0.00 H new ATOM 0 HD3 ARG A 23 12.067 1.151 4.147 1.00 0.00 H new ATOM 0 HE ARG A 23 10.791 -1.107 5.374 1.00 0.00 H new ATOM 0 HH11 ARG A 23 11.822 0.052 2.193 1.00 0.00 H new ATOM 0 HH12 ARG A 23 12.019 -1.587 1.563 1.00 0.00 H new ATOM 0 HH21 ARG A 23 11.062 -3.169 4.488 1.00 0.00 H new ATOM 0 HH22 ARG A 23 11.604 -3.344 2.816 1.00 0.00 H new ATOM 217 N CYS A 24 6.535 2.274 7.993 1.00 0.00 N ATOM 218 CA CYS A 24 5.342 3.066 8.340 1.00 0.00 C ATOM 219 C CYS A 24 5.676 4.074 9.458 1.00 0.00 C ATOM 220 O CYS A 24 5.607 5.289 9.236 1.00 0.00 O ATOM 221 CB CYS A 24 4.199 2.132 8.742 1.00 0.00 C ATOM 222 SG CYS A 24 2.726 3.159 9.016 1.00 0.00 S ATOM 0 H CYS A 24 6.420 1.265 8.092 1.00 0.00 H new ATOM 0 HA CYS A 24 5.019 3.638 7.470 1.00 0.00 H new ATOM 0 HB2 CYS A 24 4.013 1.395 7.960 1.00 0.00 H new ATOM 0 HB3 CYS A 24 4.455 1.580 9.646 1.00 0.00 H new ATOM 0 HG CYS A 24 1.790 2.439 9.559 1.00 0.00 H new ATOM 228 N ARG A 25 6.204 3.566 10.582 1.00 0.00 N ATOM 229 CA ARG A 25 6.793 4.356 11.676 1.00 0.00 C ATOM 230 C ARG A 25 7.735 5.468 11.176 1.00 0.00 C ATOM 231 O ARG A 25 7.605 6.603 11.620 1.00 0.00 O ATOM 232 CB ARG A 25 7.493 3.409 12.675 1.00 0.00 C ATOM 233 CG ARG A 25 6.569 2.984 13.824 1.00 0.00 C ATOM 234 CD ARG A 25 7.169 1.853 14.675 1.00 0.00 C ATOM 235 NE ARG A 25 6.136 1.205 15.494 1.00 0.00 N ATOM 236 CZ ARG A 25 6.289 0.243 16.394 1.00 0.00 C ATOM 237 NH1 ARG A 25 7.460 -0.135 16.866 1.00 0.00 N ATOM 238 NH2 ARG A 25 5.231 -0.383 16.851 1.00 0.00 N ATOM 0 H ARG A 25 6.234 2.562 10.761 1.00 0.00 H new ATOM 0 HA ARG A 25 5.984 4.877 12.188 1.00 0.00 H new ATOM 0 HB2 ARG A 25 7.843 2.522 12.147 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.374 3.904 13.085 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.367 3.845 14.461 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.612 2.658 13.415 1.00 0.00 H new ATOM 0 HD2 ARG A 25 7.639 1.115 14.025 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.951 2.254 15.320 1.00 0.00 H new ATOM 0 HE ARG A 25 5.182 1.536 15.353 1.00 0.00 H new ATOM 0 HH11 ARG A 25 8.313 0.320 16.539 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.514 -0.882 17.558 1.00 0.00 H new ATOM 0 HH21 ARG A 25 4.303 -0.128 16.514 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.337 -1.125 17.543 1.00 0.00 H new ATOM 252 N ILE A 26 8.641 5.206 10.222 1.00 0.00 N ATOM 253 CA ILE A 26 9.507 6.248 9.629 1.00 0.00 C ATOM 254 C ILE A 26 8.683 7.303 8.913 1.00 0.00 C ATOM 255 O ILE A 26 8.795 8.482 9.217 1.00 0.00 O ATOM 256 CB ILE A 26 10.573 5.695 8.647 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.443 4.638 9.350 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.387 6.890 8.106 1.00 0.00 C ATOM 259 CD1 ILE A 26 12.918 4.555 8.967 1.00 0.00 C ATOM 0 H ILE A 26 8.797 4.274 9.839 1.00 0.00 H new ATOM 0 HA ILE A 26 10.037 6.688 10.474 1.00 0.00 H new ATOM 0 HB ILE A 26 10.109 5.187 7.801 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.386 4.819 10.423 1.00 0.00 H new ATOM 0 HG13 ILE A 26 10.995 3.661 9.167 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.146 6.529 7.411 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.720 7.580 7.589 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.871 7.406 8.935 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.400 3.766 9.544 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.006 4.332 7.904 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.403 5.508 9.179 1.00 0.00 H new ATOM 271 N LEU A 27 7.898 6.877 7.931 1.00 0.00 N ATOM 272 CA LEU A 27 7.117 7.761 7.068 1.00 0.00 C ATOM 273 C LEU A 27 6.192 8.661 7.900 1.00 0.00 C ATOM 274 O LEU A 27 6.179 9.867 7.675 1.00 0.00 O ATOM 275 CB LEU A 27 6.342 6.922 6.028 1.00 0.00 C ATOM 276 CG LEU A 27 7.212 6.212 4.964 1.00 0.00 C ATOM 277 CD1 LEU A 27 6.327 5.322 4.087 1.00 0.00 C ATOM 278 CD2 LEU A 27 7.928 7.195 4.027 1.00 0.00 C ATOM 0 H LEU A 27 7.783 5.889 7.706 1.00 0.00 H new ATOM 0 HA LEU A 27 7.790 8.425 6.526 1.00 0.00 H new ATOM 0 HB2 LEU A 27 5.758 6.168 6.557 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.633 7.573 5.517 1.00 0.00 H new ATOM 0 HG LEU A 27 7.959 5.638 5.513 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.942 4.823 3.338 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.833 4.575 4.708 1.00 0.00 H new ATOM 0 HD13 LEU A 27 5.575 5.934 3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 27 8.523 6.639 3.302 1.00 0.00 H new ATOM 0 HD22 LEU A 27 7.189 7.801 3.502 1.00 0.00 H new ATOM 0 HD23 LEU A 27 8.581 7.844 4.611 1.00 0.00 H new ATOM 290 N VAL A 28 5.501 8.102 8.894 1.00 0.00 N ATOM 291 CA VAL A 28 4.492 8.804 9.707 1.00 0.00 C ATOM 292 C VAL A 28 5.125 9.683 10.791 1.00 0.00 C ATOM 293 O VAL A 28 4.566 10.717 11.147 1.00 0.00 O ATOM 294 CB VAL A 28 3.455 7.811 10.296 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.925 7.100 11.575 1.00 0.00 C ATOM 296 CG2 VAL A 28 2.109 8.508 10.551 1.00 0.00 C ATOM 0 H VAL A 28 5.626 7.127 9.167 1.00 0.00 H new ATOM 0 HA VAL A 28 3.957 9.480 9.040 1.00 0.00 H new ATOM 0 HB VAL A 28 3.334 7.038 9.538 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.144 6.424 11.923 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.830 6.531 11.363 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.135 7.841 12.347 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.400 7.790 10.964 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.251 9.325 11.258 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.720 8.903 9.612 1.00 0.00 H new ATOM 306 N ALA A 29 6.309 9.310 11.291 1.00 0.00 N ATOM 307 CA ALA A 29 7.050 10.114 12.253 1.00 0.00 C ATOM 308 C ALA A 29 7.850 11.235 11.572 1.00 0.00 C ATOM 309 O ALA A 29 7.916 12.339 12.108 1.00 0.00 O ATOM 310 CB ALA A 29 7.933 9.182 13.084 1.00 0.00 C ATOM 0 H ALA A 29 6.776 8.440 11.036 1.00 0.00 H new ATOM 0 HA ALA A 29 6.352 10.625 12.916 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.496 9.767 13.811 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.307 8.458 13.607 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.625 8.655 12.427 1.00 0.00 H new ATOM 316 N LEU A 30 8.397 11.017 10.367 1.00 0.00 N ATOM 317 CA LEU A 30 9.028 12.065 9.598 1.00 0.00 C ATOM 318 C LEU A 30 8.034 13.110 9.120 1.00 0.00 C ATOM 319 O LEU A 30 8.452 14.258 9.006 1.00 0.00 O ATOM 320 CB LEU A 30 9.686 11.445 8.386 1.00 0.00 C ATOM 321 CG LEU A 30 10.808 12.332 7.837 1.00 0.00 C ATOM 322 CD1 LEU A 30 12.001 12.544 8.786 1.00 0.00 C ATOM 323 CD2 LEU A 30 11.234 11.551 6.618 1.00 0.00 C ATOM 0 H LEU A 30 8.407 10.105 9.911 1.00 0.00 H new ATOM 0 HA LEU A 30 9.753 12.560 10.244 1.00 0.00 H new ATOM 0 HB2 LEU A 30 10.090 10.468 8.651 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.939 11.281 7.610 1.00 0.00 H new ATOM 0 HG LEU A 30 10.463 13.350 7.659 1.00 0.00 H new ATOM 0 HD11 LEU A 30 12.739 13.185 8.305 1.00 0.00 H new ATOM 0 HD12 LEU A 30 11.655 13.016 9.706 1.00 0.00 H new ATOM 0 HD13 LEU A 30 12.455 11.581 9.021 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.046 12.076 6.115 1.00 0.00 H new ATOM 0 HD22 LEU A 30 11.575 10.561 6.921 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.389 11.451 5.936 1.00 0.00 H new ATOM 335 N LEU A 31 6.778 12.722 8.837 1.00 0.00 N ATOM 336 CA LEU A 31 5.701 13.570 8.338 1.00 0.00 C ATOM 337 C LEU A 31 5.659 14.946 9.035 1.00 0.00 C ATOM 338 O LEU A 31 5.605 15.968 8.359 1.00 0.00 O ATOM 339 CB LEU A 31 4.417 12.739 8.515 1.00 0.00 C ATOM 340 CG LEU A 31 3.348 12.884 7.434 1.00 0.00 C ATOM 341 CD1 LEU A 31 2.170 12.058 7.946 1.00 0.00 C ATOM 342 CD2 LEU A 31 2.915 14.325 7.140 1.00 0.00 C ATOM 0 H LEU A 31 6.479 11.754 8.960 1.00 0.00 H new ATOM 0 HA LEU A 31 5.843 13.834 7.290 1.00 0.00 H new ATOM 0 HB2 LEU A 31 4.698 11.688 8.575 1.00 0.00 H new ATOM 0 HB3 LEU A 31 3.970 13.005 9.473 1.00 0.00 H new ATOM 0 HG LEU A 31 3.745 12.543 6.478 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.352 12.106 7.227 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.481 11.021 8.073 1.00 0.00 H new ATOM 0 HD13 LEU A 31 1.835 12.456 8.904 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.154 14.324 6.360 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.506 14.774 8.045 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.777 14.903 6.806 1.00 0.00 H new ATOM 354 N ASP A 32 5.783 14.945 10.364 1.00 0.00 N ATOM 355 CA ASP A 32 5.991 16.124 11.228 1.00 0.00 C ATOM 356 C ASP A 32 7.472 16.306 11.646 1.00 0.00 C ATOM 357 O ASP A 32 7.940 17.415 11.888 1.00 0.00 O ATOM 358 CB ASP A 32 5.104 15.910 12.470 1.00 0.00 C ATOM 359 CG ASP A 32 5.162 17.051 13.496 1.00 0.00 C ATOM 360 OD1 ASP A 32 4.626 18.138 13.179 1.00 0.00 O ATOM 361 OD2 ASP A 32 5.694 16.793 14.602 1.00 0.00 O ATOM 0 H ASP A 32 5.740 14.079 10.901 1.00 0.00 H new ATOM 0 HA ASP A 32 5.726 17.031 10.685 1.00 0.00 H new ATOM 0 HB2 ASP A 32 4.071 15.781 12.146 1.00 0.00 H new ATOM 0 HB3 ASP A 32 5.402 14.983 12.959 1.00 0.00 H new ATOM 366 N GLY A 33 8.241 15.210 11.681 1.00 0.00 N ATOM 367 CA GLY A 33 9.581 15.107 12.264 1.00 0.00 C ATOM 368 C GLY A 33 10.747 15.558 11.402 1.00 0.00 C ATOM 369 O GLY A 33 11.852 15.531 11.920 1.00 0.00 O ATOM 0 H GLY A 33 7.927 14.326 11.282 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.595 15.691 13.184 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.749 14.067 12.543 1.00 0.00 H new ATOM 373 N VAL A 34 10.528 15.953 10.144 1.00 0.00 N ATOM 374 CA VAL A 34 11.414 16.593 9.128 1.00 0.00 C ATOM 375 C VAL A 34 12.588 17.529 9.572 1.00 0.00 C ATOM 376 O VAL A 34 12.807 18.583 8.974 1.00 0.00 O ATOM 377 CB VAL A 34 10.537 17.336 8.079 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.723 16.411 7.174 1.00 0.00 C ATOM 379 CG2 VAL A 34 9.575 18.352 8.711 1.00 0.00 C ATOM 0 H VAL A 34 9.599 15.818 9.746 1.00 0.00 H new ATOM 0 HA VAL A 34 11.957 15.731 8.741 1.00 0.00 H new ATOM 0 HB VAL A 34 11.274 17.857 7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 34 9.140 17.008 6.473 1.00 0.00 H new ATOM 0 HG12 VAL A 34 10.397 15.757 6.621 1.00 0.00 H new ATOM 0 HG13 VAL A 34 9.050 15.807 7.782 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.992 18.837 7.928 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.903 17.838 9.399 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.146 19.104 9.256 1.00 0.00 H new ATOM 389 N CYS A 35 13.402 17.158 10.569 1.00 0.00 N ATOM 390 CA CYS A 35 14.470 17.992 11.142 1.00 0.00 C ATOM 391 C CYS A 35 15.884 17.518 10.755 1.00 0.00 C ATOM 392 O CYS A 35 16.664 18.301 10.227 1.00 0.00 O ATOM 393 CB CYS A 35 14.264 18.063 12.662 1.00 0.00 C ATOM 394 SG CYS A 35 14.948 19.624 13.308 1.00 0.00 S ATOM 0 H CYS A 35 13.335 16.242 11.013 1.00 0.00 H new ATOM 0 HA CYS A 35 14.400 18.994 10.719 1.00 0.00 H new ATOM 0 HB2 CYS A 35 13.202 17.996 12.897 1.00 0.00 H new ATOM 0 HB3 CYS A 35 14.751 17.215 13.144 1.00 0.00 H new ATOM 0 HG CYS A 35 16.061 19.383 13.936 1.00 0.00 H new ATOM 400 N TYR A 36 16.225 16.235 10.950 1.00 0.00 N ATOM 401 CA TYR A 36 17.580 15.745 10.627 1.00 0.00 C ATOM 402 C TYR A 36 17.694 14.230 10.396 1.00 0.00 C ATOM 403 O TYR A 36 16.840 13.479 10.882 1.00 0.00 O ATOM 404 CB TYR A 36 18.612 16.232 11.672 1.00 0.00 C ATOM 405 CG TYR A 36 18.212 16.229 13.130 1.00 0.00 C ATOM 406 CD1 TYR A 36 17.624 17.384 13.677 1.00 0.00 C ATOM 407 CD2 TYR A 36 18.497 15.127 13.960 1.00 0.00 C ATOM 408 CE1 TYR A 36 17.295 17.442 15.039 1.00 0.00 C ATOM 409 CE2 TYR A 36 18.177 15.179 15.331 1.00 0.00 C ATOM 410 CZ TYR A 36 17.577 16.338 15.873 1.00 0.00 C ATOM 411 OH TYR A 36 17.293 16.408 17.199 1.00 0.00 O ATOM 0 H TYR A 36 15.595 15.525 11.324 1.00 0.00 H new ATOM 0 HA TYR A 36 17.810 16.187 9.658 1.00 0.00 H new ATOM 0 HB2 TYR A 36 19.504 15.614 11.571 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.898 17.250 11.408 1.00 0.00 H new ATOM 0 HD1 TYR A 36 17.424 18.234 13.042 1.00 0.00 H new ATOM 0 HD2 TYR A 36 18.960 14.244 13.546 1.00 0.00 H new ATOM 0 HE1 TYR A 36 16.829 18.326 15.448 1.00 0.00 H new ATOM 0 HE2 TYR A 36 18.390 14.333 15.968 1.00 0.00 H new ATOM 0 HH TYR A 36 17.546 15.566 17.633 1.00 0.00 H new ATOM 421 N PRO A 37 18.736 13.759 9.674 1.00 0.00 N ATOM 422 CA PRO A 37 19.052 12.340 9.602 1.00 0.00 C ATOM 423 C PRO A 37 19.239 11.820 11.025 1.00 0.00 C ATOM 424 O PRO A 37 19.937 12.427 11.833 1.00 0.00 O ATOM 425 CB PRO A 37 20.329 12.223 8.758 1.00 0.00 C ATOM 426 CG PRO A 37 20.981 13.595 8.893 1.00 0.00 C ATOM 427 CD PRO A 37 19.771 14.521 8.982 1.00 0.00 C ATOM 0 HA PRO A 37 18.265 11.744 9.141 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.982 11.432 9.127 1.00 0.00 H new ATOM 0 HB3 PRO A 37 20.101 11.989 7.718 1.00 0.00 H new ATOM 0 HG2 PRO A 37 21.610 13.661 9.781 1.00 0.00 H new ATOM 0 HG3 PRO A 37 21.612 13.832 8.037 1.00 0.00 H new ATOM 0 HD2 PRO A 37 20.016 15.433 9.527 1.00 0.00 H new ATOM 0 HD3 PRO A 37 19.436 14.823 7.990 1.00 0.00 H new ATOM 435 N GLY A 38 18.545 10.730 11.354 1.00 0.00 N ATOM 436 CA GLY A 38 18.563 10.174 12.702 1.00 0.00 C ATOM 437 C GLY A 38 17.661 10.882 13.717 1.00 0.00 C ATOM 438 O GLY A 38 17.549 10.352 14.816 1.00 0.00 O ATOM 0 H GLY A 38 17.960 10.213 10.698 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.268 9.126 12.648 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.588 10.198 13.073 1.00 0.00 H new ATOM 442 N GLN A 39 16.966 11.985 13.389 1.00 0.00 N ATOM 443 CA GLN A 39 15.942 12.558 14.291 1.00 0.00 C ATOM 444 C GLN A 39 14.904 11.496 14.684 1.00 0.00 C ATOM 445 O GLN A 39 14.471 11.430 15.829 1.00 0.00 O ATOM 446 CB GLN A 39 15.250 13.783 13.664 1.00 0.00 C ATOM 447 CG GLN A 39 14.182 13.483 12.589 1.00 0.00 C ATOM 448 CD GLN A 39 12.784 13.086 13.098 1.00 0.00 C ATOM 449 OE1 GLN A 39 12.111 12.261 12.504 1.00 0.00 O ATOM 450 NE2 GLN A 39 12.294 13.620 14.195 1.00 0.00 N ATOM 0 H GLN A 39 17.090 12.496 12.515 1.00 0.00 H new ATOM 0 HA GLN A 39 16.455 12.894 15.192 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.781 14.358 14.462 1.00 0.00 H new ATOM 0 HB3 GLN A 39 16.015 14.419 13.219 1.00 0.00 H new ATOM 0 HG2 GLN A 39 14.077 14.365 11.958 1.00 0.00 H new ATOM 0 HG3 GLN A 39 14.554 12.679 11.954 1.00 0.00 H new ATOM 0 HE21 GLN A 39 12.836 14.313 14.711 1.00 0.00 H new ATOM 0 HE22 GLN A 39 11.372 13.342 14.530 1.00 0.00 H new ATOM 459 N LEU A 40 14.573 10.632 13.717 1.00 0.00 N ATOM 460 CA LEU A 40 13.670 9.496 13.825 1.00 0.00 C ATOM 461 C LEU A 40 14.039 8.564 14.977 1.00 0.00 C ATOM 462 O LEU A 40 13.155 7.928 15.535 1.00 0.00 O ATOM 463 CB LEU A 40 13.757 8.723 12.502 1.00 0.00 C ATOM 464 CG LEU A 40 13.130 9.451 11.302 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.767 8.930 10.013 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.608 9.262 11.310 1.00 0.00 C ATOM 0 H LEU A 40 14.959 10.720 12.777 1.00 0.00 H new ATOM 0 HA LEU A 40 12.663 9.861 14.024 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.805 8.520 12.282 1.00 0.00 H new ATOM 0 HB3 LEU A 40 13.264 7.759 12.625 1.00 0.00 H new ATOM 0 HG LEU A 40 13.322 10.522 11.367 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.327 9.442 9.157 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.840 9.118 10.036 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.588 7.858 9.926 1.00 0.00 H new ATOM 0 HD21 LEU A 40 11.172 9.781 10.456 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.373 8.200 11.247 1.00 0.00 H new ATOM 0 HD23 LEU A 40 11.195 9.671 12.232 1.00 0.00 H new ATOM 478 N ALA A 41 15.319 8.485 15.345 1.00 0.00 N ATOM 479 CA ALA A 41 15.777 7.608 16.425 1.00 0.00 C ATOM 480 C ALA A 41 15.087 7.971 17.760 1.00 0.00 C ATOM 481 O ALA A 41 14.792 7.078 18.551 1.00 0.00 O ATOM 482 CB ALA A 41 17.307 7.695 16.526 1.00 0.00 C ATOM 0 H ALA A 41 16.065 9.024 14.905 1.00 0.00 H new ATOM 0 HA ALA A 41 15.502 6.577 16.203 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.656 7.045 17.328 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.752 7.379 15.583 1.00 0.00 H new ATOM 0 HB3 ALA A 41 17.600 8.723 16.739 1.00 0.00 H new ATOM 488 N ALA A 42 14.772 9.258 17.981 1.00 0.00 N ATOM 489 CA ALA A 42 14.009 9.719 19.141 1.00 0.00 C ATOM 490 C ALA A 42 12.504 9.428 18.997 1.00 0.00 C ATOM 491 O ALA A 42 11.893 8.897 19.918 1.00 0.00 O ATOM 492 CB ALA A 42 14.291 11.217 19.339 1.00 0.00 C ATOM 0 H ALA A 42 15.045 10.011 17.350 1.00 0.00 H new ATOM 0 HA ALA A 42 14.328 9.169 20.027 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.731 11.582 20.200 1.00 0.00 H new ATOM 0 HB2 ALA A 42 15.357 11.367 19.509 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.985 11.766 18.448 1.00 0.00 H new ATOM 498 N HIS A 43 11.906 9.711 17.835 1.00 0.00 N ATOM 499 CA HIS A 43 10.494 9.387 17.575 1.00 0.00 C ATOM 500 C HIS A 43 10.158 7.884 17.703 1.00 0.00 C ATOM 501 O HIS A 43 9.031 7.522 18.046 1.00 0.00 O ATOM 502 CB HIS A 43 10.149 9.829 16.150 1.00 0.00 C ATOM 503 CG HIS A 43 9.833 11.285 15.945 1.00 0.00 C ATOM 504 ND1 HIS A 43 9.704 11.841 14.709 1.00 0.00 N flip ATOM 505 CD2 HIS A 43 9.308 12.160 16.895 1.00 0.00 C flip ATOM 506 CE1 HIS A 43 9.058 13.047 14.884 1.00 0.00 C flip ATOM 507 NE2 HIS A 43 8.851 13.216 16.199 1.00 0.00 N flip ATOM 0 H HIS A 43 12.379 10.166 17.054 1.00 0.00 H new ATOM 0 HA HIS A 43 9.911 9.911 18.333 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.987 9.570 15.503 1.00 0.00 H new ATOM 0 HB3 HIS A 43 9.293 9.246 15.812 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.275 12.019 17.965 1.00 0.00 H new ATOM 0 HE1 HIS A 43 8.770 13.733 14.102 1.00 0.00 H new ATOM 0 HE2 HIS A 43 8.407 14.035 16.615 1.00 0.00 H new ATOM 515 N LEU A 44 11.117 7.013 17.361 1.00 0.00 N ATOM 516 CA LEU A 44 10.917 5.560 17.299 1.00 0.00 C ATOM 517 C LEU A 44 11.493 4.811 18.507 1.00 0.00 C ATOM 518 O LEU A 44 11.021 3.718 18.797 1.00 0.00 O ATOM 519 CB LEU A 44 11.497 5.002 15.977 1.00 0.00 C ATOM 520 CG LEU A 44 10.964 5.654 14.679 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.296 4.821 13.440 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.450 5.926 14.695 1.00 0.00 C ATOM 0 H LEU A 44 12.064 7.302 17.117 1.00 0.00 H new ATOM 0 HA LEU A 44 9.841 5.389 17.328 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.581 5.117 16.001 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.291 3.932 15.935 1.00 0.00 H new ATOM 0 HG LEU A 44 11.478 6.614 14.631 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.903 5.317 12.552 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.377 4.719 13.349 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.845 3.833 13.534 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.153 6.383 13.751 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.913 4.987 14.828 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.210 6.601 15.517 1.00 0.00 H new ATOM 534 N GLY A 45 12.523 5.337 19.178 1.00 0.00 N ATOM 535 CA GLY A 45 13.283 4.619 20.213 1.00 0.00 C ATOM 536 C GLY A 45 14.253 3.569 19.658 1.00 0.00 C ATOM 537 O GLY A 45 14.941 2.893 20.426 1.00 0.00 O ATOM 0 H GLY A 45 12.859 6.287 19.017 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.845 5.342 20.804 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.583 4.130 20.890 1.00 0.00 H new ATOM 541 N LEU A 46 14.343 3.434 18.332 1.00 0.00 N ATOM 542 CA LEU A 46 15.262 2.509 17.668 1.00 0.00 C ATOM 543 C LEU A 46 16.500 3.270 17.186 1.00 0.00 C ATOM 544 O LEU A 46 16.433 4.450 16.838 1.00 0.00 O ATOM 545 CB LEU A 46 14.560 1.735 16.544 1.00 0.00 C ATOM 546 CG LEU A 46 13.628 0.605 17.046 1.00 0.00 C ATOM 547 CD1 LEU A 46 12.375 1.084 17.785 1.00 0.00 C ATOM 548 CD2 LEU A 46 13.144 -0.207 15.846 1.00 0.00 C ATOM 0 H LEU A 46 13.771 3.972 17.681 1.00 0.00 H new ATOM 0 HA LEU A 46 15.595 1.757 18.383 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.977 2.434 15.945 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.315 1.304 15.887 1.00 0.00 H new ATOM 0 HG LEU A 46 14.228 0.030 17.752 1.00 0.00 H new ATOM 0 HD11 LEU A 46 11.785 0.222 18.098 1.00 0.00 H new ATOM 0 HD12 LEU A 46 12.668 1.661 18.662 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.778 1.710 17.122 1.00 0.00 H new ATOM 0 HD21 LEU A 46 12.487 -1.006 16.189 1.00 0.00 H new ATOM 0 HD22 LEU A 46 12.599 0.444 15.162 1.00 0.00 H new ATOM 0 HD23 LEU A 46 14.001 -0.639 15.329 1.00 0.00 H new ATOM 560 N THR A 47 17.646 2.592 17.191 1.00 0.00 N ATOM 561 CA THR A 47 18.976 3.173 16.975 1.00 0.00 C ATOM 562 C THR A 47 19.065 3.852 15.618 1.00 0.00 C ATOM 563 O THR A 47 18.443 3.432 14.636 1.00 0.00 O ATOM 564 CB THR A 47 20.082 2.117 17.116 1.00 0.00 C ATOM 565 OG1 THR A 47 19.876 1.061 16.214 1.00 0.00 O ATOM 566 CG2 THR A 47 20.166 1.524 18.516 1.00 0.00 C ATOM 0 H THR A 47 17.678 1.585 17.351 1.00 0.00 H new ATOM 0 HA THR A 47 19.127 3.926 17.748 1.00 0.00 H new ATOM 0 HB THR A 47 21.015 2.639 16.903 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.591 0.399 16.317 1.00 0.00 H new ATOM 0 HG21 THR A 47 20.966 0.785 18.551 1.00 0.00 H new ATOM 0 HG22 THR A 47 20.373 2.317 19.235 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.219 1.046 18.766 1.00 0.00 H new ATOM 574 N ARG A 48 19.934 4.865 15.533 1.00 0.00 N ATOM 575 CA ARG A 48 20.266 5.492 14.250 1.00 0.00 C ATOM 576 C ARG A 48 20.881 4.490 13.250 1.00 0.00 C ATOM 577 O ARG A 48 20.806 4.710 12.048 1.00 0.00 O ATOM 578 CB ARG A 48 21.094 6.769 14.478 1.00 0.00 C ATOM 579 CG ARG A 48 22.588 6.561 14.791 1.00 0.00 C ATOM 580 CD ARG A 48 23.075 7.371 16.005 1.00 0.00 C ATOM 581 NE ARG A 48 23.079 6.541 17.217 1.00 0.00 N ATOM 582 CZ ARG A 48 22.973 6.941 18.479 1.00 0.00 C ATOM 583 NH1 ARG A 48 22.712 8.180 18.834 1.00 0.00 N ATOM 584 NH2 ARG A 48 23.151 6.054 19.427 1.00 0.00 N ATOM 0 H ARG A 48 20.419 5.267 16.335 1.00 0.00 H new ATOM 0 HA ARG A 48 19.345 5.812 13.763 1.00 0.00 H new ATOM 0 HB2 ARG A 48 21.014 7.393 13.588 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.646 7.326 15.300 1.00 0.00 H new ATOM 0 HG2 ARG A 48 22.770 5.502 14.973 1.00 0.00 H new ATOM 0 HG3 ARG A 48 23.177 6.840 13.917 1.00 0.00 H new ATOM 0 HD2 ARG A 48 24.079 7.751 15.816 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.429 8.237 16.153 1.00 0.00 H new ATOM 0 HE ARG A 48 23.175 5.536 17.072 1.00 0.00 H new ATOM 0 HH11 ARG A 48 22.578 8.897 18.121 1.00 0.00 H new ATOM 0 HH12 ARG A 48 22.643 8.424 19.822 1.00 0.00 H new ATOM 0 HH21 ARG A 48 23.365 5.086 19.186 1.00 0.00 H new ATOM 0 HH22 ARG A 48 23.076 6.331 20.406 1.00 0.00 H new ATOM 598 N SER A 49 21.421 3.360 13.715 1.00 0.00 N ATOM 599 CA SER A 49 21.826 2.233 12.863 1.00 0.00 C ATOM 600 C SER A 49 20.598 1.471 12.347 1.00 0.00 C ATOM 601 O SER A 49 20.409 1.368 11.134 1.00 0.00 O ATOM 602 CB SER A 49 22.742 1.273 13.640 1.00 0.00 C ATOM 603 OG SER A 49 23.815 1.970 14.248 1.00 0.00 O ATOM 0 H SER A 49 21.592 3.198 14.707 1.00 0.00 H new ATOM 0 HA SER A 49 22.373 2.636 12.010 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.164 0.752 14.403 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.135 0.513 12.964 1.00 0.00 H new ATOM 0 HG SER A 49 24.381 1.337 14.737 1.00 0.00 H new ATOM 609 N ASN A 50 19.725 1.007 13.253 1.00 0.00 N ATOM 610 CA ASN A 50 18.488 0.298 12.922 1.00 0.00 C ATOM 611 C ASN A 50 17.639 1.110 11.923 1.00 0.00 C ATOM 612 O ASN A 50 17.361 0.658 10.812 1.00 0.00 O ATOM 613 CB ASN A 50 17.733 -0.022 14.222 1.00 0.00 C ATOM 614 CG ASN A 50 16.405 -0.738 13.994 1.00 0.00 C ATOM 615 OD1 ASN A 50 15.526 -0.202 13.332 1.00 0.00 O ATOM 616 ND2 ASN A 50 16.221 -1.934 14.524 1.00 0.00 N ATOM 0 H ASN A 50 19.866 1.118 14.257 1.00 0.00 H new ATOM 0 HA ASN A 50 18.719 -0.644 12.424 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.366 -0.641 14.858 1.00 0.00 H new ATOM 0 HB3 ASN A 50 17.548 0.906 14.763 1.00 0.00 H new ATOM 0 HD21 ASN A 50 15.337 -2.423 14.384 1.00 0.00 H new ATOM 0 HD22 ASN A 50 16.963 -2.368 15.073 1.00 0.00 H new ATOM 623 N VAL A 51 17.292 2.354 12.264 1.00 0.00 N ATOM 624 CA VAL A 51 16.444 3.204 11.416 1.00 0.00 C ATOM 625 C VAL A 51 17.132 3.579 10.079 1.00 0.00 C ATOM 626 O VAL A 51 16.434 3.814 9.097 1.00 0.00 O ATOM 627 CB VAL A 51 16.030 4.452 12.249 1.00 0.00 C ATOM 628 CG1 VAL A 51 15.268 5.529 11.477 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.140 4.060 13.451 1.00 0.00 C ATOM 0 H VAL A 51 17.588 2.801 13.132 1.00 0.00 H new ATOM 0 HA VAL A 51 15.551 2.653 11.121 1.00 0.00 H new ATOM 0 HB VAL A 51 16.988 4.868 12.561 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.026 6.354 12.147 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.886 5.896 10.658 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.347 5.106 11.075 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.869 4.955 14.011 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.235 3.571 13.090 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.687 3.377 14.101 1.00 0.00 H new ATOM 639 N SER A 52 18.471 3.582 9.978 1.00 0.00 N ATOM 640 CA SER A 52 19.162 3.870 8.701 1.00 0.00 C ATOM 641 C SER A 52 19.026 2.751 7.662 1.00 0.00 C ATOM 642 O SER A 52 18.844 3.050 6.482 1.00 0.00 O ATOM 643 CB SER A 52 20.644 4.181 8.898 1.00 0.00 C ATOM 644 OG SER A 52 20.796 5.426 9.548 1.00 0.00 O ATOM 0 H SER A 52 19.098 3.390 10.759 1.00 0.00 H new ATOM 0 HA SER A 52 18.653 4.754 8.316 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.113 3.394 9.488 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.151 4.201 7.933 1.00 0.00 H new ATOM 0 HG SER A 52 20.545 5.335 10.491 1.00 0.00 H new ATOM 650 N ASN A 53 19.037 1.483 8.092 1.00 0.00 N ATOM 651 CA ASN A 53 18.693 0.331 7.244 1.00 0.00 C ATOM 652 C ASN A 53 17.329 0.542 6.586 1.00 0.00 C ATOM 653 O ASN A 53 17.188 0.486 5.365 1.00 0.00 O ATOM 654 CB ASN A 53 18.705 -0.953 8.090 1.00 0.00 C ATOM 655 CG ASN A 53 20.116 -1.436 8.384 1.00 0.00 C ATOM 656 OD1 ASN A 53 20.661 -2.256 7.665 1.00 0.00 O ATOM 657 ND2 ASN A 53 20.768 -0.938 9.420 1.00 0.00 N ATOM 0 H ASN A 53 19.287 1.224 9.046 1.00 0.00 H new ATOM 0 HA ASN A 53 19.434 0.233 6.451 1.00 0.00 H new ATOM 0 HB2 ASN A 53 18.182 -0.772 9.029 1.00 0.00 H new ATOM 0 HB3 ASN A 53 18.157 -1.736 7.566 1.00 0.00 H new ATOM 0 HD21 ASN A 53 21.723 -1.240 9.615 1.00 0.00 H new ATOM 0 HD22 ASN A 53 20.317 -0.252 10.025 1.00 0.00 H new ATOM 664 N HIS A 54 16.346 0.890 7.413 1.00 0.00 N ATOM 665 CA HIS A 54 14.980 1.178 6.993 1.00 0.00 C ATOM 666 C HIS A 54 14.861 2.416 6.065 1.00 0.00 C ATOM 667 O HIS A 54 14.066 2.392 5.124 1.00 0.00 O ATOM 668 CB HIS A 54 14.157 1.298 8.285 1.00 0.00 C ATOM 669 CG HIS A 54 14.175 0.044 9.134 1.00 0.00 C ATOM 670 ND1 HIS A 54 14.599 -0.099 10.436 1.00 0.00 N ATOM 671 CD2 HIS A 54 13.787 -1.197 8.718 1.00 0.00 C ATOM 672 CE1 HIS A 54 14.455 -1.390 10.786 1.00 0.00 C ATOM 673 NE2 HIS A 54 13.929 -2.092 9.777 1.00 0.00 N ATOM 0 H HIS A 54 16.483 0.981 8.420 1.00 0.00 H new ATOM 0 HA HIS A 54 14.596 0.375 6.364 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.540 2.131 8.874 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.125 1.538 8.028 1.00 0.00 H new ATOM 0 HD2 HIS A 54 13.429 -1.445 7.730 1.00 0.00 H new ATOM 0 HE1 HIS A 54 14.726 -1.802 11.747 1.00 0.00 H new ATOM 0 HE2 HIS A 54 13.682 -3.082 9.781 1.00 0.00 H new ATOM 681 N LEU A 55 15.668 3.471 6.279 1.00 0.00 N ATOM 682 CA LEU A 55 15.734 4.651 5.401 1.00 0.00 C ATOM 683 C LEU A 55 16.427 4.382 4.072 1.00 0.00 C ATOM 684 O LEU A 55 16.078 5.042 3.101 1.00 0.00 O ATOM 685 CB LEU A 55 16.495 5.816 6.057 1.00 0.00 C ATOM 686 CG LEU A 55 15.742 6.489 7.212 1.00 0.00 C ATOM 687 CD1 LEU A 55 16.744 7.183 8.141 1.00 0.00 C ATOM 688 CD2 LEU A 55 14.746 7.504 6.637 1.00 0.00 C ATOM 0 H LEU A 55 16.300 3.528 7.077 1.00 0.00 H new ATOM 0 HA LEU A 55 14.689 4.906 5.228 1.00 0.00 H new ATOM 0 HB2 LEU A 55 17.451 5.447 6.428 1.00 0.00 H new ATOM 0 HB3 LEU A 55 16.715 6.565 5.297 1.00 0.00 H new ATOM 0 HG LEU A 55 15.195 5.743 7.788 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.209 7.661 8.961 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.439 6.446 8.542 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.298 7.937 7.581 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.207 7.987 7.452 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.285 8.257 6.062 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.037 6.990 5.987 1.00 0.00 H new ATOM 700 N SER A 56 17.406 3.482 4.006 1.00 0.00 N ATOM 701 CA SER A 56 18.111 3.167 2.753 1.00 0.00 C ATOM 702 C SER A 56 17.151 2.895 1.577 1.00 0.00 C ATOM 703 O SER A 56 17.281 3.514 0.520 1.00 0.00 O ATOM 704 CB SER A 56 19.075 1.993 2.980 1.00 0.00 C ATOM 705 OG SER A 56 20.338 2.285 2.409 1.00 0.00 O ATOM 0 H SER A 56 17.736 2.950 4.811 1.00 0.00 H new ATOM 0 HA SER A 56 18.685 4.048 2.466 1.00 0.00 H new ATOM 0 HB2 SER A 56 19.185 1.803 4.048 1.00 0.00 H new ATOM 0 HB3 SER A 56 18.667 1.085 2.535 1.00 0.00 H new ATOM 0 HG SER A 56 20.947 1.532 2.560 1.00 0.00 H new ATOM 711 N CYS A 57 16.116 2.076 1.796 1.00 0.00 N ATOM 712 CA CYS A 57 15.127 1.746 0.776 1.00 0.00 C ATOM 713 C CYS A 57 14.081 2.874 0.592 1.00 0.00 C ATOM 714 O CYS A 57 13.628 3.157 -0.513 1.00 0.00 O ATOM 715 CB CYS A 57 14.511 0.418 1.229 1.00 0.00 C ATOM 716 SG CYS A 57 13.789 -0.598 -0.110 1.00 0.00 S ATOM 0 H CYS A 57 15.944 1.623 2.694 1.00 0.00 H new ATOM 0 HA CYS A 57 15.577 1.647 -0.212 1.00 0.00 H new ATOM 0 HB2 CYS A 57 15.279 -0.167 1.735 1.00 0.00 H new ATOM 0 HB3 CYS A 57 13.734 0.628 1.964 1.00 0.00 H new ATOM 721 N LEU A 58 13.707 3.551 1.684 1.00 0.00 N ATOM 722 CA LEU A 58 12.762 4.674 1.689 1.00 0.00 C ATOM 723 C LEU A 58 13.239 5.843 0.811 1.00 0.00 C ATOM 724 O LEU A 58 12.430 6.488 0.134 1.00 0.00 O ATOM 725 CB LEU A 58 12.579 5.122 3.156 1.00 0.00 C ATOM 726 CG LEU A 58 11.128 5.427 3.569 1.00 0.00 C ATOM 727 CD1 LEU A 58 10.213 4.217 3.400 1.00 0.00 C ATOM 728 CD2 LEU A 58 11.157 5.870 5.032 1.00 0.00 C ATOM 0 H LEU A 58 14.063 3.327 2.613 1.00 0.00 H new ATOM 0 HA LEU A 58 11.813 4.350 1.263 1.00 0.00 H new ATOM 0 HB2 LEU A 58 12.970 4.342 3.809 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.184 6.013 3.326 1.00 0.00 H new ATOM 0 HG LEU A 58 10.724 6.208 2.925 1.00 0.00 H new ATOM 0 HD11 LEU A 58 9.200 4.481 3.704 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.209 3.907 2.355 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.576 3.397 4.020 1.00 0.00 H new ATOM 0 HD21 LEU A 58 10.144 6.096 5.364 1.00 0.00 H new ATOM 0 HD22 LEU A 58 11.570 5.070 5.646 1.00 0.00 H new ATOM 0 HD23 LEU A 58 11.778 6.760 5.130 1.00 0.00 H new ATOM 740 N ARG A 59 14.551 6.105 0.835 1.00 0.00 N ATOM 741 CA ARG A 59 15.201 7.143 0.034 1.00 0.00 C ATOM 742 C ARG A 59 15.391 6.721 -1.432 1.00 0.00 C ATOM 743 O ARG A 59 15.362 7.582 -2.304 1.00 0.00 O ATOM 744 CB ARG A 59 16.529 7.546 0.685 1.00 0.00 C ATOM 745 CG ARG A 59 16.326 8.175 2.083 1.00 0.00 C ATOM 746 CD ARG A 59 17.614 8.712 2.696 1.00 0.00 C ATOM 747 NE ARG A 59 18.598 7.643 2.964 1.00 0.00 N ATOM 748 CZ ARG A 59 19.656 7.325 2.226 1.00 0.00 C ATOM 749 NH1 ARG A 59 19.986 8.011 1.150 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.410 6.298 2.562 1.00 0.00 N ATOM 0 H ARG A 59 15.203 5.589 1.426 1.00 0.00 H new ATOM 0 HA ARG A 59 14.543 8.012 0.012 1.00 0.00 H new ATOM 0 HB2 ARG A 59 17.170 6.669 0.773 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.047 8.256 0.040 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.602 8.987 2.007 1.00 0.00 H new ATOM 0 HG3 ARG A 59 15.898 7.428 2.751 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.055 9.447 2.023 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.382 9.230 3.626 1.00 0.00 H new ATOM 0 HE ARG A 59 18.449 7.089 3.807 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.423 8.812 0.863 1.00 0.00 H new ATOM 0 HH12 ARG A 59 20.805 7.741 0.604 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.182 5.747 3.389 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.222 6.054 1.995 1.00 0.00 H new ATOM 764 N GLY A 60 15.559 5.422 -1.711 1.00 0.00 N ATOM 765 CA GLY A 60 15.878 4.888 -3.046 1.00 0.00 C ATOM 766 C GLY A 60 14.659 4.532 -3.903 1.00 0.00 C ATOM 767 O GLY A 60 14.628 4.839 -5.093 1.00 0.00 O ATOM 0 H GLY A 60 15.476 4.695 -1.001 1.00 0.00 H new ATOM 0 HA2 GLY A 60 16.479 5.623 -3.582 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.494 3.997 -2.928 1.00 0.00 H new ATOM 771 N CYS A 61 13.626 3.940 -3.298 1.00 0.00 N ATOM 772 CA CYS A 61 12.332 3.710 -3.928 1.00 0.00 C ATOM 773 C CYS A 61 11.533 5.036 -4.112 1.00 0.00 C ATOM 774 O CYS A 61 10.494 5.064 -4.776 1.00 0.00 O ATOM 775 CB CYS A 61 11.628 2.629 -3.082 1.00 0.00 C ATOM 776 SG CYS A 61 12.320 0.937 -3.228 1.00 0.00 S ATOM 0 H CYS A 61 13.671 3.602 -2.337 1.00 0.00 H new ATOM 0 HA CYS A 61 12.428 3.345 -4.951 1.00 0.00 H new ATOM 0 HB2 CYS A 61 11.667 2.929 -2.035 1.00 0.00 H new ATOM 0 HB3 CYS A 61 10.576 2.598 -3.366 1.00 0.00 H new ATOM 781 N GLY A 62 12.022 6.132 -3.508 1.00 0.00 N ATOM 782 CA GLY A 62 11.563 7.505 -3.736 1.00 0.00 C ATOM 783 C GLY A 62 10.449 7.996 -2.815 1.00 0.00 C ATOM 784 O GLY A 62 9.754 8.941 -3.185 1.00 0.00 O ATOM 0 H GLY A 62 12.776 6.080 -2.823 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.416 8.175 -3.632 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.218 7.586 -4.767 1.00 0.00 H new ATOM 788 N LEU A 63 10.242 7.384 -1.642 1.00 0.00 N ATOM 789 CA LEU A 63 9.217 7.819 -0.683 1.00 0.00 C ATOM 790 C LEU A 63 9.670 8.916 0.290 1.00 0.00 C ATOM 791 O LEU A 63 8.828 9.654 0.797 1.00 0.00 O ATOM 792 CB LEU A 63 8.718 6.594 0.060 1.00 0.00 C ATOM 793 CG LEU A 63 8.210 5.506 -0.907 1.00 0.00 C ATOM 794 CD1 LEU A 63 7.747 4.394 -0.003 1.00 0.00 C ATOM 795 CD2 LEU A 63 7.069 5.934 -1.844 1.00 0.00 C ATOM 0 H LEU A 63 10.779 6.575 -1.331 1.00 0.00 H new ATOM 0 HA LEU A 63 8.415 8.289 -1.252 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.522 6.188 0.674 1.00 0.00 H new ATOM 0 HB3 LEU A 63 7.914 6.882 0.738 1.00 0.00 H new ATOM 0 HG LEU A 63 9.011 5.233 -1.594 1.00 0.00 H new ATOM 0 HD11 LEU A 63 7.366 3.570 -0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.584 4.045 0.602 1.00 0.00 H new ATOM 0 HD13 LEU A 63 6.956 4.762 0.650 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.788 5.096 -2.481 1.00 0.00 H new ATOM 0 HD22 LEU A 63 6.208 6.244 -1.251 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.401 6.766 -2.465 1.00 0.00 H new ATOM 807 N VAL A 64 10.973 9.047 0.525 1.00 0.00 N ATOM 808 CA VAL A 64 11.588 10.178 1.250 1.00 0.00 C ATOM 809 C VAL A 64 12.726 10.796 0.445 1.00 0.00 C ATOM 810 O VAL A 64 13.412 10.102 -0.298 1.00 0.00 O ATOM 811 CB VAL A 64 12.111 9.788 2.651 1.00 0.00 C ATOM 812 CG1 VAL A 64 10.966 9.736 3.665 1.00 0.00 C ATOM 813 CG2 VAL A 64 12.827 8.460 2.660 1.00 0.00 C ATOM 0 H VAL A 64 11.656 8.357 0.212 1.00 0.00 H new ATOM 0 HA VAL A 64 10.790 10.909 1.384 1.00 0.00 H new ATOM 0 HB VAL A 64 12.827 10.562 2.929 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.359 9.459 4.643 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.491 10.715 3.728 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.231 8.996 3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.172 8.239 3.670 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.145 7.677 2.330 1.00 0.00 H new ATOM 0 HG23 VAL A 64 13.683 8.503 1.986 1.00 0.00 H new ATOM 823 N VAL A 65 12.928 12.105 0.604 1.00 0.00 N ATOM 824 CA VAL A 65 13.944 12.905 -0.106 1.00 0.00 C ATOM 825 C VAL A 65 14.623 13.873 0.875 1.00 0.00 C ATOM 826 O VAL A 65 14.016 14.311 1.852 1.00 0.00 O ATOM 827 CB VAL A 65 13.321 13.670 -1.308 1.00 0.00 C ATOM 828 CG1 VAL A 65 14.386 14.380 -2.162 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.547 12.731 -2.253 1.00 0.00 C ATOM 0 H VAL A 65 12.372 12.663 1.252 1.00 0.00 H new ATOM 0 HA VAL A 65 14.698 12.230 -0.510 1.00 0.00 H new ATOM 0 HB VAL A 65 12.648 14.399 -0.857 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.902 14.900 -2.989 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.925 15.100 -1.546 1.00 0.00 H new ATOM 0 HG13 VAL A 65 15.086 13.644 -2.557 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.129 13.308 -3.078 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.224 11.973 -2.647 1.00 0.00 H new ATOM 0 HG23 VAL A 65 11.740 12.247 -1.704 1.00 0.00 H new ATOM 839 N ALA A 66 15.900 14.190 0.638 1.00 0.00 N ATOM 840 CA ALA A 66 16.675 15.199 1.375 1.00 0.00 C ATOM 841 C ALA A 66 16.212 16.647 1.121 1.00 0.00 C ATOM 842 O ALA A 66 15.526 16.962 0.150 1.00 0.00 O ATOM 843 CB ALA A 66 18.161 14.999 1.037 1.00 0.00 C ATOM 0 H ALA A 66 16.443 13.737 -0.097 1.00 0.00 H new ATOM 0 HA ALA A 66 16.507 15.051 2.442 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.758 15.737 1.572 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.470 13.997 1.334 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.310 15.121 -0.036 1.00 0.00 H new ATOM 849 N THR A 67 16.590 17.551 2.032 1.00 0.00 N ATOM 850 CA THR A 67 16.392 19.012 1.951 1.00 0.00 C ATOM 851 C THR A 67 17.322 19.683 2.964 1.00 0.00 C ATOM 852 O THR A 67 17.831 18.993 3.836 1.00 0.00 O ATOM 853 CB THR A 67 14.948 19.419 2.299 1.00 0.00 C ATOM 854 OG1 THR A 67 13.974 18.523 1.816 1.00 0.00 O ATOM 855 CG2 THR A 67 14.546 20.816 1.844 1.00 0.00 C ATOM 0 H THR A 67 17.067 17.275 2.891 1.00 0.00 H new ATOM 0 HA THR A 67 16.604 19.323 0.928 1.00 0.00 H new ATOM 0 HB THR A 67 14.970 19.398 3.389 1.00 0.00 H new ATOM 0 HG1 THR A 67 13.469 18.948 1.092 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.514 21.010 2.134 1.00 0.00 H new ATOM 0 HG22 THR A 67 15.199 21.553 2.311 1.00 0.00 H new ATOM 0 HG23 THR A 67 14.637 20.886 0.760 1.00 0.00 H new ATOM 863 N TYR A 68 17.503 21.002 2.908 1.00 0.00 N ATOM 864 CA TYR A 68 18.122 21.792 3.990 1.00 0.00 C ATOM 865 C TYR A 68 16.994 22.499 4.773 1.00 0.00 C ATOM 866 O TYR A 68 16.222 23.237 4.159 1.00 0.00 O ATOM 867 CB TYR A 68 19.117 22.812 3.394 1.00 0.00 C ATOM 868 CG TYR A 68 20.531 22.711 3.936 1.00 0.00 C ATOM 869 CD1 TYR A 68 20.798 23.054 5.276 1.00 0.00 C ATOM 870 CD2 TYR A 68 21.586 22.294 3.099 1.00 0.00 C ATOM 871 CE1 TYR A 68 22.105 22.956 5.789 1.00 0.00 C ATOM 872 CE2 TYR A 68 22.898 22.204 3.602 1.00 0.00 C ATOM 873 CZ TYR A 68 23.158 22.524 4.952 1.00 0.00 C ATOM 874 OH TYR A 68 24.420 22.414 5.448 1.00 0.00 O ATOM 0 H TYR A 68 17.224 21.565 2.105 1.00 0.00 H new ATOM 0 HA TYR A 68 18.682 21.147 4.667 1.00 0.00 H new ATOM 0 HB2 TYR A 68 19.147 22.680 2.312 1.00 0.00 H new ATOM 0 HB3 TYR A 68 18.741 23.818 3.582 1.00 0.00 H new ATOM 0 HD1 TYR A 68 19.995 23.394 5.913 1.00 0.00 H new ATOM 0 HD2 TYR A 68 21.387 22.043 2.068 1.00 0.00 H new ATOM 0 HE1 TYR A 68 22.302 23.210 6.820 1.00 0.00 H new ATOM 0 HE2 TYR A 68 23.704 21.891 2.956 1.00 0.00 H new ATOM 0 HH TYR A 68 25.023 22.103 4.741 1.00 0.00 H new ATOM 884 N GLU A 69 16.853 22.267 6.087 1.00 0.00 N ATOM 885 CA GLU A 69 15.778 22.882 6.891 1.00 0.00 C ATOM 886 C GLU A 69 16.044 24.335 7.330 1.00 0.00 C ATOM 887 O GLU A 69 15.100 25.036 7.690 1.00 0.00 O ATOM 888 CB GLU A 69 15.301 21.951 8.027 1.00 0.00 C ATOM 889 CG GLU A 69 16.291 21.286 8.994 1.00 0.00 C ATOM 890 CD GLU A 69 16.971 22.200 10.013 1.00 0.00 C ATOM 891 OE1 GLU A 69 17.700 23.125 9.587 1.00 0.00 O ATOM 892 OE2 GLU A 69 16.850 21.916 11.224 1.00 0.00 O ATOM 0 H GLU A 69 17.471 21.656 6.620 1.00 0.00 H new ATOM 0 HA GLU A 69 14.933 22.991 6.211 1.00 0.00 H new ATOM 0 HB2 GLU A 69 14.604 22.527 8.635 1.00 0.00 H new ATOM 0 HB3 GLU A 69 14.729 21.149 7.559 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.762 20.503 9.538 1.00 0.00 H new ATOM 0 HG3 GLU A 69 17.066 20.797 8.405 1.00 0.00 H new ATOM 899 N GLY A 70 17.288 24.817 7.198 1.00 0.00 N ATOM 900 CA GLY A 70 17.701 26.208 7.439 1.00 0.00 C ATOM 901 C GLY A 70 18.970 26.342 8.284 1.00 0.00 C ATOM 902 O GLY A 70 19.706 27.318 8.137 1.00 0.00 O ATOM 0 H GLY A 70 18.066 24.225 6.909 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.862 26.700 6.480 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.888 26.737 7.936 1.00 0.00 H new ATOM 906 N ARG A 71 19.261 25.348 9.128 1.00 0.00 N ATOM 907 CA ARG A 71 20.495 25.206 9.918 1.00 0.00 C ATOM 908 C ARG A 71 21.101 23.788 9.829 1.00 0.00 C ATOM 909 O ARG A 71 22.244 23.590 10.246 1.00 0.00 O ATOM 910 CB ARG A 71 20.183 25.609 11.371 1.00 0.00 C ATOM 911 CG ARG A 71 21.426 26.084 12.144 1.00 0.00 C ATOM 912 CD ARG A 71 21.033 26.633 13.523 1.00 0.00 C ATOM 913 NE ARG A 71 22.162 27.310 14.201 1.00 0.00 N ATOM 914 CZ ARG A 71 23.125 26.749 14.927 1.00 0.00 C ATOM 915 NH1 ARG A 71 23.205 25.445 15.096 1.00 0.00 N ATOM 916 NH2 ARG A 71 24.036 27.506 15.502 1.00 0.00 N ATOM 0 H ARG A 71 18.611 24.579 9.290 1.00 0.00 H new ATOM 0 HA ARG A 71 21.259 25.866 9.506 1.00 0.00 H new ATOM 0 HB2 ARG A 71 19.437 26.404 11.369 1.00 0.00 H new ATOM 0 HB3 ARG A 71 19.742 24.759 11.891 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.125 25.256 12.263 1.00 0.00 H new ATOM 0 HG3 ARG A 71 21.942 26.856 11.573 1.00 0.00 H new ATOM 0 HD2 ARG A 71 20.206 27.335 13.410 1.00 0.00 H new ATOM 0 HD3 ARG A 71 20.674 25.815 14.148 1.00 0.00 H new ATOM 0 HE ARG A 71 22.206 28.324 14.100 1.00 0.00 H new ATOM 0 HH11 ARG A 71 22.515 24.831 14.663 1.00 0.00 H new ATOM 0 HH12 ARG A 71 23.957 25.049 15.660 1.00 0.00 H new ATOM 0 HH21 ARG A 71 24.002 28.519 15.390 1.00 0.00 H new ATOM 0 HH22 ARG A 71 24.776 27.079 16.059 1.00 0.00 H new ATOM 930 N GLN A 72 20.384 22.813 9.270 1.00 0.00 N ATOM 931 CA GLN A 72 20.762 21.413 9.143 1.00 0.00 C ATOM 932 C GLN A 72 20.158 20.783 7.873 1.00 0.00 C ATOM 933 O GLN A 72 19.194 21.297 7.307 1.00 0.00 O ATOM 934 CB GLN A 72 20.292 20.697 10.433 1.00 0.00 C ATOM 935 CG GLN A 72 20.858 19.287 10.644 1.00 0.00 C ATOM 936 CD GLN A 72 22.351 19.274 10.365 1.00 0.00 C ATOM 937 OE1 GLN A 72 22.788 18.987 9.262 1.00 0.00 O ATOM 938 NE2 GLN A 72 23.170 19.751 11.271 1.00 0.00 N ATOM 0 H GLN A 72 19.464 22.996 8.869 1.00 0.00 H new ATOM 0 HA GLN A 72 21.842 21.311 9.034 1.00 0.00 H new ATOM 0 HB2 GLN A 72 20.565 21.312 11.290 1.00 0.00 H new ATOM 0 HB3 GLN A 72 19.204 20.635 10.419 1.00 0.00 H new ATOM 0 HG2 GLN A 72 20.669 18.961 11.667 1.00 0.00 H new ATOM 0 HG3 GLN A 72 20.351 18.582 9.985 1.00 0.00 H new ATOM 0 HE21 GLN A 72 22.820 19.995 12.197 1.00 0.00 H new ATOM 0 HE22 GLN A 72 24.158 19.878 11.050 1.00 0.00 H new ATOM 947 N VAL A 73 20.725 19.666 7.408 1.00 0.00 N ATOM 948 CA VAL A 73 20.100 18.844 6.359 1.00 0.00 C ATOM 949 C VAL A 73 19.067 17.909 6.983 1.00 0.00 C ATOM 950 O VAL A 73 19.268 17.408 8.088 1.00 0.00 O ATOM 951 CB VAL A 73 21.112 18.042 5.513 1.00 0.00 C ATOM 952 CG1 VAL A 73 21.984 18.987 4.677 1.00 0.00 C ATOM 953 CG2 VAL A 73 22.006 17.088 6.326 1.00 0.00 C ATOM 0 H VAL A 73 21.619 19.306 7.741 1.00 0.00 H new ATOM 0 HA VAL A 73 19.614 19.534 5.669 1.00 0.00 H new ATOM 0 HB VAL A 73 20.507 17.410 4.863 1.00 0.00 H new ATOM 0 HG11 VAL A 73 22.691 18.403 4.087 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.351 19.572 4.010 1.00 0.00 H new ATOM 0 HG13 VAL A 73 22.531 19.659 5.339 1.00 0.00 H new ATOM 0 HG21 VAL A 73 22.686 16.565 5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 73 22.583 17.660 7.053 1.00 0.00 H new ATOM 0 HG23 VAL A 73 21.383 16.362 6.848 1.00 0.00 H new ATOM 963 N ARG A 74 17.970 17.645 6.270 1.00 0.00 N ATOM 964 CA ARG A 74 16.820 16.898 6.761 1.00 0.00 C ATOM 965 C ARG A 74 16.422 15.824 5.765 1.00 0.00 C ATOM 966 O ARG A 74 16.799 15.851 4.593 1.00 0.00 O ATOM 967 CB ARG A 74 15.622 17.845 7.030 1.00 0.00 C ATOM 968 CG ARG A 74 14.947 18.448 5.772 1.00 0.00 C ATOM 969 CD ARG A 74 13.444 18.677 5.937 1.00 0.00 C ATOM 970 NE ARG A 74 12.798 18.903 4.626 1.00 0.00 N ATOM 971 CZ ARG A 74 11.584 19.378 4.381 1.00 0.00 C ATOM 972 NH1 ARG A 74 10.751 19.692 5.350 1.00 0.00 N ATOM 973 NH2 ARG A 74 11.185 19.509 3.131 1.00 0.00 N ATOM 0 H ARG A 74 17.858 17.957 5.305 1.00 0.00 H new ATOM 0 HA ARG A 74 17.101 16.421 7.700 1.00 0.00 H new ATOM 0 HB2 ARG A 74 14.869 17.297 7.596 1.00 0.00 H new ATOM 0 HB3 ARG A 74 15.964 18.663 7.664 1.00 0.00 H new ATOM 0 HG2 ARG A 74 15.427 19.397 5.531 1.00 0.00 H new ATOM 0 HG3 ARG A 74 15.114 17.782 4.925 1.00 0.00 H new ATOM 0 HD2 ARG A 74 12.992 17.814 6.426 1.00 0.00 H new ATOM 0 HD3 ARG A 74 13.272 19.537 6.585 1.00 0.00 H new ATOM 0 HE ARG A 74 13.356 18.663 3.807 1.00 0.00 H new ATOM 0 HH11 ARG A 74 11.032 19.572 6.323 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.824 20.055 5.128 1.00 0.00 H new ATOM 0 HH21 ARG A 74 11.807 19.246 2.367 1.00 0.00 H new ATOM 0 HH22 ARG A 74 10.254 19.873 2.928 1.00 0.00 H new ATOM 987 N TYR A 75 15.591 14.899 6.226 1.00 0.00 N ATOM 988 CA TYR A 75 14.831 14.001 5.363 1.00 0.00 C ATOM 989 C TYR A 75 13.370 14.467 5.427 1.00 0.00 C ATOM 990 O TYR A 75 12.929 14.992 6.448 1.00 0.00 O ATOM 991 CB TYR A 75 14.983 12.543 5.819 1.00 0.00 C ATOM 992 CG TYR A 75 16.380 11.943 5.738 1.00 0.00 C ATOM 993 CD1 TYR A 75 17.272 12.275 4.694 1.00 0.00 C ATOM 994 CD2 TYR A 75 16.776 11.006 6.713 1.00 0.00 C ATOM 995 CE1 TYR A 75 18.552 11.686 4.632 1.00 0.00 C ATOM 996 CE2 TYR A 75 18.052 10.414 6.655 1.00 0.00 C ATOM 997 CZ TYR A 75 18.941 10.744 5.610 1.00 0.00 C ATOM 998 OH TYR A 75 20.172 10.166 5.569 1.00 0.00 O ATOM 0 H TYR A 75 15.423 14.748 7.221 1.00 0.00 H new ATOM 0 HA TYR A 75 15.197 14.035 4.337 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.642 12.472 6.852 1.00 0.00 H new ATOM 0 HB3 TYR A 75 14.313 11.927 5.219 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.972 12.985 3.938 1.00 0.00 H new ATOM 0 HD2 TYR A 75 16.097 10.740 7.509 1.00 0.00 H new ATOM 0 HE1 TYR A 75 19.233 11.955 3.838 1.00 0.00 H new ATOM 0 HE2 TYR A 75 18.351 9.705 7.413 1.00 0.00 H new ATOM 0 HH TYR A 75 20.267 9.545 6.321 1.00 0.00 H new ATOM 1008 N ALA A 76 12.617 14.295 4.351 1.00 0.00 N ATOM 1009 CA ALA A 76 11.191 14.586 4.316 1.00 0.00 C ATOM 1010 C ALA A 76 10.488 13.634 3.374 1.00 0.00 C ATOM 1011 O ALA A 76 11.124 13.083 2.476 1.00 0.00 O ATOM 1012 CB ALA A 76 10.989 16.041 3.891 1.00 0.00 C ATOM 0 H ALA A 76 12.984 13.945 3.466 1.00 0.00 H new ATOM 0 HA ALA A 76 10.758 14.448 5.307 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.923 16.267 3.862 1.00 0.00 H new ATOM 0 HB2 ALA A 76 11.481 16.701 4.606 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.419 16.194 2.901 1.00 0.00 H new ATOM 1018 N LEU A 77 9.184 13.446 3.575 1.00 0.00 N ATOM 1019 CA LEU A 77 8.346 12.720 2.639 1.00 0.00 C ATOM 1020 C LEU A 77 8.482 13.321 1.228 1.00 0.00 C ATOM 1021 O LEU A 77 8.631 14.534 1.095 1.00 0.00 O ATOM 1022 CB LEU A 77 6.899 12.812 3.131 1.00 0.00 C ATOM 1023 CG LEU A 77 6.158 11.495 2.962 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.628 10.432 3.949 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.712 11.817 3.269 1.00 0.00 C ATOM 0 H LEU A 77 8.685 13.795 4.393 1.00 0.00 H new ATOM 0 HA LEU A 77 8.653 11.675 2.584 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.891 13.101 4.182 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.378 13.595 2.581 1.00 0.00 H new ATOM 0 HG LEU A 77 6.325 11.097 1.961 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.068 9.511 3.786 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.691 10.241 3.800 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.462 10.783 4.968 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.109 10.915 3.169 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.632 12.195 4.288 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.352 12.573 2.572 1.00 0.00 H new ATOM 1037 N ALA A 78 8.428 12.491 0.185 1.00 0.00 N ATOM 1038 CA ALA A 78 8.741 12.927 -1.180 1.00 0.00 C ATOM 1039 C ALA A 78 7.736 13.900 -1.828 1.00 0.00 C ATOM 1040 O ALA A 78 8.122 14.570 -2.776 1.00 0.00 O ATOM 1041 CB ALA A 78 8.944 11.681 -2.044 1.00 0.00 C ATOM 0 H ALA A 78 8.169 11.507 0.259 1.00 0.00 H new ATOM 0 HA ALA A 78 9.651 13.524 -1.112 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.178 11.981 -3.065 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.766 11.089 -1.642 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.032 11.084 -2.041 1.00 0.00 H new ATOM 1047 N ASP A 79 6.491 13.980 -1.342 1.00 0.00 N ATOM 1048 CA ASP A 79 5.463 14.954 -1.761 1.00 0.00 C ATOM 1049 C ASP A 79 4.234 14.954 -0.821 1.00 0.00 C ATOM 1050 O ASP A 79 3.983 13.996 -0.079 1.00 0.00 O ATOM 1051 CB ASP A 79 5.012 14.732 -3.230 1.00 0.00 C ATOM 1052 CG ASP A 79 4.007 15.806 -3.680 1.00 0.00 C ATOM 1053 OD1 ASP A 79 4.325 17.005 -3.512 1.00 0.00 O ATOM 1054 OD2 ASP A 79 2.836 15.456 -3.954 1.00 0.00 O ATOM 0 H ASP A 79 6.154 13.345 -0.618 1.00 0.00 H new ATOM 0 HA ASP A 79 5.937 15.933 -1.694 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.883 14.750 -3.886 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.559 13.745 -3.328 1.00 0.00 H new ATOM 1059 N SER A 80 3.420 16.011 -0.922 1.00 0.00 N ATOM 1060 CA SER A 80 2.083 16.153 -0.330 1.00 0.00 C ATOM 1061 C SER A 80 1.164 14.967 -0.658 1.00 0.00 C ATOM 1062 O SER A 80 0.298 14.615 0.136 1.00 0.00 O ATOM 1063 CB SER A 80 1.388 17.407 -0.879 1.00 0.00 C ATOM 1064 OG SER A 80 2.108 18.596 -0.630 1.00 0.00 O ATOM 0 H SER A 80 3.692 16.840 -1.450 1.00 0.00 H new ATOM 0 HA SER A 80 2.239 16.211 0.747 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.246 17.294 -1.954 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.397 17.490 -0.433 1.00 0.00 H new ATOM 0 HG SER A 80 1.619 19.359 -1.003 1.00 0.00 H new ATOM 1070 N HIS A 81 1.354 14.328 -1.815 1.00 0.00 N ATOM 1071 CA HIS A 81 0.721 13.087 -2.236 1.00 0.00 C ATOM 1072 C HIS A 81 0.883 11.975 -1.205 1.00 0.00 C ATOM 1073 O HIS A 81 -0.126 11.445 -0.730 1.00 0.00 O ATOM 1074 CB HIS A 81 1.329 12.692 -3.598 1.00 0.00 C ATOM 1075 CG HIS A 81 0.685 13.374 -4.776 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.487 14.101 -4.779 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.001 13.120 -6.074 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -0.903 14.216 -6.048 1.00 0.00 C ATOM 1079 NE2 HIS A 81 0.041 13.711 -6.871 1.00 0.00 N ATOM 0 H HIS A 81 1.994 14.690 -2.522 1.00 0.00 H new ATOM 0 HA HIS A 81 -0.354 13.239 -2.331 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.393 12.928 -3.592 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.242 11.613 -3.724 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -0.956 14.484 -3.958 1.00 0.00 H new ATOM 0 HD2 HIS A 81 1.854 12.555 -6.421 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.843 14.644 -6.362 1.00 0.00 H new ATOM 1088 N LEU A 82 2.126 11.615 -0.853 1.00 0.00 N ATOM 1089 CA LEU A 82 2.341 10.581 0.167 1.00 0.00 C ATOM 1090 C LEU A 82 1.793 11.088 1.495 1.00 0.00 C ATOM 1091 O LEU A 82 1.047 10.359 2.133 1.00 0.00 O ATOM 1092 CB LEU A 82 3.816 10.152 0.295 1.00 0.00 C ATOM 1093 CG LEU A 82 4.562 9.888 -1.023 1.00 0.00 C ATOM 1094 CD1 LEU A 82 5.971 9.381 -0.730 1.00 0.00 C ATOM 1095 CD2 LEU A 82 3.838 8.895 -1.947 1.00 0.00 C ATOM 0 H LEU A 82 2.978 12.013 -1.249 1.00 0.00 H new ATOM 0 HA LEU A 82 1.807 9.682 -0.141 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.352 10.927 0.843 1.00 0.00 H new ATOM 0 HB3 LEU A 82 3.858 9.246 0.900 1.00 0.00 H new ATOM 0 HG LEU A 82 4.601 10.840 -1.552 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.494 9.196 -1.668 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.514 10.130 -0.153 1.00 0.00 H new ATOM 0 HD13 LEU A 82 5.913 8.455 -0.158 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.420 8.755 -2.858 1.00 0.00 H new ATOM 0 HD22 LEU A 82 3.727 7.938 -1.437 1.00 0.00 H new ATOM 0 HD23 LEU A 82 2.853 9.287 -2.202 1.00 0.00 H new ATOM 1107 N ALA A 83 2.071 12.352 1.844 1.00 0.00 N ATOM 1108 CA ALA A 83 1.706 12.973 3.121 1.00 0.00 C ATOM 1109 C ALA A 83 0.201 12.904 3.365 1.00 0.00 C ATOM 1110 O ALA A 83 -0.232 12.731 4.498 1.00 0.00 O ATOM 1111 CB ALA A 83 2.174 14.435 3.119 1.00 0.00 C ATOM 0 H ALA A 83 2.572 12.989 1.224 1.00 0.00 H new ATOM 0 HA ALA A 83 2.195 12.426 3.927 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.906 14.904 4.066 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.256 14.471 2.990 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.693 14.970 2.300 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.577 13.003 2.288 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.023 12.910 2.299 1.00 0.00 C ATOM 1119 C ARG A 84 -2.509 11.462 2.501 1.00 0.00 C ATOM 1120 O ARG A 84 -3.137 11.232 3.522 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.549 13.631 1.041 1.00 0.00 C ATOM 1122 CG ARG A 84 -4.024 13.338 0.797 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.848 14.434 0.119 1.00 0.00 C ATOM 1124 NE ARG A 84 -4.972 15.644 0.959 1.00 0.00 N ATOM 1125 CZ ARG A 84 -5.775 15.799 2.009 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -6.572 14.853 2.453 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -5.788 16.953 2.645 1.00 0.00 N ATOM 0 H ARG A 84 -0.197 13.156 1.354 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.449 13.420 3.163 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.405 14.706 1.151 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.968 13.319 0.173 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -4.094 12.436 0.188 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -4.487 13.111 1.757 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.383 14.700 -0.831 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -5.842 14.049 -0.109 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.384 16.439 0.709 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -6.595 13.946 1.988 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -7.167 15.026 3.263 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -5.187 17.715 2.331 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -6.399 17.084 3.451 1.00 0.00 H new ATOM 1141 N ALA A 85 -2.157 10.471 1.672 1.00 0.00 N ATOM 1142 CA ALA A 85 -2.643 9.087 1.886 1.00 0.00 C ATOM 1143 C ALA A 85 -2.052 8.417 3.157 1.00 0.00 C ATOM 1144 O ALA A 85 -2.657 7.514 3.737 1.00 0.00 O ATOM 1145 CB ALA A 85 -2.454 8.274 0.595 1.00 0.00 C ATOM 0 H ALA A 85 -1.550 10.589 0.861 1.00 0.00 H new ATOM 0 HA ALA A 85 -3.711 9.121 2.099 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -2.811 7.256 0.751 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -3.020 8.737 -0.213 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -1.397 8.251 0.331 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.894 8.903 3.619 1.00 0.00 N ATOM 1152 CA LEU A 86 -0.274 8.596 4.916 1.00 0.00 C ATOM 1153 C LEU A 86 -1.059 9.258 6.065 1.00 0.00 C ATOM 1154 O LEU A 86 -1.334 8.611 7.072 1.00 0.00 O ATOM 1155 CB LEU A 86 1.169 9.131 4.826 1.00 0.00 C ATOM 1156 CG LEU A 86 2.085 9.052 6.048 1.00 0.00 C ATOM 1157 CD1 LEU A 86 2.528 7.684 6.532 1.00 0.00 C ATOM 1158 CD2 LEU A 86 3.358 9.819 5.688 1.00 0.00 C ATOM 0 H LEU A 86 -0.334 9.555 3.070 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.279 7.527 5.128 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.663 8.598 4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.110 10.179 4.531 1.00 0.00 H new ATOM 0 HG LEU A 86 1.484 9.450 6.866 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.172 7.798 7.404 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.653 7.092 6.801 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.078 7.178 5.739 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.049 9.793 6.531 1.00 0.00 H new ATOM 0 HD22 LEU A 86 3.828 9.357 4.819 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.106 10.854 5.457 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.421 10.536 5.900 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.005 11.409 6.924 1.00 0.00 C ATOM 1172 C GLY A 87 -3.521 11.290 7.090 1.00 0.00 C ATOM 1173 O GLY A 87 -4.017 11.367 8.211 1.00 0.00 O ATOM 0 H GLY A 87 -1.309 11.012 5.005 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.532 11.188 7.881 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.762 12.443 6.680 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.256 11.081 5.996 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.713 10.863 5.977 1.00 0.00 C ATOM 1179 C GLU A 88 -6.107 9.434 6.390 1.00 0.00 C ATOM 1180 O GLU A 88 -7.290 9.148 6.558 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.315 11.327 4.634 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.370 10.346 3.438 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.200 11.097 2.108 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -6.748 12.219 1.969 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.425 10.621 1.250 1.00 0.00 O ATOM 0 H GLU A 88 -3.843 11.057 5.064 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.161 11.491 6.747 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.335 11.657 4.831 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.753 12.203 4.311 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.585 9.596 3.540 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.321 9.814 3.442 1.00 0.00 H new ATOM 1192 N LEU A 89 -5.101 8.570 6.592 1.00 0.00 N ATOM 1193 CA LEU A 89 -5.171 7.246 7.207 1.00 0.00 C ATOM 1194 C LEU A 89 -6.086 6.269 6.454 1.00 0.00 C ATOM 1195 O LEU A 89 -7.260 6.094 6.785 1.00 0.00 O ATOM 1196 CB LEU A 89 -5.543 7.404 8.698 1.00 0.00 C ATOM 1197 CG LEU A 89 -5.381 6.120 9.536 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -3.915 5.655 9.580 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -5.889 6.384 10.960 1.00 0.00 C ATOM 0 H LEU A 89 -4.149 8.800 6.307 1.00 0.00 H new ATOM 0 HA LEU A 89 -4.187 6.782 7.140 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -4.923 8.188 9.133 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -6.577 7.740 8.768 1.00 0.00 H new ATOM 0 HG LEU A 89 -5.965 5.326 9.070 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -3.839 4.748 10.179 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -3.567 5.451 8.567 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -3.299 6.436 10.025 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -5.778 5.480 11.559 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -5.310 7.191 11.409 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -6.941 6.669 10.924 1.00 0.00 H new ATOM 1211 N VAL A 90 -5.499 5.546 5.491 1.00 0.00 N ATOM 1212 CA VAL A 90 -6.162 4.495 4.691 1.00 0.00 C ATOM 1213 C VAL A 90 -7.082 3.605 5.541 1.00 0.00 C ATOM 1214 O VAL A 90 -6.813 3.327 6.710 1.00 0.00 O ATOM 1215 CB VAL A 90 -5.179 3.601 3.893 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -4.020 4.379 3.238 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -4.617 2.449 4.742 1.00 0.00 C ATOM 0 H VAL A 90 -4.520 5.676 5.236 1.00 0.00 H new ATOM 0 HA VAL A 90 -6.764 5.048 3.970 1.00 0.00 H new ATOM 0 HB VAL A 90 -5.784 3.185 3.088 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -3.375 3.685 2.698 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -4.423 5.116 2.543 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -3.441 4.887 4.009 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -3.934 1.852 4.138 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -4.082 2.857 5.600 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.437 1.821 5.091 1.00 0.00 H new ATOM 1227 N GLN A 91 -8.138 3.069 4.934 1.00 0.00 N ATOM 1228 CA GLN A 91 -9.307 2.575 5.632 1.00 0.00 C ATOM 1229 C GLN A 91 -9.099 1.275 6.403 1.00 0.00 C ATOM 1230 O GLN A 91 -10.038 0.806 7.021 1.00 0.00 O ATOM 1231 CB GLN A 91 -10.390 2.426 4.569 1.00 0.00 C ATOM 1232 CG GLN A 91 -11.024 3.762 4.186 1.00 0.00 C ATOM 1233 CD GLN A 91 -12.174 4.147 5.104 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -13.317 3.778 4.894 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -11.895 4.837 6.192 1.00 0.00 N ATOM 0 H GLN A 91 -8.199 2.967 3.921 1.00 0.00 H new ATOM 0 HA GLN A 91 -9.578 3.283 6.415 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -9.961 1.964 3.680 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -11.164 1.752 4.936 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -10.264 4.543 4.215 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -11.386 3.707 3.159 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -10.939 5.146 6.369 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -12.635 5.062 6.857 1.00 0.00 H new ATOM 1244 N VAL A 92 -7.890 0.723 6.439 1.00 0.00 N ATOM 1245 CA VAL A 92 -7.492 -0.468 7.228 1.00 0.00 C ATOM 1246 C VAL A 92 -7.527 -0.255 8.761 1.00 0.00 C ATOM 1247 O VAL A 92 -6.707 -0.781 9.500 1.00 0.00 O ATOM 1248 CB VAL A 92 -6.158 -1.053 6.702 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -4.947 -0.224 7.156 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -6.002 -2.550 7.032 1.00 0.00 C ATOM 0 H VAL A 92 -7.114 1.103 5.897 1.00 0.00 H new ATOM 0 HA VAL A 92 -8.259 -1.225 7.068 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.194 -0.984 5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.033 -0.670 6.764 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.043 0.795 6.781 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.905 -0.208 8.245 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -5.051 -2.911 6.642 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -6.027 -2.689 8.113 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.818 -3.110 6.575 1.00 0.00 H new ATOM 1260 N VAL A 93 -8.495 0.534 9.235 1.00 0.00 N ATOM 1261 CA VAL A 93 -8.863 0.712 10.650 1.00 0.00 C ATOM 1262 C VAL A 93 -7.718 1.281 11.519 1.00 0.00 C ATOM 1263 O VAL A 93 -7.736 1.128 12.736 1.00 0.00 O ATOM 1264 CB VAL A 93 -9.451 -0.597 11.266 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -10.484 -0.270 12.361 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -10.177 -1.492 10.237 1.00 0.00 C ATOM 0 H VAL A 93 -9.076 1.097 8.613 1.00 0.00 H new ATOM 0 HA VAL A 93 -9.648 1.468 10.655 1.00 0.00 H new ATOM 0 HB VAL A 93 -8.587 -1.130 11.662 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -10.880 -1.197 12.776 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -10.005 0.306 13.153 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -11.299 0.312 11.930 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -10.559 -2.383 10.735 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -11.006 -0.939 9.795 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -9.478 -1.786 9.454 1.00 0.00 H new ATOM 1276 N LEU A 94 -6.729 1.917 10.863 1.00 0.00 N ATOM 1277 CA LEU A 94 -5.408 2.339 11.351 1.00 0.00 C ATOM 1278 C LEU A 94 -4.427 1.220 10.977 1.00 0.00 C ATOM 1279 O LEU A 94 -4.439 0.142 11.565 1.00 0.00 O ATOM 1280 CB LEU A 94 -5.376 2.694 12.860 1.00 0.00 C ATOM 1281 CG LEU A 94 -4.169 3.523 13.353 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -4.384 3.880 14.831 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -2.815 2.815 13.203 1.00 0.00 C ATOM 0 H LEU A 94 -6.850 2.172 9.883 1.00 0.00 H new ATOM 0 HA LEU A 94 -5.123 3.278 10.877 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.286 3.243 13.100 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.405 1.765 13.429 1.00 0.00 H new ATOM 0 HG LEU A 94 -4.123 4.410 12.721 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.538 4.466 15.191 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.299 4.463 14.935 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.468 2.965 15.418 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.022 3.465 13.572 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.823 1.889 13.778 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.638 2.587 12.152 1.00 0.00 H new ATOM 1295 N ALA A 95 -3.577 1.469 9.980 1.00 0.00 N ATOM 1296 CA ALA A 95 -2.451 0.605 9.632 1.00 0.00 C ATOM 1297 C ALA A 95 -1.517 0.372 10.839 1.00 0.00 C ATOM 1298 O ALA A 95 -0.565 1.117 11.038 1.00 0.00 O ATOM 1299 CB ALA A 95 -1.728 1.233 8.427 1.00 0.00 C ATOM 0 H ALA A 95 -3.654 2.292 9.382 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.807 -0.387 9.355 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -0.881 0.608 8.145 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -2.419 1.309 7.587 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -1.372 2.228 8.695 1.00 0.00 H new ATOM 1305 N VAL A 96 -1.791 -0.668 11.630 1.00 0.00 N ATOM 1306 CA VAL A 96 -0.928 -1.158 12.716 1.00 0.00 C ATOM 1307 C VAL A 96 0.405 -1.658 12.150 1.00 0.00 C ATOM 1308 O VAL A 96 0.427 -2.418 11.182 1.00 0.00 O ATOM 1309 CB VAL A 96 -1.600 -2.297 13.523 1.00 0.00 C ATOM 1310 CG1 VAL A 96 -0.769 -2.699 14.757 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -3.003 -1.912 14.018 1.00 0.00 C ATOM 0 H VAL A 96 -2.648 -1.213 11.532 1.00 0.00 H new ATOM 0 HA VAL A 96 -0.755 -0.320 13.391 1.00 0.00 H new ATOM 0 HB VAL A 96 -1.669 -3.134 12.828 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.278 -3.500 15.293 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.214 -3.044 14.437 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.655 -1.838 15.415 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.432 -2.743 14.578 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -2.933 -1.037 14.664 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -3.640 -1.683 13.164 1.00 0.00 H new ATOM 1321 N ASP A 97 1.505 -1.284 12.809 1.00 0.00 N ATOM 1322 CA ASP A 97 2.907 -1.641 12.499 1.00 0.00 C ATOM 1323 C ASP A 97 3.233 -3.151 12.584 1.00 0.00 C ATOM 1324 O ASP A 97 4.396 -3.549 12.498 1.00 0.00 O ATOM 1325 CB ASP A 97 3.842 -0.883 13.461 1.00 0.00 C ATOM 1326 CG ASP A 97 3.701 0.638 13.446 1.00 0.00 C ATOM 1327 OD1 ASP A 97 3.885 1.247 12.368 1.00 0.00 O ATOM 1328 OD2 ASP A 97 3.507 1.186 14.559 1.00 0.00 O ATOM 0 H ASP A 97 1.444 -0.683 13.631 1.00 0.00 H new ATOM 0 HA ASP A 97 3.059 -1.357 11.458 1.00 0.00 H new ATOM 0 HB2 ASP A 97 3.658 -1.238 14.475 1.00 0.00 H new ATOM 0 HB3 ASP A 97 4.873 -1.138 13.216 1.00 0.00 H new ATOM 1333 N THR A 98 2.222 -4.002 12.796 1.00 0.00 N ATOM 1334 CA THR A 98 2.373 -5.457 12.835 1.00 0.00 C ATOM 1335 C THR A 98 2.902 -5.975 11.510 1.00 0.00 C ATOM 1336 O THR A 98 2.464 -5.583 10.428 1.00 0.00 O ATOM 1337 CB THR A 98 1.084 -6.215 13.205 1.00 0.00 C ATOM 1338 OG1 THR A 98 -0.077 -5.453 12.978 1.00 0.00 O ATOM 1339 CG2 THR A 98 1.086 -6.612 14.682 1.00 0.00 C ATOM 0 H THR A 98 1.262 -3.692 12.947 1.00 0.00 H new ATOM 0 HA THR A 98 3.089 -5.652 13.633 1.00 0.00 H new ATOM 0 HB THR A 98 1.069 -7.096 12.563 1.00 0.00 H new ATOM 0 HG1 THR A 98 -0.866 -5.978 13.226 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.165 -7.146 14.917 1.00 0.00 H new ATOM 0 HG22 THR A 98 1.941 -7.257 14.884 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.154 -5.716 15.299 1.00 0.00 H new ATOM 1347 N ASP A 99 3.829 -6.915 11.643 1.00 0.00 N ATOM 1348 CA ASP A 99 4.274 -7.798 10.581 1.00 0.00 C ATOM 1349 C ASP A 99 3.430 -9.081 10.659 1.00 0.00 C ATOM 1350 O ASP A 99 2.918 -9.479 11.714 1.00 0.00 O ATOM 1351 CB ASP A 99 5.774 -8.109 10.703 1.00 0.00 C ATOM 1352 CG ASP A 99 6.186 -9.164 9.672 1.00 0.00 C ATOM 1353 OD1 ASP A 99 5.967 -8.899 8.469 1.00 0.00 O ATOM 1354 OD2 ASP A 99 6.542 -10.285 10.096 1.00 0.00 O ATOM 0 H ASP A 99 4.307 -7.087 12.527 1.00 0.00 H new ATOM 0 HA ASP A 99 4.139 -7.317 9.612 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.354 -7.198 10.553 1.00 0.00 H new ATOM 0 HB3 ASP A 99 5.997 -8.467 11.708 1.00 0.00 H new ATOM 1359 N GLN A 100 3.288 -9.744 9.522 1.00 0.00 N ATOM 1360 CA GLN A 100 2.641 -11.032 9.389 1.00 0.00 C ATOM 1361 C GLN A 100 3.121 -11.609 8.056 1.00 0.00 C ATOM 1362 O GLN A 100 3.091 -10.871 7.063 1.00 0.00 O ATOM 1363 CB GLN A 100 1.109 -10.848 9.378 1.00 0.00 C ATOM 1364 CG GLN A 100 0.276 -12.063 9.815 1.00 0.00 C ATOM 1365 CD GLN A 100 0.012 -12.100 11.319 1.00 0.00 C ATOM 1366 OE1 GLN A 100 -0.899 -12.754 11.794 1.00 0.00 O ATOM 1367 NE2 GLN A 100 0.743 -11.361 12.131 1.00 0.00 N ATOM 0 H GLN A 100 3.635 -9.382 8.634 1.00 0.00 H new ATOM 0 HA GLN A 100 2.885 -11.697 10.217 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.860 -10.010 10.029 1.00 0.00 H new ATOM 0 HB3 GLN A 100 0.805 -10.569 8.369 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -0.677 -12.052 9.285 1.00 0.00 H new ATOM 0 HG3 GLN A 100 0.794 -12.976 9.521 1.00 0.00 H new ATOM 0 HE21 GLN A 100 1.512 -10.804 11.760 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.539 -11.347 13.130 1.00 0.00 H new ATOM 1376 N PRO A 101 3.486 -12.902 7.982 1.00 0.00 N ATOM 1377 CA PRO A 101 3.728 -13.547 6.702 1.00 0.00 C ATOM 1378 C PRO A 101 2.454 -13.511 5.851 1.00 0.00 C ATOM 1379 O PRO A 101 1.358 -13.255 6.351 1.00 0.00 O ATOM 1380 CB PRO A 101 4.172 -14.978 7.032 1.00 0.00 C ATOM 1381 CG PRO A 101 3.510 -15.243 8.382 1.00 0.00 C ATOM 1382 CD PRO A 101 3.578 -13.877 9.062 1.00 0.00 C ATOM 0 HA PRO A 101 4.496 -13.042 6.116 1.00 0.00 H new ATOM 0 HB2 PRO A 101 3.840 -15.688 6.274 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.257 -15.060 7.092 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.482 -15.588 8.268 1.00 0.00 H new ATOM 0 HG3 PRO A 101 4.042 -16.006 8.951 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.763 -13.752 9.775 1.00 0.00 H new ATOM 0 HD3 PRO A 101 4.508 -13.761 9.618 1.00 0.00 H new ATOM 1390 N CYS A 102 2.603 -13.787 4.558 1.00 0.00 N ATOM 1391 CA CYS A 102 1.500 -13.991 3.642 1.00 0.00 C ATOM 1392 C CYS A 102 0.853 -15.384 3.883 1.00 0.00 C ATOM 1393 O CYS A 102 0.499 -15.768 4.998 1.00 0.00 O ATOM 1394 CB CYS A 102 2.119 -13.744 2.250 1.00 0.00 C ATOM 1395 SG CYS A 102 0.987 -13.836 0.822 1.00 0.00 S ATOM 0 H CYS A 102 3.517 -13.876 4.115 1.00 0.00 H new ATOM 0 HA CYS A 102 0.654 -13.316 3.772 1.00 0.00 H new ATOM 0 HB2 CYS A 102 2.582 -12.757 2.254 1.00 0.00 H new ATOM 0 HB3 CYS A 102 2.917 -14.471 2.099 1.00 0.00 H new ATOM 1400 N VAL A 103 0.689 -16.131 2.795 1.00 0.00 N ATOM 1401 CA VAL A 103 0.328 -17.560 2.699 1.00 0.00 C ATOM 1402 C VAL A 103 -1.162 -17.831 2.964 1.00 0.00 C ATOM 1403 O VAL A 103 -1.743 -18.578 2.185 1.00 0.00 O ATOM 1404 CB VAL A 103 1.223 -18.470 3.588 1.00 0.00 C ATOM 1405 CG1 VAL A 103 0.938 -19.964 3.356 1.00 0.00 C ATOM 1406 CG2 VAL A 103 2.713 -18.216 3.287 1.00 0.00 C ATOM 0 H VAL A 103 0.815 -15.723 1.869 1.00 0.00 H new ATOM 0 HA VAL A 103 0.520 -17.825 1.659 1.00 0.00 H new ATOM 0 HB VAL A 103 0.990 -18.220 4.623 1.00 0.00 H new ATOM 0 HG11 VAL A 103 1.586 -20.562 3.997 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.104 -20.177 3.593 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.131 -20.213 2.313 1.00 0.00 H new ATOM 0 HG21 VAL A 103 3.326 -18.860 3.917 1.00 0.00 H new ATOM 0 HG22 VAL A 103 2.915 -18.435 2.239 1.00 0.00 H new ATOM 0 HG23 VAL A 103 2.953 -17.173 3.492 1.00 0.00 H new ATOM 1416 N ALA A 104 -1.738 -17.224 4.022 1.00 0.00 N ATOM 1417 CA ALA A 104 -3.145 -17.232 4.505 1.00 0.00 C ATOM 1418 C ALA A 104 -3.298 -17.706 5.966 1.00 0.00 C ATOM 1419 O ALA A 104 -4.410 -17.796 6.482 1.00 0.00 O ATOM 1420 CB ALA A 104 -4.111 -17.992 3.578 1.00 0.00 C ATOM 0 H ALA A 104 -1.163 -16.646 4.635 1.00 0.00 H new ATOM 0 HA ALA A 104 -3.435 -16.181 4.479 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.118 -17.956 3.994 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -4.109 -17.529 2.591 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.791 -19.030 3.492 1.00 0.00 H new ATOM 1426 N GLU A 105 -2.191 -18.016 6.639 1.00 0.00 N ATOM 1427 CA GLU A 105 -2.173 -18.372 8.060 1.00 0.00 C ATOM 1428 C GLU A 105 -2.495 -17.162 8.968 1.00 0.00 C ATOM 1429 O GLU A 105 -2.760 -16.067 8.470 1.00 0.00 O ATOM 1430 CB GLU A 105 -0.812 -19.021 8.355 1.00 0.00 C ATOM 1431 CG GLU A 105 0.369 -18.033 8.308 1.00 0.00 C ATOM 1432 CD GLU A 105 0.707 -17.538 9.711 1.00 0.00 C ATOM 1433 OE1 GLU A 105 1.081 -18.384 10.544 1.00 0.00 O ATOM 1434 OE2 GLU A 105 0.500 -16.338 9.987 1.00 0.00 O ATOM 0 H GLU A 105 -1.267 -18.028 6.207 1.00 0.00 H new ATOM 0 HA GLU A 105 -2.963 -19.088 8.287 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.847 -19.485 9.341 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -0.636 -19.819 7.633 1.00 0.00 H new ATOM 0 HG2 GLU A 105 1.240 -18.519 7.868 1.00 0.00 H new ATOM 0 HG3 GLU A 105 0.118 -17.187 7.668 1.00 0.00 H new ATOM 1441 N ARG A 106 -2.448 -17.335 10.293 1.00 0.00 N ATOM 1442 CA ARG A 106 -2.507 -16.233 11.268 1.00 0.00 C ATOM 1443 C ARG A 106 -1.925 -16.714 12.607 1.00 0.00 C ATOM 1444 O ARG A 106 -2.671 -17.004 13.541 1.00 0.00 O ATOM 1445 CB ARG A 106 -3.943 -15.646 11.374 1.00 0.00 C ATOM 1446 CG ARG A 106 -4.034 -14.184 11.865 1.00 0.00 C ATOM 1447 CD ARG A 106 -3.504 -13.979 13.288 1.00 0.00 C ATOM 1448 NE ARG A 106 -3.654 -12.593 13.786 1.00 0.00 N ATOM 1449 CZ ARG A 106 -2.844 -12.023 14.669 1.00 0.00 C ATOM 1450 NH1 ARG A 106 -1.786 -12.630 15.162 1.00 0.00 N ATOM 1451 NH2 ARG A 106 -3.090 -10.813 15.093 1.00 0.00 N ATOM 0 H ARG A 106 -2.367 -18.254 10.727 1.00 0.00 H new ATOM 0 HA ARG A 106 -1.891 -15.399 10.930 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -4.416 -15.711 10.394 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -4.523 -16.274 12.050 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.474 -13.545 11.182 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -5.074 -13.860 11.824 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -4.028 -14.656 13.962 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -2.450 -14.254 13.316 1.00 0.00 H new ATOM 0 HE ARG A 106 -4.432 -12.039 13.426 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -1.559 -13.580 14.867 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -1.192 -12.151 15.839 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -3.904 -10.307 14.746 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -2.468 -10.374 15.772 1.00 0.00 H new TER 1465 ARG A 106 ATOM 1466 N ALA B 10 -1.879 -6.772 10.005 1.00 0.00 N ATOM 1467 CA ALA B 10 -0.550 -6.248 9.730 1.00 0.00 C ATOM 1468 C ALA B 10 -0.523 -5.356 8.493 1.00 0.00 C ATOM 1469 O ALA B 10 -1.011 -5.760 7.431 1.00 0.00 O ATOM 1470 CB ALA B 10 0.353 -7.465 9.516 1.00 0.00 C ATOM 0 HA ALA B 10 -0.217 -5.626 10.561 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.369 -7.132 9.305 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.353 -8.081 10.415 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.019 -8.051 8.675 1.00 0.00 H new ATOM 1476 N LEU B 11 0.140 -4.197 8.575 1.00 0.00 N ATOM 1477 CA LEU B 11 0.290 -3.312 7.413 1.00 0.00 C ATOM 1478 C LEU B 11 1.234 -3.892 6.353 1.00 0.00 C ATOM 1479 O LEU B 11 1.088 -3.572 5.173 1.00 0.00 O ATOM 1480 CB LEU B 11 0.621 -1.884 7.864 1.00 0.00 C ATOM 1481 CG LEU B 11 2.015 -1.629 8.471 1.00 0.00 C ATOM 1482 CD1 LEU B 11 3.131 -1.530 7.423 1.00 0.00 C ATOM 1483 CD2 LEU B 11 1.962 -0.276 9.185 1.00 0.00 C ATOM 0 H LEU B 11 0.579 -3.851 9.428 1.00 0.00 H new ATOM 0 HA LEU B 11 -0.667 -3.247 6.896 1.00 0.00 H new ATOM 0 HB2 LEU B 11 0.504 -1.225 7.004 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -0.125 -1.583 8.599 1.00 0.00 H new ATOM 0 HG LEU B 11 2.242 -2.470 9.126 1.00 0.00 H new ATOM 0 HD11 LEU B 11 4.083 -1.350 7.922 1.00 0.00 H new ATOM 0 HD12 LEU B 11 3.186 -2.462 6.861 1.00 0.00 H new ATOM 0 HD13 LEU B 11 2.917 -0.707 6.741 1.00 0.00 H new ATOM 0 HD21 LEU B 11 2.934 -0.060 9.629 1.00 0.00 H new ATOM 0 HD22 LEU B 11 1.710 0.505 8.467 1.00 0.00 H new ATOM 0 HD23 LEU B 11 1.205 -0.307 9.968 1.00 0.00 H new ATOM 1495 N ALA B 12 2.141 -4.789 6.763 1.00 0.00 N ATOM 1496 CA ALA B 12 2.951 -5.600 5.860 1.00 0.00 C ATOM 1497 C ALA B 12 2.046 -6.520 5.026 1.00 0.00 C ATOM 1498 O ALA B 12 2.047 -6.431 3.801 1.00 0.00 O ATOM 1499 CB ALA B 12 3.979 -6.375 6.695 1.00 0.00 C ATOM 0 H ALA B 12 2.331 -4.970 7.749 1.00 0.00 H new ATOM 0 HA ALA B 12 3.493 -4.974 5.151 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.595 -6.988 6.037 1.00 0.00 H new ATOM 0 HB2 ALA B 12 4.613 -5.672 7.235 1.00 0.00 H new ATOM 0 HB3 ALA B 12 3.460 -7.016 7.407 1.00 0.00 H new ATOM 1505 N ARG B 13 1.201 -7.337 5.676 1.00 0.00 N ATOM 1506 CA ARG B 13 0.243 -8.216 4.986 1.00 0.00 C ATOM 1507 C ARG B 13 -0.754 -7.441 4.113 1.00 0.00 C ATOM 1508 O ARG B 13 -1.039 -7.884 3.003 1.00 0.00 O ATOM 1509 CB ARG B 13 -0.494 -9.106 5.993 1.00 0.00 C ATOM 1510 CG ARG B 13 -1.431 -10.092 5.280 1.00 0.00 C ATOM 1511 CD ARG B 13 -2.149 -11.052 6.229 1.00 0.00 C ATOM 1512 NE ARG B 13 -1.338 -12.235 6.563 1.00 0.00 N ATOM 1513 CZ ARG B 13 -1.804 -13.380 7.041 1.00 0.00 C ATOM 1514 NH1 ARG B 13 -3.085 -13.608 7.224 1.00 0.00 N ATOM 1515 NH2 ARG B 13 -0.972 -14.341 7.352 1.00 0.00 N ATOM 0 H ARG B 13 1.163 -7.407 6.693 1.00 0.00 H new ATOM 0 HA ARG B 13 0.823 -8.847 4.312 1.00 0.00 H new ATOM 0 HB2 ARG B 13 0.230 -9.657 6.593 1.00 0.00 H new ATOM 0 HB3 ARG B 13 -1.069 -8.484 6.679 1.00 0.00 H new ATOM 0 HG2 ARG B 13 -2.174 -9.529 4.715 1.00 0.00 H new ATOM 0 HG3 ARG B 13 -0.854 -10.671 4.559 1.00 0.00 H new ATOM 0 HD2 ARG B 13 -2.408 -10.523 7.146 1.00 0.00 H new ATOM 0 HD3 ARG B 13 -3.085 -11.375 5.773 1.00 0.00 H new ATOM 0 HE ARG B 13 -0.331 -12.167 6.414 1.00 0.00 H new ATOM 0 HH11 ARG B 13 -3.769 -12.887 6.995 1.00 0.00 H new ATOM 0 HH12 ARG B 13 -3.395 -14.506 7.595 1.00 0.00 H new ATOM 0 HH21 ARG B 13 0.031 -14.207 7.226 1.00 0.00 H new ATOM 0 HH22 ARG B 13 -1.327 -15.224 7.720 1.00 0.00 H new ATOM 1529 N LEU B 14 -1.257 -6.290 4.576 1.00 0.00 N ATOM 1530 CA LEU B 14 -2.159 -5.414 3.819 1.00 0.00 C ATOM 1531 C LEU B 14 -1.548 -5.066 2.457 1.00 0.00 C ATOM 1532 O LEU B 14 -2.116 -5.395 1.412 1.00 0.00 O ATOM 1533 CB LEU B 14 -2.446 -4.187 4.712 1.00 0.00 C ATOM 1534 CG LEU B 14 -3.361 -3.056 4.196 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.686 -2.113 3.190 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -4.690 -3.583 3.643 1.00 0.00 C ATOM 0 H LEU B 14 -1.043 -5.934 5.508 1.00 0.00 H new ATOM 0 HA LEU B 14 -3.106 -5.900 3.584 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -2.879 -4.556 5.641 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -1.486 -3.738 4.965 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.576 -2.456 5.080 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.395 -1.347 2.877 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -1.823 -1.639 3.658 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -2.359 -2.683 2.320 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -5.296 -2.747 3.294 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -4.495 -4.262 2.813 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -5.226 -4.115 4.429 1.00 0.00 H new ATOM 1548 N GLY B 15 -0.363 -4.442 2.460 1.00 0.00 N ATOM 1549 CA GLY B 15 0.284 -4.011 1.218 1.00 0.00 C ATOM 1550 C GLY B 15 0.870 -5.163 0.398 1.00 0.00 C ATOM 1551 O GLY B 15 0.999 -5.019 -0.811 1.00 0.00 O ATOM 0 H GLY B 15 0.164 -4.226 3.306 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -0.442 -3.475 0.607 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.080 -3.306 1.459 1.00 0.00 H new ATOM 1555 N ARG B 16 1.142 -6.323 1.007 1.00 0.00 N ATOM 1556 CA ARG B 16 1.705 -7.536 0.376 1.00 0.00 C ATOM 1557 C ARG B 16 0.834 -8.125 -0.742 1.00 0.00 C ATOM 1558 O ARG B 16 1.308 -8.970 -1.510 1.00 0.00 O ATOM 1559 CB ARG B 16 1.916 -8.624 1.453 1.00 0.00 C ATOM 1560 CG ARG B 16 3.377 -8.824 1.873 1.00 0.00 C ATOM 1561 CD ARG B 16 4.237 -9.465 0.776 1.00 0.00 C ATOM 1562 NE ARG B 16 3.769 -10.823 0.417 1.00 0.00 N ATOM 1563 CZ ARG B 16 4.522 -11.867 0.088 1.00 0.00 C ATOM 1564 NH1 ARG B 16 5.833 -11.832 0.193 1.00 0.00 N ATOM 1565 NH2 ARG B 16 3.971 -12.982 -0.342 1.00 0.00 N ATOM 0 H ARG B 16 0.969 -6.454 2.004 1.00 0.00 H new ATOM 0 HA ARG B 16 2.645 -7.226 -0.081 1.00 0.00 H new ATOM 0 HB2 ARG B 16 1.330 -8.364 2.334 1.00 0.00 H new ATOM 0 HB3 ARG B 16 1.526 -9.570 1.078 1.00 0.00 H new ATOM 0 HG2 ARG B 16 3.806 -7.859 2.145 1.00 0.00 H new ATOM 0 HG3 ARG B 16 3.410 -9.450 2.764 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.222 -8.832 -0.111 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.272 -9.517 1.113 1.00 0.00 H new ATOM 0 HE ARG B 16 2.760 -10.973 0.423 1.00 0.00 H new ATOM 0 HH11 ARG B 16 6.295 -10.989 0.534 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.387 -12.648 -0.066 1.00 0.00 H new ATOM 0 HH21 ARG B 16 2.957 -13.051 -0.425 1.00 0.00 H new ATOM 0 HH22 ARG B 16 4.558 -13.778 -0.592 1.00 0.00 H new ATOM 1579 N ALA B 17 -0.445 -7.747 -0.777 1.00 0.00 N ATOM 1580 CA ALA B 17 -1.394 -8.164 -1.796 1.00 0.00 C ATOM 1581 C ALA B 17 -2.074 -6.994 -2.539 1.00 0.00 C ATOM 1582 O ALA B 17 -2.739 -7.241 -3.540 1.00 0.00 O ATOM 1583 CB ALA B 17 -2.342 -9.161 -1.122 1.00 0.00 C ATOM 0 H ALA B 17 -0.854 -7.127 -0.078 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.884 -8.658 -2.623 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -3.079 -9.508 -1.846 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -1.771 -10.011 -0.749 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -2.851 -8.674 -0.291 1.00 0.00 H new ATOM 1589 N LEU B 18 -1.877 -5.738 -2.111 1.00 0.00 N ATOM 1590 CA LEU B 18 -2.249 -4.548 -2.903 1.00 0.00 C ATOM 1591 C LEU B 18 -1.101 -4.137 -3.854 1.00 0.00 C ATOM 1592 O LEU B 18 -1.364 -3.728 -4.982 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.654 -3.389 -1.959 1.00 0.00 C ATOM 1594 CG LEU B 18 -4.142 -3.431 -1.526 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -4.320 -2.894 -0.102 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -5.052 -2.603 -2.455 1.00 0.00 C ATOM 0 H LEU B 18 -1.457 -5.515 -1.209 1.00 0.00 H new ATOM 0 HA LEU B 18 -3.109 -4.793 -3.526 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -2.025 -3.419 -1.070 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.456 -2.440 -2.457 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.433 -4.480 -1.580 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.374 -2.936 0.174 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.739 -3.502 0.591 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.974 -1.861 -0.057 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -6.083 -2.667 -2.106 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.730 -1.562 -2.446 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.988 -2.994 -3.470 1.00 0.00 H new ATOM 1608 N ALA B 19 0.158 -4.263 -3.420 1.00 0.00 N ATOM 1609 CA ALA B 19 1.345 -3.873 -4.184 1.00 0.00 C ATOM 1610 C ALA B 19 1.892 -5.040 -5.016 1.00 0.00 C ATOM 1611 O ALA B 19 2.870 -5.687 -4.646 1.00 0.00 O ATOM 1612 CB ALA B 19 2.363 -3.293 -3.199 1.00 0.00 C ATOM 0 H ALA B 19 0.384 -4.649 -2.503 1.00 0.00 H new ATOM 0 HA ALA B 19 1.096 -3.108 -4.919 1.00 0.00 H new ATOM 0 HB1 ALA B 19 3.261 -2.992 -3.739 1.00 0.00 H new ATOM 0 HB2 ALA B 19 1.932 -2.425 -2.699 1.00 0.00 H new ATOM 0 HB3 ALA B 19 2.622 -4.048 -2.456 1.00 0.00 H new ATOM 1618 N ASP B 20 1.221 -5.308 -6.134 1.00 0.00 N ATOM 1619 CA ASP B 20 1.447 -6.466 -6.995 1.00 0.00 C ATOM 1620 C ASP B 20 0.802 -6.275 -8.386 1.00 0.00 C ATOM 1621 O ASP B 20 -0.347 -5.812 -8.450 1.00 0.00 O ATOM 1622 CB ASP B 20 0.862 -7.703 -6.303 1.00 0.00 C ATOM 1623 CG ASP B 20 0.803 -8.914 -7.234 1.00 0.00 C ATOM 1624 OD1 ASP B 20 -0.175 -9.053 -8.004 1.00 0.00 O ATOM 1625 OD2 ASP B 20 1.704 -9.764 -7.103 1.00 0.00 O ATOM 0 H ASP B 20 0.477 -4.701 -6.478 1.00 0.00 H new ATOM 0 HA ASP B 20 2.518 -6.589 -7.153 1.00 0.00 H new ATOM 0 HB2 ASP B 20 1.466 -7.948 -5.430 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.141 -7.475 -5.943 1.00 0.00 H new ATOM 1630 N PRO B 21 1.486 -6.683 -9.480 1.00 0.00 N ATOM 1631 CA PRO B 21 1.092 -6.444 -10.876 1.00 0.00 C ATOM 1632 C PRO B 21 -0.347 -6.855 -11.199 1.00 0.00 C ATOM 1633 O PRO B 21 -1.098 -6.086 -11.798 1.00 0.00 O ATOM 1634 CB PRO B 21 2.071 -7.287 -11.718 1.00 0.00 C ATOM 1635 CG PRO B 21 2.523 -8.370 -10.732 1.00 0.00 C ATOM 1636 CD PRO B 21 2.690 -7.509 -9.490 1.00 0.00 C ATOM 0 HA PRO B 21 1.132 -5.375 -11.087 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.585 -7.716 -12.594 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.910 -6.692 -12.078 1.00 0.00 H new ATOM 0 HG2 PRO B 21 1.780 -9.157 -10.602 1.00 0.00 H new ATOM 0 HG3 PRO B 21 3.451 -8.855 -11.036 1.00 0.00 H new ATOM 0 HD2 PRO B 21 2.767 -8.117 -8.588 1.00 0.00 H new ATOM 0 HD3 PRO B 21 3.593 -6.901 -9.542 1.00 0.00 H new ATOM 1644 N THR B 22 -0.729 -8.084 -10.834 1.00 0.00 N ATOM 1645 CA THR B 22 -2.019 -8.647 -11.240 1.00 0.00 C ATOM 1646 C THR B 22 -3.080 -8.355 -10.194 1.00 0.00 C ATOM 1647 O THR B 22 -4.238 -8.153 -10.550 1.00 0.00 O ATOM 1648 CB THR B 22 -1.894 -10.141 -11.554 1.00 0.00 C ATOM 1649 OG1 THR B 22 -0.880 -10.287 -12.517 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.174 -10.713 -12.164 1.00 0.00 C ATOM 0 H THR B 22 -0.162 -8.707 -10.258 1.00 0.00 H new ATOM 0 HA THR B 22 -2.338 -8.163 -12.163 1.00 0.00 H new ATOM 0 HB THR B 22 -1.685 -10.668 -10.623 1.00 0.00 H new ATOM 0 HG1 THR B 22 -0.774 -11.236 -12.739 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.036 -11.775 -12.369 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.000 -10.583 -11.465 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.399 -10.190 -13.093 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.728 -8.300 -8.908 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.698 -8.069 -7.840 1.00 0.00 C ATOM 1660 C ARG B 23 -4.275 -6.652 -7.863 1.00 0.00 C ATOM 1661 O ARG B 23 -5.479 -6.546 -7.650 1.00 0.00 O ATOM 1662 CB ARG B 23 -3.132 -8.486 -6.483 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.136 -10.021 -6.381 1.00 0.00 C ATOM 1664 CD ARG B 23 -2.395 -10.543 -5.145 1.00 0.00 C ATOM 1665 NE ARG B 23 -0.943 -10.626 -5.360 1.00 0.00 N ATOM 1666 CZ ARG B 23 -0.041 -10.858 -4.414 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -0.366 -11.118 -3.175 1.00 0.00 N ATOM 1668 NH2 ARG B 23 1.235 -10.830 -4.683 1.00 0.00 N ATOM 0 H ARG B 23 -1.769 -8.414 -8.581 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.556 -8.715 -8.025 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.117 -8.105 -6.366 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -3.729 -8.055 -5.679 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.167 -10.375 -6.356 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -2.677 -10.440 -7.276 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -2.598 -9.887 -4.298 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -2.779 -11.529 -4.883 1.00 0.00 H new ATOM 0 HE ARG B 23 -0.601 -10.495 -6.312 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -1.348 -11.149 -2.901 1.00 0.00 H new ATOM 0 HH12 ARG B 23 0.362 -11.290 -2.482 1.00 0.00 H new ATOM 0 HH21 ARG B 23 1.552 -10.628 -5.631 1.00 0.00 H new ATOM 0 HH22 ARG B 23 1.916 -11.010 -3.945 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.522 -5.612 -8.244 1.00 0.00 N ATOM 1683 CA CYS B 24 -4.109 -4.284 -8.507 1.00 0.00 C ATOM 1684 C CYS B 24 -5.237 -4.386 -9.553 1.00 0.00 C ATOM 1685 O CYS B 24 -6.403 -4.106 -9.242 1.00 0.00 O ATOM 1686 CB CYS B 24 -3.004 -3.318 -8.958 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.746 -1.666 -9.123 1.00 0.00 S ATOM 0 H CYS B 24 -2.512 -5.660 -8.377 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.554 -3.895 -7.591 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -2.191 -3.301 -8.232 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.577 -3.642 -9.907 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.900 -0.866 -9.701 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.904 -4.951 -10.725 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.850 -5.295 -11.798 1.00 0.00 C ATOM 1695 C ARG B 25 -7.076 -6.058 -11.277 1.00 0.00 C ATOM 1696 O ARG B 25 -8.196 -5.627 -11.528 1.00 0.00 O ATOM 1697 CB ARG B 25 -5.136 -6.074 -12.921 1.00 0.00 C ATOM 1698 CG ARG B 25 -4.276 -5.173 -13.813 1.00 0.00 C ATOM 1699 CD ARG B 25 -3.630 -5.932 -14.983 1.00 0.00 C ATOM 1700 NE ARG B 25 -2.825 -5.010 -15.794 1.00 0.00 N ATOM 1701 CZ ARG B 25 -1.998 -5.297 -16.788 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -1.894 -6.488 -17.335 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -1.236 -4.352 -17.283 1.00 0.00 N ATOM 0 H ARG B 25 -3.940 -5.188 -10.959 1.00 0.00 H new ATOM 0 HA ARG B 25 -6.224 -4.359 -12.213 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.507 -6.846 -12.478 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.880 -6.582 -13.535 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -4.893 -4.365 -14.207 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -3.494 -4.712 -13.209 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -3.002 -6.738 -14.603 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -4.402 -6.393 -15.599 1.00 0.00 H new ATOM 0 HE ARG B 25 -2.914 -4.021 -15.562 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -2.471 -7.257 -16.995 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -1.236 -6.643 -18.099 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -1.284 -3.407 -16.903 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -0.595 -4.562 -18.049 1.00 0.00 H new ATOM 1717 N ILE B 26 -6.899 -7.153 -10.521 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.015 -7.893 -9.880 1.00 0.00 C ATOM 1719 C ILE B 26 -8.917 -6.955 -9.091 1.00 0.00 C ATOM 1720 O ILE B 26 -10.120 -6.913 -9.311 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.553 -9.030 -8.921 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -6.672 -10.052 -9.661 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -8.800 -9.657 -8.256 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -6.785 -11.518 -9.241 1.00 0.00 C ATOM 0 H ILE B 26 -5.981 -7.556 -10.333 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.554 -8.348 -10.711 1.00 0.00 H new ATOM 0 HB ILE B 26 -6.922 -8.626 -8.129 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -6.904 -9.988 -10.724 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -5.632 -9.748 -9.543 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.490 -10.455 -7.582 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.335 -8.893 -7.692 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.456 -10.066 -9.025 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -6.109 -12.123 -9.845 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -6.518 -11.617 -8.189 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -7.809 -11.861 -9.389 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.326 -6.269 -8.123 1.00 0.00 N ATOM 1737 CA LEU B 27 -9.040 -5.482 -7.119 1.00 0.00 C ATOM 1738 C LEU B 27 -9.813 -4.322 -7.769 1.00 0.00 C ATOM 1739 O LEU B 27 -10.972 -4.101 -7.422 1.00 0.00 O ATOM 1740 CB LEU B 27 -8.035 -5.006 -6.051 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.432 -6.088 -5.128 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.323 -5.450 -4.277 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.489 -6.678 -4.183 1.00 0.00 C ATOM 0 H LEU B 27 -7.313 -6.241 -8.008 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.791 -6.100 -6.628 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -7.215 -4.498 -6.559 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.531 -4.264 -5.425 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.041 -6.890 -5.755 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.889 -6.204 -3.620 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.548 -5.048 -4.930 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.744 -4.644 -3.676 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.028 -7.436 -3.549 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.902 -5.885 -3.559 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.288 -7.132 -4.769 1.00 0.00 H new ATOM 1755 N VAL B 28 -9.216 -3.629 -8.744 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.873 -2.523 -9.470 1.00 0.00 C ATOM 1757 C VAL B 28 -10.897 -3.025 -10.499 1.00 0.00 C ATOM 1758 O VAL B 28 -11.870 -2.331 -10.778 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.844 -1.554 -10.100 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -8.184 -2.085 -11.381 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -9.462 -0.173 -10.377 1.00 0.00 C ATOM 0 H VAL B 28 -8.263 -3.815 -9.057 1.00 0.00 H new ATOM 0 HA VAL B 28 -10.434 -1.954 -8.729 1.00 0.00 H new ATOM 0 HB VAL B 28 -8.058 -1.463 -9.351 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -7.477 -1.347 -11.759 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.657 -3.013 -11.161 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -8.950 -2.273 -12.134 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.710 0.480 -10.819 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -10.299 -0.281 -11.066 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.815 0.262 -9.442 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.721 -4.244 -11.023 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.735 -4.905 -11.828 1.00 0.00 C ATOM 1773 C ALA B 29 -12.908 -5.379 -10.957 1.00 0.00 C ATOM 1774 O ALA B 29 -14.050 -5.213 -11.365 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.066 -6.043 -12.606 1.00 0.00 C ATOM 0 H ALA B 29 -9.870 -4.793 -10.897 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.168 -4.207 -12.545 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.811 -6.553 -13.217 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -10.286 -5.635 -13.249 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.624 -6.752 -11.906 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.684 -5.897 -9.741 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.743 -6.438 -8.892 1.00 0.00 C ATOM 1783 C LEU B 30 -14.764 -5.422 -8.411 1.00 0.00 C ATOM 1784 O LEU B 30 -15.898 -5.800 -8.141 1.00 0.00 O ATOM 1785 CB LEU B 30 -13.108 -7.074 -7.673 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.766 -8.426 -7.400 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -13.413 -9.527 -8.410 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.171 -8.768 -6.062 1.00 0.00 C ATOM 0 H LEU B 30 -11.756 -5.950 -9.321 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.285 -7.150 -9.514 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -12.038 -7.205 -7.834 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -13.223 -6.421 -6.808 1.00 0.00 H new ATOM 0 HG LEU B 30 -14.853 -8.364 -7.455 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -13.925 -10.450 -8.136 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -13.727 -9.220 -9.408 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -12.336 -9.694 -8.404 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.556 -9.731 -5.728 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -12.086 -8.822 -6.149 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -13.439 -7.999 -5.337 1.00 0.00 H new ATOM 1800 N LEU B 31 -14.342 -4.164 -8.318 1.00 0.00 N ATOM 1801 CA LEU B 31 -15.190 -2.983 -8.110 1.00 0.00 C ATOM 1802 C LEU B 31 -16.438 -2.987 -9.033 1.00 0.00 C ATOM 1803 O LEU B 31 -17.469 -2.451 -8.641 1.00 0.00 O ATOM 1804 CB LEU B 31 -14.296 -1.727 -8.249 1.00 0.00 C ATOM 1805 CG LEU B 31 -13.764 -1.140 -6.925 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -12.769 -0.015 -7.233 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.905 -0.565 -6.074 1.00 0.00 C ATOM 0 H LEU B 31 -13.353 -3.924 -8.388 1.00 0.00 H new ATOM 0 HA LEU B 31 -15.616 -2.989 -7.107 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -13.445 -1.976 -8.883 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -14.864 -0.954 -8.767 1.00 0.00 H new ATOM 0 HG LEU B 31 -13.280 -1.943 -6.369 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -12.391 0.402 -6.300 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -11.938 -0.413 -7.815 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -13.270 0.767 -7.804 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -14.499 -0.159 -5.148 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -15.408 0.228 -6.628 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -15.619 -1.355 -5.841 1.00 0.00 H new ATOM 1819 N ASP B 32 -16.352 -3.649 -10.192 1.00 0.00 N ATOM 1820 CA ASP B 32 -17.455 -4.018 -11.106 1.00 0.00 C ATOM 1821 C ASP B 32 -17.649 -5.555 -11.172 1.00 0.00 C ATOM 1822 O ASP B 32 -18.756 -6.081 -11.257 1.00 0.00 O ATOM 1823 CB ASP B 32 -17.055 -3.495 -12.500 1.00 0.00 C ATOM 1824 CG ASP B 32 -17.964 -3.965 -13.643 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -17.658 -5.030 -14.233 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -18.925 -3.230 -13.954 1.00 0.00 O ATOM 0 H ASP B 32 -15.450 -3.966 -10.547 1.00 0.00 H new ATOM 0 HA ASP B 32 -18.393 -3.589 -10.755 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -17.054 -2.405 -12.478 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -16.033 -3.810 -12.713 1.00 0.00 H new ATOM 1831 N GLY B 33 -16.543 -6.285 -11.014 1.00 0.00 N ATOM 1832 CA GLY B 33 -16.312 -7.701 -11.284 1.00 0.00 C ATOM 1833 C GLY B 33 -16.761 -8.648 -10.190 1.00 0.00 C ATOM 1834 O GLY B 33 -16.398 -9.821 -10.187 1.00 0.00 O ATOM 0 H GLY B 33 -15.695 -5.847 -10.654 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -16.827 -7.967 -12.207 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -15.247 -7.852 -11.459 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.581 -8.161 -9.274 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.345 -8.942 -8.294 1.00 0.00 C ATOM 1840 C VAL B 34 -19.347 -9.967 -8.889 1.00 0.00 C ATOM 1841 O VAL B 34 -20.359 -10.286 -8.264 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.036 -8.022 -7.271 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.037 -7.283 -6.383 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -20.051 -7.036 -7.874 1.00 0.00 C ATOM 0 H VAL B 34 -17.746 -7.159 -9.182 1.00 0.00 H new ATOM 0 HA VAL B 34 -17.597 -9.554 -7.790 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.613 -8.709 -6.652 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.576 -6.648 -5.680 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.436 -8.006 -5.832 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.386 -6.667 -7.003 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.486 -6.430 -7.079 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.547 -6.387 -8.590 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.840 -7.591 -8.381 1.00 0.00 H new ATOM 1854 N CYS B 35 -19.077 -10.501 -10.086 1.00 0.00 N ATOM 1855 CA CYS B 35 -19.909 -11.476 -10.785 1.00 0.00 C ATOM 1856 C CYS B 35 -19.591 -12.913 -10.338 1.00 0.00 C ATOM 1857 O CYS B 35 -20.369 -13.511 -9.611 1.00 0.00 O ATOM 1858 CB CYS B 35 -19.807 -11.278 -12.318 1.00 0.00 C ATOM 1859 SG CYS B 35 -19.300 -9.607 -12.836 1.00 0.00 S ATOM 0 H CYS B 35 -18.239 -10.253 -10.611 1.00 0.00 H new ATOM 0 HA CYS B 35 -20.950 -11.305 -10.513 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -19.094 -12.000 -12.717 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -20.775 -11.505 -12.765 1.00 0.00 H new ATOM 0 HG CYS B 35 -19.245 -9.553 -14.134 1.00 0.00 H new ATOM 1865 N TYR B 36 -18.449 -13.486 -10.740 1.00 0.00 N ATOM 1866 CA TYR B 36 -18.194 -14.924 -10.544 1.00 0.00 C ATOM 1867 C TYR B 36 -16.706 -15.321 -10.582 1.00 0.00 C ATOM 1868 O TYR B 36 -15.905 -14.594 -11.179 1.00 0.00 O ATOM 1869 CB TYR B 36 -19.030 -15.736 -11.564 1.00 0.00 C ATOM 1870 CG TYR B 36 -18.874 -15.363 -13.024 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -17.887 -15.974 -13.819 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -19.738 -14.407 -13.590 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -17.727 -15.587 -15.163 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -19.568 -13.995 -14.924 1.00 0.00 C ATOM 1875 CZ TYR B 36 -18.548 -14.575 -15.711 1.00 0.00 C ATOM 1876 OH TYR B 36 -18.334 -14.155 -16.986 1.00 0.00 O ATOM 0 H TYR B 36 -17.690 -12.982 -11.200 1.00 0.00 H new ATOM 0 HA TYR B 36 -18.509 -15.165 -9.529 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -18.772 -16.789 -11.453 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -20.082 -15.635 -11.298 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -17.252 -16.740 -13.398 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -20.537 -13.987 -12.996 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -16.976 -16.064 -15.776 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -20.214 -13.239 -15.345 1.00 0.00 H new ATOM 0 HH TYR B 36 -18.982 -13.456 -17.213 1.00 0.00 H new ATOM 1886 N PRO B 37 -16.306 -16.464 -9.980 1.00 0.00 N ATOM 1887 CA PRO B 37 -14.944 -16.974 -10.087 1.00 0.00 C ATOM 1888 C PRO B 37 -14.600 -17.171 -11.562 1.00 0.00 C ATOM 1889 O PRO B 37 -15.306 -17.869 -12.284 1.00 0.00 O ATOM 1890 CB PRO B 37 -14.911 -18.287 -9.292 1.00 0.00 C ATOM 1891 CG PRO B 37 -16.370 -18.730 -9.252 1.00 0.00 C ATOM 1892 CD PRO B 37 -17.117 -17.401 -9.209 1.00 0.00 C ATOM 0 HA PRO B 37 -14.201 -16.288 -9.682 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -14.281 -19.032 -9.778 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -14.512 -18.137 -8.289 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -16.640 -19.319 -10.129 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -16.584 -19.344 -8.377 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -18.115 -17.499 -9.637 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -17.243 -17.056 -8.183 1.00 0.00 H new ATOM 1900 N GLY B 38 -13.547 -16.494 -12.026 1.00 0.00 N ATOM 1901 CA GLY B 38 -13.154 -16.495 -13.434 1.00 0.00 C ATOM 1902 C GLY B 38 -13.791 -15.393 -14.285 1.00 0.00 C ATOM 1903 O GLY B 38 -13.360 -15.233 -15.421 1.00 0.00 O ATOM 0 H GLY B 38 -12.941 -15.928 -11.432 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -12.070 -16.398 -13.493 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -13.411 -17.462 -13.867 1.00 0.00 H new ATOM 1907 N GLN B 39 -14.728 -14.579 -13.772 1.00 0.00 N ATOM 1908 CA GLN B 39 -15.240 -13.402 -14.505 1.00 0.00 C ATOM 1909 C GLN B 39 -14.107 -12.436 -14.874 1.00 0.00 C ATOM 1910 O GLN B 39 -14.120 -11.852 -15.953 1.00 0.00 O ATOM 1911 CB GLN B 39 -16.348 -12.673 -13.728 1.00 0.00 C ATOM 1912 CG GLN B 39 -15.888 -11.705 -12.625 1.00 0.00 C ATOM 1913 CD GLN B 39 -15.364 -10.348 -13.111 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -14.321 -9.883 -12.687 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.032 -9.672 -14.016 1.00 0.00 N ATOM 0 H GLN B 39 -15.149 -14.712 -12.852 1.00 0.00 H new ATOM 0 HA GLN B 39 -15.682 -13.776 -15.429 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -16.954 -12.115 -14.441 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -16.997 -13.422 -13.276 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -16.724 -11.530 -11.948 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -15.104 -12.190 -12.044 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -16.908 -10.042 -14.385 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -15.675 -8.777 -14.350 1.00 0.00 H new ATOM 1924 N LEU B 40 -13.109 -12.327 -13.988 1.00 0.00 N ATOM 1925 CA LEU B 40 -11.923 -11.494 -14.155 1.00 0.00 C ATOM 1926 C LEU B 40 -11.158 -11.840 -15.431 1.00 0.00 C ATOM 1927 O LEU B 40 -10.450 -11.000 -15.964 1.00 0.00 O ATOM 1928 CB LEU B 40 -11.003 -11.702 -12.939 1.00 0.00 C ATOM 1929 CG LEU B 40 -11.544 -11.094 -11.635 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -10.895 -11.812 -10.449 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -11.264 -9.585 -11.592 1.00 0.00 C ATOM 0 H LEU B 40 -13.110 -12.837 -13.105 1.00 0.00 H new ATOM 0 HA LEU B 40 -12.241 -10.454 -14.232 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.848 -12.771 -12.792 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -10.028 -11.265 -13.155 1.00 0.00 H new ATOM 0 HG LEU B 40 -12.625 -11.227 -11.584 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -11.271 -11.389 -9.517 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -11.138 -12.874 -10.489 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -9.813 -11.685 -10.494 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -11.653 -9.169 -10.663 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -10.189 -9.413 -11.645 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -11.751 -9.100 -12.438 1.00 0.00 H new ATOM 1943 N ALA B 41 -11.287 -13.070 -15.928 1.00 0.00 N ATOM 1944 CA ALA B 41 -10.498 -13.526 -17.074 1.00 0.00 C ATOM 1945 C ALA B 41 -10.794 -12.683 -18.336 1.00 0.00 C ATOM 1946 O ALA B 41 -9.892 -12.409 -19.123 1.00 0.00 O ATOM 1947 CB ALA B 41 -10.772 -15.018 -17.303 1.00 0.00 C ATOM 0 H ALA B 41 -11.930 -13.769 -15.556 1.00 0.00 H new ATOM 0 HA ALA B 41 -9.438 -13.391 -16.861 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -10.189 -15.368 -18.155 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -10.489 -15.581 -16.413 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -11.833 -15.166 -17.504 1.00 0.00 H new ATOM 1953 N ALA B 42 -12.039 -12.203 -18.484 1.00 0.00 N ATOM 1954 CA ALA B 42 -12.420 -11.259 -19.533 1.00 0.00 C ATOM 1955 C ALA B 42 -11.936 -9.835 -19.214 1.00 0.00 C ATOM 1956 O ALA B 42 -11.285 -9.221 -20.053 1.00 0.00 O ATOM 1957 CB ALA B 42 -13.942 -11.329 -19.717 1.00 0.00 C ATOM 0 H ALA B 42 -12.812 -12.465 -17.871 1.00 0.00 H new ATOM 0 HA ALA B 42 -11.935 -11.532 -20.470 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -14.247 -10.631 -20.497 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -14.228 -12.341 -20.004 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -14.434 -11.065 -18.781 1.00 0.00 H new ATOM 1963 N HIS B 43 -12.188 -9.333 -17.998 1.00 0.00 N ATOM 1964 CA HIS B 43 -11.741 -7.997 -17.563 1.00 0.00 C ATOM 1965 C HIS B 43 -10.217 -7.770 -17.678 1.00 0.00 C ATOM 1966 O HIS B 43 -9.765 -6.647 -17.900 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.162 -7.788 -16.098 1.00 0.00 C ATOM 1968 CG HIS B 43 -13.591 -7.375 -15.867 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.470 -6.896 -16.838 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -14.148 -7.213 -14.634 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -15.536 -6.440 -16.161 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -15.374 -6.605 -14.838 1.00 0.00 N ATOM 0 H HIS B 43 -12.709 -9.841 -17.284 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.213 -7.279 -18.234 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -11.982 -8.716 -15.555 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.512 -7.031 -15.660 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -13.718 -7.502 -13.686 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -16.409 -5.999 -16.620 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -16.037 -6.331 -14.113 1.00 0.00 H new ATOM 1980 N LEU B 44 -9.429 -8.832 -17.477 1.00 0.00 N ATOM 1981 CA LEU B 44 -7.966 -8.782 -17.407 1.00 0.00 C ATOM 1982 C LEU B 44 -7.284 -9.302 -18.679 1.00 0.00 C ATOM 1983 O LEU B 44 -6.129 -8.960 -18.900 1.00 0.00 O ATOM 1984 CB LEU B 44 -7.474 -9.563 -16.160 1.00 0.00 C ATOM 1985 CG LEU B 44 -8.087 -9.130 -14.808 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -7.305 -9.639 -13.599 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.284 -7.612 -14.655 1.00 0.00 C ATOM 0 H LEU B 44 -9.802 -9.774 -17.356 1.00 0.00 H new ATOM 0 HA LEU B 44 -7.683 -7.733 -17.319 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.686 -10.621 -16.311 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.391 -9.461 -16.095 1.00 0.00 H new ATOM 0 HG LEU B 44 -9.070 -9.600 -14.829 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.789 -9.299 -12.683 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -7.281 -10.729 -13.614 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.286 -9.253 -13.636 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.718 -7.398 -13.678 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.321 -7.110 -14.742 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.953 -7.251 -15.436 1.00 0.00 H new ATOM 1999 N GLY B 45 -7.942 -10.154 -19.474 1.00 0.00 N ATOM 2000 CA GLY B 45 -7.344 -10.856 -20.621 1.00 0.00 C ATOM 2001 C GLY B 45 -6.485 -12.065 -20.236 1.00 0.00 C ATOM 2002 O GLY B 45 -6.052 -12.814 -21.114 1.00 0.00 O ATOM 0 H GLY B 45 -8.927 -10.381 -19.337 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -8.141 -11.187 -21.286 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -6.731 -10.153 -21.184 1.00 0.00 H new ATOM 2006 N LEU B 46 -6.251 -12.280 -18.939 1.00 0.00 N ATOM 2007 CA LEU B 46 -5.470 -13.402 -18.413 1.00 0.00 C ATOM 2008 C LEU B 46 -6.410 -14.565 -18.069 1.00 0.00 C ATOM 2009 O LEU B 46 -7.605 -14.365 -17.848 1.00 0.00 O ATOM 2010 CB LEU B 46 -4.617 -12.942 -17.223 1.00 0.00 C ATOM 2011 CG LEU B 46 -3.321 -12.203 -17.642 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -3.534 -10.880 -18.391 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -2.518 -11.876 -16.383 1.00 0.00 C ATOM 0 H LEU B 46 -6.608 -11.664 -18.208 1.00 0.00 H new ATOM 0 HA LEU B 46 -4.774 -13.765 -19.169 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -5.213 -12.284 -16.591 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -4.352 -13.810 -16.619 1.00 0.00 H new ATOM 0 HG LEU B 46 -2.812 -12.880 -18.328 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -2.567 -10.443 -18.639 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -4.094 -11.067 -19.308 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -4.093 -10.190 -17.759 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -1.602 -11.355 -16.661 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -3.112 -11.240 -15.727 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -2.266 -12.800 -15.862 1.00 0.00 H new ATOM 2025 N THR B 47 -5.904 -15.797 -18.039 1.00 0.00 N ATOM 2026 CA THR B 47 -6.755 -16.988 -17.934 1.00 0.00 C ATOM 2027 C THR B 47 -7.362 -17.126 -16.547 1.00 0.00 C ATOM 2028 O THR B 47 -6.798 -16.707 -15.533 1.00 0.00 O ATOM 2029 CB THR B 47 -6.040 -18.278 -18.358 1.00 0.00 C ATOM 2030 OG1 THR B 47 -4.957 -18.551 -17.507 1.00 0.00 O ATOM 2031 CG2 THR B 47 -5.539 -18.222 -19.792 1.00 0.00 C ATOM 0 H THR B 47 -4.905 -16.000 -18.086 1.00 0.00 H new ATOM 0 HA THR B 47 -7.568 -16.837 -18.644 1.00 0.00 H new ATOM 0 HB THR B 47 -6.781 -19.075 -18.287 1.00 0.00 H new ATOM 0 HG1 THR B 47 -4.516 -19.378 -17.794 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.041 -19.159 -20.040 1.00 0.00 H new ATOM 0 HG22 THR B 47 -6.382 -18.069 -20.466 1.00 0.00 H new ATOM 0 HG23 THR B 47 -4.834 -17.397 -19.899 1.00 0.00 H new ATOM 2039 N ARG B 48 -8.504 -17.815 -16.500 1.00 0.00 N ATOM 2040 CA ARG B 48 -9.136 -18.263 -15.250 1.00 0.00 C ATOM 2041 C ARG B 48 -8.190 -19.133 -14.402 1.00 0.00 C ATOM 2042 O ARG B 48 -8.316 -19.162 -13.182 1.00 0.00 O ATOM 2043 CB ARG B 48 -10.465 -18.986 -15.551 1.00 0.00 C ATOM 2044 CG ARG B 48 -10.300 -20.185 -16.503 1.00 0.00 C ATOM 2045 CD ARG B 48 -11.630 -20.862 -16.867 1.00 0.00 C ATOM 2046 NE ARG B 48 -11.429 -21.717 -18.050 1.00 0.00 N ATOM 2047 CZ ARG B 48 -11.459 -21.281 -19.305 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -12.090 -20.184 -19.650 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -10.820 -21.935 -20.246 1.00 0.00 N ATOM 0 H ARG B 48 -9.024 -18.082 -17.336 1.00 0.00 H new ATOM 0 HA ARG B 48 -9.357 -17.380 -14.651 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -10.904 -19.331 -14.615 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -11.166 -18.276 -15.989 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -9.810 -19.849 -17.417 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -9.642 -20.920 -16.039 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -11.990 -21.459 -16.029 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -12.391 -20.109 -17.072 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.255 -22.710 -17.895 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -12.580 -19.634 -18.944 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -12.091 -19.881 -20.624 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -10.298 -22.781 -20.015 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -10.845 -21.598 -21.208 1.00 0.00 H new ATOM 2063 N SER B 49 -7.215 -19.795 -15.027 1.00 0.00 N ATOM 2064 CA SER B 49 -6.106 -20.479 -14.353 1.00 0.00 C ATOM 2065 C SER B 49 -5.119 -19.459 -13.763 1.00 0.00 C ATOM 2066 O SER B 49 -4.949 -19.412 -12.548 1.00 0.00 O ATOM 2067 CB SER B 49 -5.382 -21.408 -15.344 1.00 0.00 C ATOM 2068 OG SER B 49 -6.292 -22.267 -16.011 1.00 0.00 O ATOM 0 H SER B 49 -7.172 -19.873 -16.043 1.00 0.00 H new ATOM 0 HA SER B 49 -6.511 -21.077 -13.536 1.00 0.00 H new ATOM 0 HB2 SER B 49 -4.841 -20.809 -16.077 1.00 0.00 H new ATOM 0 HB3 SER B 49 -4.641 -22.004 -14.811 1.00 0.00 H new ATOM 0 HG SER B 49 -5.802 -22.843 -16.634 1.00 0.00 H new ATOM 2074 N ASN B 50 -4.547 -18.581 -14.601 1.00 0.00 N ATOM 2075 CA ASN B 50 -3.587 -17.550 -14.204 1.00 0.00 C ATOM 2076 C ASN B 50 -4.130 -16.679 -13.058 1.00 0.00 C ATOM 2077 O ASN B 50 -3.539 -16.630 -11.978 1.00 0.00 O ATOM 2078 CB ASN B 50 -3.208 -16.707 -15.437 1.00 0.00 C ATOM 2079 CG ASN B 50 -2.293 -15.522 -15.125 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -2.612 -14.690 -14.288 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -1.145 -15.405 -15.768 1.00 0.00 N ATOM 0 H ASN B 50 -4.748 -18.572 -15.601 1.00 0.00 H new ATOM 0 HA ASN B 50 -2.688 -18.032 -13.819 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -2.716 -17.350 -16.166 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -4.120 -16.335 -15.904 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -0.525 -14.621 -15.566 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -0.879 -16.099 -16.466 1.00 0.00 H new ATOM 2088 N VAL B 51 -5.281 -16.023 -13.253 1.00 0.00 N ATOM 2089 CA VAL B 51 -5.836 -15.084 -12.265 1.00 0.00 C ATOM 2090 C VAL B 51 -6.191 -15.797 -10.940 1.00 0.00 C ATOM 2091 O VAL B 51 -6.196 -15.151 -9.894 1.00 0.00 O ATOM 2092 CB VAL B 51 -7.057 -14.350 -12.894 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -7.755 -13.380 -11.938 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -6.677 -13.511 -14.136 1.00 0.00 C ATOM 0 H VAL B 51 -5.851 -16.126 -14.092 1.00 0.00 H new ATOM 0 HA VAL B 51 -5.082 -14.340 -12.007 1.00 0.00 H new ATOM 0 HB VAL B 51 -7.725 -15.171 -13.156 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -8.595 -12.908 -12.448 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -8.120 -13.926 -11.068 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -7.049 -12.615 -11.616 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -7.568 -13.023 -14.532 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -5.944 -12.755 -13.854 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -6.251 -14.163 -14.899 1.00 0.00 H new ATOM 2104 N SER B 52 -6.408 -17.120 -10.931 1.00 0.00 N ATOM 2105 CA SER B 52 -6.715 -17.871 -9.696 1.00 0.00 C ATOM 2106 C SER B 52 -5.538 -17.964 -8.715 1.00 0.00 C ATOM 2107 O SER B 52 -5.751 -17.833 -7.510 1.00 0.00 O ATOM 2108 CB SER B 52 -7.256 -19.273 -9.995 1.00 0.00 C ATOM 2109 OG SER B 52 -8.557 -19.183 -10.542 1.00 0.00 O ATOM 0 H SER B 52 -6.377 -17.699 -11.770 1.00 0.00 H new ATOM 0 HA SER B 52 -7.493 -17.286 -9.205 1.00 0.00 H new ATOM 0 HB2 SER B 52 -6.594 -19.786 -10.693 1.00 0.00 H new ATOM 0 HB3 SER B 52 -7.277 -19.866 -9.081 1.00 0.00 H new ATOM 0 HG SER B 52 -8.523 -19.379 -11.502 1.00 0.00 H new ATOM 2115 N ASN B 53 -4.297 -18.091 -9.201 1.00 0.00 N ATOM 2116 CA ASN B 53 -3.092 -17.969 -8.364 1.00 0.00 C ATOM 2117 C ASN B 53 -3.045 -16.626 -7.638 1.00 0.00 C ATOM 2118 O ASN B 53 -2.858 -16.567 -6.425 1.00 0.00 O ATOM 2119 CB ASN B 53 -1.844 -18.154 -9.240 1.00 0.00 C ATOM 2120 CG ASN B 53 -1.554 -19.616 -9.556 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -2.038 -20.536 -8.916 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -0.732 -19.878 -10.552 1.00 0.00 N ATOM 0 H ASN B 53 -4.098 -18.281 -10.183 1.00 0.00 H new ATOM 0 HA ASN B 53 -3.121 -18.747 -7.601 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -1.976 -17.605 -10.172 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -0.983 -17.719 -8.733 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -0.504 -20.845 -10.784 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -0.324 -19.114 -11.091 1.00 0.00 H new ATOM 2129 N HIS B 54 -3.299 -15.557 -8.383 1.00 0.00 N ATOM 2130 CA HIS B 54 -3.348 -14.194 -7.867 1.00 0.00 C ATOM 2131 C HIS B 54 -4.491 -13.986 -6.838 1.00 0.00 C ATOM 2132 O HIS B 54 -4.318 -13.244 -5.867 1.00 0.00 O ATOM 2133 CB HIS B 54 -3.397 -13.273 -9.102 1.00 0.00 C ATOM 2134 CG HIS B 54 -2.243 -13.521 -10.054 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -2.291 -14.026 -11.340 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -0.917 -13.419 -9.740 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -1.032 -14.201 -11.771 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -0.155 -13.852 -10.822 1.00 0.00 N ATOM 0 H HIS B 54 -3.481 -15.615 -9.385 1.00 0.00 H new ATOM 0 HA HIS B 54 -2.465 -13.950 -7.276 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -4.339 -13.426 -9.629 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -3.379 -12.233 -8.777 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -0.522 -13.059 -8.801 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -0.764 -14.572 -12.749 1.00 0.00 H new ATOM 0 HE2 HIS B 54 0.862 -13.894 -10.880 1.00 0.00 H new ATOM 2146 N LEU B 55 -5.623 -14.696 -6.991 1.00 0.00 N ATOM 2147 CA LEU B 55 -6.736 -14.731 -6.029 1.00 0.00 C ATOM 2148 C LEU B 55 -6.452 -15.587 -4.794 1.00 0.00 C ATOM 2149 O LEU B 55 -6.977 -15.266 -3.733 1.00 0.00 O ATOM 2150 CB LEU B 55 -8.020 -15.273 -6.684 1.00 0.00 C ATOM 2151 CG LEU B 55 -8.669 -14.328 -7.707 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -9.623 -15.136 -8.592 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -9.437 -13.209 -6.990 1.00 0.00 C ATOM 0 H LEU B 55 -5.792 -15.278 -7.812 1.00 0.00 H new ATOM 0 HA LEU B 55 -6.862 -13.696 -5.712 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -7.789 -16.217 -7.178 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -8.746 -15.492 -5.901 1.00 0.00 H new ATOM 0 HG LEU B 55 -7.894 -13.870 -8.321 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -10.090 -14.475 -9.322 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -9.065 -15.915 -9.112 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -10.394 -15.594 -7.972 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -9.891 -12.548 -7.729 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -10.217 -13.645 -6.366 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -8.750 -12.638 -6.366 1.00 0.00 H new ATOM 2165 N SER B 56 -5.689 -16.673 -4.891 1.00 0.00 N ATOM 2166 CA SER B 56 -5.356 -17.478 -3.708 1.00 0.00 C ATOM 2167 C SER B 56 -4.718 -16.662 -2.579 1.00 0.00 C ATOM 2168 O SER B 56 -5.124 -16.841 -1.432 1.00 0.00 O ATOM 2169 CB SER B 56 -4.509 -18.692 -4.092 1.00 0.00 C ATOM 2170 OG SER B 56 -5.345 -19.666 -4.699 1.00 0.00 O ATOM 0 H SER B 56 -5.291 -17.017 -5.765 1.00 0.00 H new ATOM 0 HA SER B 56 -6.300 -17.842 -3.302 1.00 0.00 H new ATOM 0 HB2 SER B 56 -3.716 -18.396 -4.779 1.00 0.00 H new ATOM 0 HB3 SER B 56 -4.026 -19.109 -3.208 1.00 0.00 H new ATOM 0 HG SER B 56 -4.809 -20.447 -4.950 1.00 0.00 H new ATOM 2176 N CYS B 57 -3.838 -15.696 -2.878 1.00 0.00 N ATOM 2177 CA CYS B 57 -3.362 -14.779 -1.857 1.00 0.00 C ATOM 2178 C CYS B 57 -4.469 -13.814 -1.380 1.00 0.00 C ATOM 2179 O CYS B 57 -4.673 -13.618 -0.182 1.00 0.00 O ATOM 2180 CB CYS B 57 -2.185 -14.007 -2.442 1.00 0.00 C ATOM 2181 SG CYS B 57 -1.520 -12.931 -1.132 1.00 0.00 S ATOM 0 H CYS B 57 -3.451 -15.538 -3.808 1.00 0.00 H new ATOM 0 HA CYS B 57 -3.054 -15.344 -0.978 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -1.417 -14.693 -2.799 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -2.505 -13.413 -3.298 1.00 0.00 H new ATOM 2186 N LEU B 58 -5.177 -13.208 -2.338 1.00 0.00 N ATOM 2187 CA LEU B 58 -6.153 -12.137 -2.122 1.00 0.00 C ATOM 2188 C LEU B 58 -7.283 -12.570 -1.172 1.00 0.00 C ATOM 2189 O LEU B 58 -7.743 -11.771 -0.348 1.00 0.00 O ATOM 2190 CB LEU B 58 -6.679 -11.726 -3.518 1.00 0.00 C ATOM 2191 CG LEU B 58 -6.884 -10.219 -3.757 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -5.574 -9.443 -3.635 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -7.452 -10.055 -5.171 1.00 0.00 C ATOM 0 H LEU B 58 -5.082 -13.460 -3.322 1.00 0.00 H new ATOM 0 HA LEU B 58 -5.687 -11.284 -1.629 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -5.982 -12.099 -4.269 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -7.630 -12.231 -3.687 1.00 0.00 H new ATOM 0 HG LEU B 58 -7.564 -9.820 -3.004 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -5.761 -8.384 -3.810 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.163 -9.578 -2.635 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -4.862 -9.813 -4.373 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -7.612 -8.997 -5.379 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -6.748 -10.465 -5.896 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -8.401 -10.587 -5.246 1.00 0.00 H new ATOM 2205 N ARG B 59 -7.713 -13.835 -1.293 1.00 0.00 N ATOM 2206 CA ARG B 59 -8.749 -14.474 -0.470 1.00 0.00 C ATOM 2207 C ARG B 59 -8.225 -15.022 0.876 1.00 0.00 C ATOM 2208 O ARG B 59 -9.033 -15.486 1.674 1.00 0.00 O ATOM 2209 CB ARG B 59 -9.405 -15.617 -1.269 1.00 0.00 C ATOM 2210 CG ARG B 59 -10.072 -15.237 -2.613 1.00 0.00 C ATOM 2211 CD ARG B 59 -10.694 -16.452 -3.325 1.00 0.00 C ATOM 2212 NE ARG B 59 -9.707 -17.502 -3.661 1.00 0.00 N ATOM 2213 CZ ARG B 59 -9.378 -18.566 -2.929 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -9.993 -18.859 -1.797 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -8.406 -19.365 -3.327 1.00 0.00 N ATOM 0 H ARG B 59 -7.332 -14.467 -1.997 1.00 0.00 H new ATOM 0 HA ARG B 59 -9.475 -13.698 -0.227 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -8.644 -16.372 -1.469 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -10.159 -16.085 -0.636 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -10.845 -14.490 -2.433 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -9.330 -14.777 -3.266 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -11.468 -16.881 -2.688 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -11.183 -16.117 -4.240 1.00 0.00 H new ATOM 0 HE ARG B 59 -9.224 -17.400 -4.554 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -10.747 -18.262 -1.457 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -9.714 -19.682 -1.263 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -7.907 -19.168 -4.194 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -8.154 -20.179 -2.767 1.00 0.00 H new ATOM 2229 N GLY B 60 -6.908 -15.011 1.122 1.00 0.00 N ATOM 2230 CA GLY B 60 -6.267 -15.442 2.377 1.00 0.00 C ATOM 2231 C GLY B 60 -5.733 -14.294 3.243 1.00 0.00 C ATOM 2232 O GLY B 60 -5.855 -14.331 4.463 1.00 0.00 O ATOM 0 H GLY B 60 -6.233 -14.690 0.428 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -6.987 -16.016 2.960 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -5.443 -16.114 2.138 1.00 0.00 H new ATOM 2236 N CYS B 61 -5.175 -13.256 2.613 1.00 0.00 N ATOM 2237 CA CYS B 61 -4.758 -12.012 3.257 1.00 0.00 C ATOM 2238 C CYS B 61 -5.968 -11.115 3.647 1.00 0.00 C ATOM 2239 O CYS B 61 -5.831 -10.155 4.409 1.00 0.00 O ATOM 2240 CB CYS B 61 -3.727 -11.349 2.318 1.00 0.00 C ATOM 2241 SG CYS B 61 -2.046 -12.052 2.439 1.00 0.00 S ATOM 0 H CYS B 61 -4.996 -13.261 1.609 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.281 -12.199 4.219 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -4.075 -11.443 1.289 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -3.680 -10.283 2.542 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.156 -11.436 3.114 1.00 0.00 N ATOM 2247 CA GLY B 62 -8.429 -10.816 3.481 1.00 0.00 C ATOM 2248 C GLY B 62 -8.802 -9.592 2.649 1.00 0.00 C ATOM 2249 O GLY B 62 -9.618 -8.801 3.110 1.00 0.00 O ATOM 0 H GLY B 62 -7.256 -12.154 2.397 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -9.221 -11.559 3.386 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -8.388 -10.527 4.531 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.231 -9.406 1.453 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.598 -8.304 0.559 1.00 0.00 C ATOM 2255 C LEU B 63 -9.823 -8.595 -0.310 1.00 0.00 C ATOM 2256 O LEU B 63 -10.504 -7.653 -0.708 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.394 -7.947 -0.288 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.219 -7.480 0.588 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.097 -7.236 -0.386 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.479 -6.207 1.407 1.00 0.00 C ATOM 0 H LEU B 63 -7.503 -10.015 1.079 1.00 0.00 H new ATOM 0 HA LEU B 63 -8.891 -7.457 1.179 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.091 -8.812 -0.877 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.662 -7.160 -0.992 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.011 -8.239 1.342 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.213 -6.898 0.155 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -4.867 -8.161 -0.915 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.398 -6.473 -1.103 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.591 -5.962 1.990 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.710 -5.382 0.733 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.320 -6.373 2.080 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.128 -9.870 -0.562 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.372 -10.314 -1.222 1.00 0.00 C ATOM 2274 C VAL B 64 -12.116 -11.388 -0.432 1.00 0.00 C ATOM 2275 O VAL B 64 -11.507 -12.223 0.231 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.151 -10.825 -2.665 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -10.959 -9.657 -3.638 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -9.971 -11.762 -2.757 1.00 0.00 C ATOM 0 H VAL B 64 -9.510 -10.642 -0.311 1.00 0.00 H new ATOM 0 HA VAL B 64 -11.984 -9.413 -1.261 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.048 -11.379 -2.943 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -10.806 -10.044 -4.645 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -11.845 -9.022 -3.624 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.089 -9.072 -3.338 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -9.852 -12.097 -3.787 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.068 -11.242 -2.438 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -10.140 -12.625 -2.112 1.00 0.00 H new ATOM 2288 N VAL B 65 -13.446 -11.349 -0.541 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.408 -12.210 0.173 1.00 0.00 C ATOM 2290 C VAL B 65 -15.419 -12.831 -0.808 1.00 0.00 C ATOM 2291 O VAL B 65 -15.836 -12.194 -1.774 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.110 -11.388 1.289 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.395 -12.020 1.846 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.139 -11.162 2.462 1.00 0.00 C ATOM 0 H VAL B 65 -13.911 -10.684 -1.160 1.00 0.00 H new ATOM 0 HA VAL B 65 -13.876 -13.037 0.643 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.400 -10.453 0.810 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -16.813 -11.375 2.619 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.121 -12.139 1.041 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.165 -12.996 2.274 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.637 -10.585 3.241 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.827 -12.125 2.867 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.264 -10.616 2.110 1.00 0.00 H new ATOM 2304 N ALA B 66 -15.803 -14.087 -0.554 1.00 0.00 N ATOM 2305 CA ALA B 66 -16.838 -14.837 -1.288 1.00 0.00 C ATOM 2306 C ALA B 66 -18.264 -14.491 -0.833 1.00 0.00 C ATOM 2307 O ALA B 66 -18.506 -14.080 0.301 1.00 0.00 O ATOM 2308 CB ALA B 66 -16.553 -16.338 -1.145 1.00 0.00 C ATOM 0 H ALA B 66 -15.386 -14.635 0.199 1.00 0.00 H new ATOM 0 HA ALA B 66 -16.790 -14.548 -2.338 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -17.312 -16.905 -1.684 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -15.570 -16.563 -1.559 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -16.574 -16.614 -0.091 1.00 0.00 H new ATOM 2314 N THR B 67 -19.236 -14.638 -1.741 1.00 0.00 N ATOM 2315 CA THR B 67 -20.669 -14.350 -1.516 1.00 0.00 C ATOM 2316 C THR B 67 -21.498 -15.070 -2.584 1.00 0.00 C ATOM 2317 O THR B 67 -20.917 -15.576 -3.532 1.00 0.00 O ATOM 2318 CB THR B 67 -20.949 -12.836 -1.619 1.00 0.00 C ATOM 2319 OG1 THR B 67 -19.919 -12.026 -1.090 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.263 -12.384 -0.990 1.00 0.00 C ATOM 0 H THR B 67 -19.047 -14.972 -2.686 1.00 0.00 H new ATOM 0 HA THR B 67 -20.937 -14.695 -0.517 1.00 0.00 H new ATOM 0 HB THR B 67 -21.011 -12.695 -2.698 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.231 -11.597 -0.266 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.373 -11.306 -1.111 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.094 -12.891 -1.480 1.00 0.00 H new ATOM 0 HG23 THR B 67 -22.262 -12.631 0.072 1.00 0.00 H new ATOM 2328 N TYR B 68 -22.826 -15.074 -2.477 1.00 0.00 N ATOM 2329 CA TYR B 68 -23.739 -15.450 -3.574 1.00 0.00 C ATOM 2330 C TYR B 68 -24.302 -14.161 -4.210 1.00 0.00 C ATOM 2331 O TYR B 68 -24.831 -13.320 -3.480 1.00 0.00 O ATOM 2332 CB TYR B 68 -24.886 -16.330 -3.041 1.00 0.00 C ATOM 2333 CG TYR B 68 -24.775 -17.800 -3.395 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -25.114 -18.230 -4.693 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -24.370 -18.741 -2.428 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -25.039 -19.594 -5.033 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -24.302 -20.109 -2.758 1.00 0.00 C ATOM 2338 CZ TYR B 68 -24.636 -20.538 -4.062 1.00 0.00 C ATOM 2339 OH TYR B 68 -24.569 -21.861 -4.374 1.00 0.00 O ATOM 0 H TYR B 68 -23.312 -14.814 -1.618 1.00 0.00 H new ATOM 0 HA TYR B 68 -23.196 -16.025 -4.324 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -24.925 -16.234 -1.956 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -25.830 -15.947 -3.429 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -25.433 -17.509 -5.431 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -24.111 -18.413 -1.432 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.289 -19.918 -6.033 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -23.995 -20.829 -2.014 1.00 0.00 H new ATOM 0 HH TYR B 68 -24.273 -22.368 -3.589 1.00 0.00 H new ATOM 2349 N GLU B 69 -24.182 -13.976 -5.531 1.00 0.00 N ATOM 2350 CA GLU B 69 -24.744 -12.804 -6.226 1.00 0.00 C ATOM 2351 C GLU B 69 -26.260 -12.892 -6.505 1.00 0.00 C ATOM 2352 O GLU B 69 -26.887 -11.860 -6.737 1.00 0.00 O ATOM 2353 CB GLU B 69 -23.890 -12.390 -7.446 1.00 0.00 C ATOM 2354 CG GLU B 69 -23.429 -13.409 -8.503 1.00 0.00 C ATOM 2355 CD GLU B 69 -24.523 -14.027 -9.369 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -25.443 -14.640 -8.791 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -24.404 -13.985 -10.612 1.00 0.00 O ATOM 0 H GLU B 69 -23.697 -14.628 -6.147 1.00 0.00 H new ATOM 0 HA GLU B 69 -24.676 -11.976 -5.520 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -24.451 -11.620 -7.976 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -22.991 -11.916 -7.053 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -22.709 -12.920 -9.159 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -22.900 -14.214 -7.994 1.00 0.00 H new ATOM 2364 N GLY B 70 -26.859 -14.087 -6.379 1.00 0.00 N ATOM 2365 CA GLY B 70 -28.301 -14.355 -6.509 1.00 0.00 C ATOM 2366 C GLY B 70 -28.631 -15.605 -7.332 1.00 0.00 C ATOM 2367 O GLY B 70 -29.657 -16.240 -7.098 1.00 0.00 O ATOM 0 H GLY B 70 -26.326 -14.932 -6.174 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -28.731 -14.464 -5.513 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -28.780 -13.492 -6.970 1.00 0.00 H new ATOM 2371 N ARG B 71 -27.752 -15.994 -8.261 1.00 0.00 N ATOM 2372 CA ARG B 71 -27.815 -17.218 -9.078 1.00 0.00 C ATOM 2373 C ARG B 71 -26.450 -17.937 -9.195 1.00 0.00 C ATOM 2374 O ARG B 71 -26.394 -19.054 -9.714 1.00 0.00 O ATOM 2375 CB ARG B 71 -28.394 -16.845 -10.458 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.053 -18.034 -11.182 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.768 -17.576 -12.463 1.00 0.00 C ATOM 2378 NE ARG B 71 -30.570 -18.661 -13.077 1.00 0.00 N ATOM 2379 CZ ARG B 71 -30.148 -19.605 -13.916 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -28.889 -19.681 -14.299 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -30.999 -20.499 -14.384 1.00 0.00 N ATOM 0 H ARG B 71 -26.928 -15.433 -8.478 1.00 0.00 H new ATOM 0 HA ARG B 71 -28.467 -17.939 -8.585 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -29.130 -16.051 -10.333 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -27.596 -16.444 -11.083 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -28.295 -18.777 -11.431 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -29.768 -18.518 -10.516 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -30.418 -16.732 -12.232 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -29.029 -17.221 -13.182 1.00 0.00 H new ATOM 0 HE ARG B 71 -31.559 -18.688 -12.828 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -28.209 -19.005 -13.951 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -28.595 -20.416 -14.943 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -31.979 -20.466 -14.103 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -30.677 -21.222 -15.027 1.00 0.00 H new ATOM 2395 N GLN B 72 -25.364 -17.347 -8.699 1.00 0.00 N ATOM 2396 CA GLN B 72 -23.996 -17.844 -8.741 1.00 0.00 C ATOM 2397 C GLN B 72 -23.196 -17.344 -7.523 1.00 0.00 C ATOM 2398 O GLN B 72 -23.579 -16.368 -6.879 1.00 0.00 O ATOM 2399 CB GLN B 72 -23.370 -17.380 -10.079 1.00 0.00 C ATOM 2400 CG GLN B 72 -22.026 -18.028 -10.438 1.00 0.00 C ATOM 2401 CD GLN B 72 -22.075 -19.519 -10.171 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -21.666 -20.000 -9.129 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -22.743 -20.287 -10.995 1.00 0.00 N ATOM 0 H GLN B 72 -25.425 -16.446 -8.225 1.00 0.00 H new ATOM 0 HA GLN B 72 -23.978 -18.933 -8.691 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -24.078 -17.584 -10.882 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.234 -16.299 -10.041 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -21.796 -17.847 -11.488 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -21.227 -17.573 -9.853 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -23.096 -19.907 -11.874 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -22.911 -21.265 -10.758 1.00 0.00 H new ATOM 2412 N VAL B 73 -22.086 -18.007 -7.191 1.00 0.00 N ATOM 2413 CA VAL B 73 -21.132 -17.489 -6.199 1.00 0.00 C ATOM 2414 C VAL B 73 -20.184 -16.477 -6.843 1.00 0.00 C ATOM 2415 O VAL B 73 -19.836 -16.602 -8.017 1.00 0.00 O ATOM 2416 CB VAL B 73 -20.349 -18.594 -5.456 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -21.298 -19.524 -4.687 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -19.425 -19.425 -6.362 1.00 0.00 C ATOM 0 H VAL B 73 -21.822 -18.906 -7.594 1.00 0.00 H new ATOM 0 HA VAL B 73 -21.726 -16.985 -5.436 1.00 0.00 H new ATOM 0 HB VAL B 73 -19.704 -18.064 -4.755 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -20.719 -20.292 -4.174 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -21.861 -18.945 -3.955 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -21.989 -19.997 -5.385 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -18.912 -20.179 -5.765 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -20.018 -19.916 -7.134 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -18.690 -18.770 -6.830 1.00 0.00 H new ATOM 2428 N ARG B 74 -19.747 -15.483 -6.065 1.00 0.00 N ATOM 2429 CA ARG B 74 -18.978 -14.329 -6.519 1.00 0.00 C ATOM 2430 C ARG B 74 -17.774 -14.091 -5.612 1.00 0.00 C ATOM 2431 O ARG B 74 -17.697 -14.616 -4.501 1.00 0.00 O ATOM 2432 CB ARG B 74 -19.881 -13.075 -6.552 1.00 0.00 C ATOM 2433 CG ARG B 74 -20.298 -12.504 -5.180 1.00 0.00 C ATOM 2434 CD ARG B 74 -20.342 -10.976 -5.168 1.00 0.00 C ATOM 2435 NE ARG B 74 -20.334 -10.495 -3.778 1.00 0.00 N ATOM 2436 CZ ARG B 74 -20.642 -9.299 -3.313 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -20.952 -8.283 -4.092 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -20.605 -9.119 -2.013 1.00 0.00 N ATOM 0 H ARG B 74 -19.928 -15.463 -5.061 1.00 0.00 H new ATOM 0 HA ARG B 74 -18.611 -14.530 -7.526 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -19.362 -12.293 -7.106 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -20.784 -13.317 -7.112 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.280 -12.894 -4.911 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.598 -12.850 -4.419 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -19.485 -10.573 -5.708 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -21.237 -10.623 -5.681 1.00 0.00 H new ATOM 0 HE ARG B 74 -20.052 -11.180 -3.077 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -20.961 -8.401 -5.105 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -21.183 -7.378 -3.682 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -20.344 -9.890 -1.399 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -20.837 -8.208 -1.618 1.00 0.00 H new ATOM 2452 N TYR B 75 -16.858 -13.233 -6.046 1.00 0.00 N ATOM 2453 CA TYR B 75 -15.817 -12.644 -5.189 1.00 0.00 C ATOM 2454 C TYR B 75 -16.107 -11.138 -5.046 1.00 0.00 C ATOM 2455 O TYR B 75 -16.844 -10.585 -5.854 1.00 0.00 O ATOM 2456 CB TYR B 75 -14.419 -12.901 -5.779 1.00 0.00 C ATOM 2457 CG TYR B 75 -13.998 -14.358 -5.912 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -14.289 -15.298 -4.898 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -13.276 -14.771 -7.051 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -13.874 -16.638 -5.024 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -12.851 -16.108 -7.177 1.00 0.00 C ATOM 2462 CZ TYR B 75 -13.141 -17.044 -6.161 1.00 0.00 C ATOM 2463 OH TYR B 75 -12.725 -18.334 -6.292 1.00 0.00 O ATOM 0 H TYR B 75 -16.811 -12.918 -7.015 1.00 0.00 H new ATOM 0 HA TYR B 75 -15.831 -13.108 -4.203 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -14.375 -12.441 -6.766 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -13.686 -12.389 -5.156 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -14.834 -14.986 -4.019 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -13.048 -14.059 -7.830 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -14.116 -17.354 -4.252 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -12.302 -16.418 -8.054 1.00 0.00 H new ATOM 0 HH TYR B 75 -12.236 -18.436 -7.135 1.00 0.00 H new ATOM 2473 N ALA B 76 -15.567 -10.455 -4.039 1.00 0.00 N ATOM 2474 CA ALA B 76 -15.794 -9.022 -3.827 1.00 0.00 C ATOM 2475 C ALA B 76 -14.714 -8.417 -2.937 1.00 0.00 C ATOM 2476 O ALA B 76 -14.200 -9.129 -2.075 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.178 -8.816 -3.197 1.00 0.00 C ATOM 0 H ALA B 76 -14.956 -10.880 -3.342 1.00 0.00 H new ATOM 0 HA ALA B 76 -15.750 -8.516 -4.791 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.351 -7.752 -3.038 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -17.944 -9.212 -3.864 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.224 -9.338 -2.241 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.411 -7.125 -3.121 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.574 -6.335 -2.210 1.00 0.00 C ATOM 2485 C LEU B 77 -14.118 -6.547 -0.789 1.00 0.00 C ATOM 2486 O LEU B 77 -15.322 -6.419 -0.579 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.648 -4.833 -2.579 1.00 0.00 C ATOM 2488 CG LEU B 77 -12.904 -4.276 -3.802 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.526 -4.887 -4.033 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -13.782 -4.404 -5.047 1.00 0.00 C ATOM 0 H LEU B 77 -14.747 -6.590 -3.922 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.533 -6.650 -2.281 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -14.702 -4.589 -2.710 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.297 -4.275 -1.711 1.00 0.00 H new ATOM 0 HG LEU B 77 -12.711 -3.224 -3.591 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -11.072 -4.437 -4.916 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -10.895 -4.699 -3.165 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -11.625 -5.962 -4.184 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -13.249 -4.007 -5.911 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -14.020 -5.454 -5.218 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -14.705 -3.842 -4.901 1.00 0.00 H new ATOM 2502 N ALA B 78 -13.249 -6.887 0.164 1.00 0.00 N ATOM 2503 CA ALA B 78 -13.638 -7.355 1.498 1.00 0.00 C ATOM 2504 C ALA B 78 -14.331 -6.331 2.422 1.00 0.00 C ATOM 2505 O ALA B 78 -14.643 -6.699 3.549 1.00 0.00 O ATOM 2506 CB ALA B 78 -12.395 -7.960 2.157 1.00 0.00 C ATOM 0 H ALA B 78 -12.239 -6.845 0.030 1.00 0.00 H new ATOM 0 HA ALA B 78 -14.426 -8.093 1.348 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -12.650 -8.319 3.154 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -12.032 -8.792 1.554 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -11.617 -7.200 2.233 1.00 0.00 H new ATOM 2512 N ASP B 79 -14.546 -5.092 1.965 1.00 0.00 N ATOM 2513 CA ASP B 79 -15.367 -4.027 2.572 1.00 0.00 C ATOM 2514 C ASP B 79 -15.342 -2.759 1.700 1.00 0.00 C ATOM 2515 O ASP B 79 -14.426 -2.543 0.896 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.963 -3.675 4.026 1.00 0.00 C ATOM 2517 CG ASP B 79 -15.880 -2.592 4.626 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -17.112 -2.803 4.613 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -15.392 -1.478 4.928 1.00 0.00 O ATOM 0 H ASP B 79 -14.119 -4.779 1.093 1.00 0.00 H new ATOM 0 HA ASP B 79 -16.380 -4.427 2.620 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -15.007 -4.572 4.643 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -13.930 -3.327 4.043 1.00 0.00 H new ATOM 2524 N SER B 80 -16.322 -1.878 1.929 1.00 0.00 N ATOM 2525 CA SER B 80 -16.373 -0.508 1.415 1.00 0.00 C ATOM 2526 C SER B 80 -15.052 0.236 1.645 1.00 0.00 C ATOM 2527 O SER B 80 -14.688 1.078 0.833 1.00 0.00 O ATOM 2528 CB SER B 80 -17.461 0.304 2.127 1.00 0.00 C ATOM 2529 OG SER B 80 -18.745 -0.272 2.017 1.00 0.00 O ATOM 0 H SER B 80 -17.134 -2.111 2.501 1.00 0.00 H new ATOM 0 HA SER B 80 -16.579 -0.595 0.348 1.00 0.00 H new ATOM 0 HB2 SER B 80 -17.202 0.401 3.181 1.00 0.00 H new ATOM 0 HB3 SER B 80 -17.485 1.311 1.711 1.00 0.00 H new ATOM 0 HG SER B 80 -19.396 0.287 2.490 1.00 0.00 H new ATOM 2535 N HIS B 81 -14.308 -0.093 2.707 1.00 0.00 N ATOM 2536 CA HIS B 81 -12.951 0.371 2.988 1.00 0.00 C ATOM 2537 C HIS B 81 -12.001 0.231 1.801 1.00 0.00 C ATOM 2538 O HIS B 81 -11.345 1.210 1.441 1.00 0.00 O ATOM 2539 CB HIS B 81 -12.413 -0.438 4.182 1.00 0.00 C ATOM 2540 CG HIS B 81 -12.924 0.009 5.523 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -13.614 1.171 5.807 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -12.512 -0.517 6.706 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -13.564 1.369 7.132 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -12.997 0.292 7.714 1.00 0.00 N ATOM 0 H HIS B 81 -14.657 -0.723 3.429 1.00 0.00 H new ATOM 0 HA HIS B 81 -13.000 1.437 3.209 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -12.673 -1.487 4.040 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -11.325 -0.377 4.184 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -14.080 1.773 5.128 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -11.914 -1.407 6.835 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -13.920 2.248 7.649 1.00 0.00 H new ATOM 2553 N LEU B 82 -11.886 -0.969 1.220 1.00 0.00 N ATOM 2554 CA LEU B 82 -10.933 -1.225 0.133 1.00 0.00 C ATOM 2555 C LEU B 82 -11.496 -0.703 -1.180 1.00 0.00 C ATOM 2556 O LEU B 82 -10.776 -0.035 -1.908 1.00 0.00 O ATOM 2557 CB LEU B 82 -10.572 -2.716 0.003 1.00 0.00 C ATOM 2558 CG LEU B 82 -10.343 -3.457 1.339 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -10.096 -4.939 1.060 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -9.157 -2.874 2.124 1.00 0.00 C ATOM 0 H LEU B 82 -12.443 -1.781 1.486 1.00 0.00 H new ATOM 0 HA LEU B 82 -10.012 -0.696 0.376 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -11.370 -3.220 -0.541 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -9.669 -2.803 -0.602 1.00 0.00 H new ATOM 0 HG LEU B 82 -11.237 -3.331 1.950 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -9.934 -5.464 2.001 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -10.962 -5.363 0.552 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -9.215 -5.048 0.427 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -9.032 -3.425 3.056 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -8.249 -2.959 1.527 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -9.348 -1.824 2.346 1.00 0.00 H new ATOM 2572 N ALA B 83 -12.793 -0.906 -1.433 1.00 0.00 N ATOM 2573 CA ALA B 83 -13.494 -0.279 -2.551 1.00 0.00 C ATOM 2574 C ALA B 83 -13.310 1.253 -2.561 1.00 0.00 C ATOM 2575 O ALA B 83 -13.140 1.836 -3.625 1.00 0.00 O ATOM 2576 CB ALA B 83 -14.968 -0.683 -2.440 1.00 0.00 C ATOM 0 H ALA B 83 -13.385 -1.512 -0.865 1.00 0.00 H new ATOM 0 HA ALA B 83 -13.080 -0.621 -3.499 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -15.531 -0.235 -3.259 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -15.053 -1.768 -2.493 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -15.370 -0.334 -1.489 1.00 0.00 H new ATOM 2582 N ARG B 84 -13.264 1.886 -1.382 1.00 0.00 N ATOM 2583 CA ARG B 84 -12.985 3.309 -1.215 1.00 0.00 C ATOM 2584 C ARG B 84 -11.497 3.650 -1.393 1.00 0.00 C ATOM 2585 O ARG B 84 -11.208 4.369 -2.335 1.00 0.00 O ATOM 2586 CB ARG B 84 -13.591 3.807 0.113 1.00 0.00 C ATOM 2587 CG ARG B 84 -13.144 5.233 0.405 1.00 0.00 C ATOM 2588 CD ARG B 84 -14.012 6.059 1.358 1.00 0.00 C ATOM 2589 NE ARG B 84 -15.284 6.485 0.737 1.00 0.00 N ATOM 2590 CZ ARG B 84 -15.425 7.452 -0.171 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -14.410 8.136 -0.654 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -16.626 7.763 -0.615 1.00 0.00 N ATOM 0 H ARG B 84 -13.425 1.405 -0.497 1.00 0.00 H new ATOM 0 HA ARG B 84 -13.475 3.858 -2.019 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -14.679 3.765 0.061 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -13.285 3.150 0.927 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.135 5.193 0.816 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -13.081 5.768 -0.543 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -14.226 5.472 2.251 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -13.456 6.939 1.681 1.00 0.00 H new ATOM 0 HE ARG B 84 -16.130 5.996 1.029 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -13.462 7.936 -0.335 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -14.571 8.866 -1.348 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -17.444 7.265 -0.264 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -16.738 8.502 -1.309 1.00 0.00 H new ATOM 2606 N ALA B 85 -10.541 3.139 -0.603 1.00 0.00 N ATOM 2607 CA ALA B 85 -9.131 3.564 -0.761 1.00 0.00 C ATOM 2608 C ALA B 85 -8.509 3.135 -2.107 1.00 0.00 C ATOM 2609 O ALA B 85 -7.546 3.749 -2.570 1.00 0.00 O ATOM 2610 CB ALA B 85 -8.300 3.186 0.471 1.00 0.00 C ATOM 0 H ALA B 85 -10.704 2.451 0.132 1.00 0.00 H new ATOM 0 HA ALA B 85 -9.121 4.653 -0.812 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -7.269 3.510 0.328 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -8.714 3.674 1.353 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -8.325 2.105 0.609 1.00 0.00 H new ATOM 2616 N LEU B 86 -9.082 2.123 -2.770 1.00 0.00 N ATOM 2617 CA LEU B 86 -8.770 1.814 -4.163 1.00 0.00 C ATOM 2618 C LEU B 86 -9.471 2.835 -5.080 1.00 0.00 C ATOM 2619 O LEU B 86 -8.808 3.490 -5.878 1.00 0.00 O ATOM 2620 CB LEU B 86 -9.189 0.364 -4.486 1.00 0.00 C ATOM 2621 CG LEU B 86 -8.335 -0.304 -5.576 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -9.007 -1.627 -5.935 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -8.124 0.516 -6.855 1.00 0.00 C ATOM 0 H LEU B 86 -9.773 1.499 -2.353 1.00 0.00 H new ATOM 0 HA LEU B 86 -7.696 1.889 -4.334 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -9.129 -0.232 -3.575 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -10.232 0.360 -4.802 1.00 0.00 H new ATOM 0 HG LEU B 86 -7.336 -0.423 -5.157 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -8.428 -2.131 -6.708 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -9.059 -2.261 -5.050 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -10.015 -1.435 -6.304 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -7.508 -0.051 -7.553 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -9.089 0.730 -7.313 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -7.624 1.453 -6.608 1.00 0.00 H new ATOM 2635 N GLY B 87 -10.792 3.004 -4.933 1.00 0.00 N ATOM 2636 CA GLY B 87 -11.653 3.787 -5.827 1.00 0.00 C ATOM 2637 C GLY B 87 -11.467 5.307 -5.761 1.00 0.00 C ATOM 2638 O GLY B 87 -11.671 5.974 -6.770 1.00 0.00 O ATOM 0 H GLY B 87 -11.308 2.584 -4.160 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -11.474 3.461 -6.852 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -12.693 3.556 -5.596 1.00 0.00 H new ATOM 2642 N GLU B 88 -11.045 5.853 -4.615 1.00 0.00 N ATOM 2643 CA GLU B 88 -10.616 7.250 -4.468 1.00 0.00 C ATOM 2644 C GLU B 88 -9.184 7.475 -4.997 1.00 0.00 C ATOM 2645 O GLU B 88 -8.744 8.614 -5.118 1.00 0.00 O ATOM 2646 CB GLU B 88 -10.902 7.762 -3.038 1.00 0.00 C ATOM 2647 CG GLU B 88 -9.920 7.445 -1.883 1.00 0.00 C ATOM 2648 CD GLU B 88 -10.659 7.219 -0.546 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -11.751 7.806 -0.346 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -10.194 6.388 0.265 1.00 0.00 O ATOM 0 H GLU B 88 -10.991 5.325 -3.744 1.00 0.00 H new ATOM 0 HA GLU B 88 -11.221 7.886 -5.115 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -10.993 8.847 -3.096 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -11.879 7.376 -2.746 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -9.341 6.556 -2.133 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -9.212 8.266 -1.772 1.00 0.00 H new ATOM 2657 N LEU B 89 -8.494 6.383 -5.372 1.00 0.00 N ATOM 2658 CA LEU B 89 -7.247 6.333 -6.136 1.00 0.00 C ATOM 2659 C LEU B 89 -6.078 7.046 -5.448 1.00 0.00 C ATOM 2660 O LEU B 89 -5.753 8.197 -5.744 1.00 0.00 O ATOM 2661 CB LEU B 89 -7.511 6.831 -7.573 1.00 0.00 C ATOM 2662 CG LEU B 89 -6.336 6.616 -8.549 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -5.979 5.129 -8.707 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -6.704 7.210 -9.915 1.00 0.00 C ATOM 0 H LEU B 89 -8.822 5.448 -5.129 1.00 0.00 H new ATOM 0 HA LEU B 89 -6.918 5.295 -6.187 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -8.391 6.321 -7.965 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -7.748 7.894 -7.538 1.00 0.00 H new ATOM 0 HG LEU B 89 -5.460 7.118 -8.139 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -5.147 5.027 -9.403 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -5.694 4.718 -7.738 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -6.843 4.586 -9.092 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -5.878 7.062 -10.611 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -7.595 6.714 -10.299 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -6.900 8.277 -9.807 1.00 0.00 H new ATOM 2676 N VAL B 90 -5.385 6.306 -4.575 1.00 0.00 N ATOM 2677 CA VAL B 90 -4.236 6.793 -3.790 1.00 0.00 C ATOM 2678 C VAL B 90 -3.262 7.641 -4.617 1.00 0.00 C ATOM 2679 O VAL B 90 -3.003 7.396 -5.796 1.00 0.00 O ATOM 2680 CB VAL B 90 -3.451 5.682 -3.049 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -4.350 4.607 -2.412 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -2.390 5.013 -3.934 1.00 0.00 C ATOM 0 H VAL B 90 -5.610 5.329 -4.388 1.00 0.00 H new ATOM 0 HA VAL B 90 -4.699 7.425 -3.032 1.00 0.00 H new ATOM 0 HB VAL B 90 -2.946 6.209 -2.239 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -3.729 3.864 -1.912 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -5.015 5.073 -1.685 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -4.943 4.122 -3.188 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -1.872 4.243 -3.362 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -2.872 4.559 -4.800 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -1.672 5.761 -4.269 1.00 0.00 H new ATOM 2692 N GLN B 91 -2.649 8.609 -3.949 1.00 0.00 N ATOM 2693 CA GLN B 91 -1.964 9.750 -4.560 1.00 0.00 C ATOM 2694 C GLN B 91 -0.678 9.456 -5.331 1.00 0.00 C ATOM 2695 O GLN B 91 -0.055 10.386 -5.823 1.00 0.00 O ATOM 2696 CB GLN B 91 -1.686 10.747 -3.447 1.00 0.00 C ATOM 2697 CG GLN B 91 -2.953 11.448 -2.983 1.00 0.00 C ATOM 2698 CD GLN B 91 -3.357 12.660 -3.802 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.913 13.772 -3.563 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -4.165 12.473 -4.827 1.00 0.00 N ATOM 0 H GLN B 91 -2.611 8.626 -2.930 1.00 0.00 H new ATOM 0 HA GLN B 91 -2.632 10.129 -5.334 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -1.227 10.231 -2.604 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.968 11.489 -3.796 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -3.773 10.730 -2.998 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -2.819 11.758 -1.947 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -4.533 11.542 -5.023 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.422 13.259 -5.424 1.00 0.00 H new ATOM 2709 N VAL B 92 -0.309 8.197 -5.530 1.00 0.00 N ATOM 2710 CA VAL B 92 0.769 7.726 -6.435 1.00 0.00 C ATOM 2711 C VAL B 92 0.462 7.975 -7.933 1.00 0.00 C ATOM 2712 O VAL B 92 0.843 7.215 -8.813 1.00 0.00 O ATOM 2713 CB VAL B 92 1.142 6.263 -6.097 1.00 0.00 C ATOM 2714 CG1 VAL B 92 0.070 5.291 -6.602 1.00 0.00 C ATOM 2715 CG2 VAL B 92 2.551 5.867 -6.575 1.00 0.00 C ATOM 0 H VAL B 92 -0.768 7.425 -5.046 1.00 0.00 H new ATOM 0 HA VAL B 92 1.656 8.333 -6.255 1.00 0.00 H new ATOM 0 HB VAL B 92 1.174 6.194 -5.010 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.357 4.270 -6.351 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.885 5.525 -6.131 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.026 5.385 -7.684 1.00 0.00 H new ATOM 0 HG21 VAL B 92 2.748 4.829 -6.306 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.613 5.979 -7.657 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.291 6.512 -6.100 1.00 0.00 H new ATOM 2725 N VAL B 93 -0.262 9.061 -8.204 1.00 0.00 N ATOM 2726 CA VAL B 93 -0.570 9.656 -9.515 1.00 0.00 C ATOM 2727 C VAL B 93 -1.401 8.748 -10.447 1.00 0.00 C ATOM 2728 O VAL B 93 -1.555 9.063 -11.623 1.00 0.00 O ATOM 2729 CB VAL B 93 0.703 10.202 -10.232 1.00 0.00 C ATOM 2730 CG1 VAL B 93 0.362 11.464 -11.045 1.00 0.00 C ATOM 2731 CG2 VAL B 93 1.822 10.636 -9.259 1.00 0.00 C ATOM 0 H VAL B 93 -0.688 9.598 -7.448 1.00 0.00 H new ATOM 0 HA VAL B 93 -1.214 10.505 -9.286 1.00 0.00 H new ATOM 0 HB VAL B 93 1.049 9.374 -10.851 1.00 0.00 H new ATOM 0 HG11 VAL B 93 1.261 11.832 -11.539 1.00 0.00 H new ATOM 0 HG12 VAL B 93 -0.391 11.221 -11.795 1.00 0.00 H new ATOM 0 HG13 VAL B 93 -0.026 12.233 -10.377 1.00 0.00 H new ATOM 0 HG21 VAL B 93 2.676 11.005 -9.828 1.00 0.00 H new ATOM 0 HG22 VAL B 93 1.451 11.427 -8.607 1.00 0.00 H new ATOM 0 HG23 VAL B 93 2.130 9.783 -8.655 1.00 0.00 H new ATOM 2741 N LEU B 94 -1.943 7.653 -9.883 1.00 0.00 N ATOM 2742 CA LEU B 94 -2.559 6.468 -10.497 1.00 0.00 C ATOM 2743 C LEU B 94 -1.492 5.368 -10.417 1.00 0.00 C ATOM 2744 O LEU B 94 -0.478 5.420 -11.108 1.00 0.00 O ATOM 2745 CB LEU B 94 -3.087 6.691 -11.937 1.00 0.00 C ATOM 2746 CG LEU B 94 -4.001 5.590 -12.522 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -4.588 6.094 -13.850 1.00 0.00 C ATOM 2748 CD2 LEU B 94 -3.292 4.251 -12.771 1.00 0.00 C ATOM 0 H LEU B 94 -1.960 7.571 -8.866 1.00 0.00 H new ATOM 0 HA LEU B 94 -3.466 6.194 -9.958 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -3.635 7.633 -11.956 1.00 0.00 H new ATOM 0 HB3 LEU B 94 -2.229 6.808 -12.599 1.00 0.00 H new ATOM 0 HG LEU B 94 -4.773 5.397 -11.777 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -5.236 5.328 -14.276 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -5.167 7.000 -13.671 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -3.778 6.312 -14.546 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -4.003 3.534 -13.181 1.00 0.00 H new ATOM 0 HD22 LEU B 94 -2.475 4.398 -13.478 1.00 0.00 H new ATOM 0 HD23 LEU B 94 -2.894 3.870 -11.831 1.00 0.00 H new ATOM 2760 N ALA B 95 -1.705 4.393 -9.533 1.00 0.00 N ATOM 2761 CA ALA B 95 -0.868 3.204 -9.391 1.00 0.00 C ATOM 2762 C ALA B 95 -0.786 2.402 -10.703 1.00 0.00 C ATOM 2763 O ALA B 95 -1.549 1.461 -10.897 1.00 0.00 O ATOM 2764 CB ALA B 95 -1.440 2.382 -8.224 1.00 0.00 C ATOM 0 H ALA B 95 -2.487 4.410 -8.878 1.00 0.00 H new ATOM 0 HA ALA B 95 0.162 3.483 -9.171 1.00 0.00 H new ATOM 0 HB1 ALA B 95 -0.841 1.482 -8.085 1.00 0.00 H new ATOM 0 HB2 ALA B 95 -1.416 2.979 -7.312 1.00 0.00 H new ATOM 0 HB3 ALA B 95 -2.469 2.102 -8.447 1.00 0.00 H new ATOM 2770 N VAL B 96 0.123 2.792 -11.599 1.00 0.00 N ATOM 2771 CA VAL B 96 0.414 2.071 -12.846 1.00 0.00 C ATOM 2772 C VAL B 96 0.791 0.622 -12.526 1.00 0.00 C ATOM 2773 O VAL B 96 1.657 0.391 -11.682 1.00 0.00 O ATOM 2774 CB VAL B 96 1.573 2.709 -13.657 1.00 0.00 C ATOM 2775 CG1 VAL B 96 1.585 2.164 -15.096 1.00 0.00 C ATOM 2776 CG2 VAL B 96 1.510 4.242 -13.713 1.00 0.00 C ATOM 0 H VAL B 96 0.689 3.632 -11.479 1.00 0.00 H new ATOM 0 HA VAL B 96 -0.489 2.122 -13.454 1.00 0.00 H new ATOM 0 HB VAL B 96 2.488 2.436 -13.131 1.00 0.00 H new ATOM 0 HG11 VAL B 96 2.404 2.621 -15.651 1.00 0.00 H new ATOM 0 HG12 VAL B 96 1.721 1.083 -15.074 1.00 0.00 H new ATOM 0 HG13 VAL B 96 0.639 2.401 -15.583 1.00 0.00 H new ATOM 0 HG21 VAL B 96 2.350 4.620 -14.296 1.00 0.00 H new ATOM 0 HG22 VAL B 96 0.576 4.551 -14.182 1.00 0.00 H new ATOM 0 HG23 VAL B 96 1.559 4.645 -12.702 1.00 0.00 H new ATOM 2786 N ASP B 97 0.201 -0.327 -13.259 1.00 0.00 N ATOM 2787 CA ASP B 97 0.436 -1.786 -13.209 1.00 0.00 C ATOM 2788 C ASP B 97 1.877 -2.242 -13.538 1.00 0.00 C ATOM 2789 O ASP B 97 2.117 -3.433 -13.759 1.00 0.00 O ATOM 2790 CB ASP B 97 -0.547 -2.497 -14.161 1.00 0.00 C ATOM 2791 CG ASP B 97 -2.021 -2.405 -13.765 1.00 0.00 C ATOM 2792 OD1 ASP B 97 -2.325 -2.410 -12.550 1.00 0.00 O ATOM 2793 OD2 ASP B 97 -2.838 -2.424 -14.714 1.00 0.00 O ATOM 0 H ASP B 97 -0.505 -0.086 -13.955 1.00 0.00 H new ATOM 0 HA ASP B 97 0.273 -2.064 -12.168 1.00 0.00 H new ATOM 0 HB2 ASP B 97 -0.429 -2.076 -15.159 1.00 0.00 H new ATOM 0 HB3 ASP B 97 -0.270 -3.549 -14.224 1.00 0.00 H new ATOM 2798 N THR B 98 2.844 -1.318 -13.597 1.00 0.00 N ATOM 2799 CA THR B 98 4.253 -1.673 -13.768 1.00 0.00 C ATOM 2800 C THR B 98 4.775 -2.400 -12.541 1.00 0.00 C ATOM 2801 O THR B 98 4.572 -1.981 -11.400 1.00 0.00 O ATOM 2802 CB THR B 98 5.189 -0.500 -14.114 1.00 0.00 C ATOM 2803 OG1 THR B 98 5.052 0.591 -13.236 1.00 0.00 O ATOM 2804 CG2 THR B 98 4.961 0.007 -15.538 1.00 0.00 C ATOM 0 H THR B 98 2.672 -0.315 -13.528 1.00 0.00 H new ATOM 0 HA THR B 98 4.267 -2.327 -14.640 1.00 0.00 H new ATOM 0 HB THR B 98 6.195 -0.907 -14.016 1.00 0.00 H new ATOM 0 HG1 THR B 98 5.670 1.304 -13.501 1.00 0.00 H new ATOM 0 HG21 THR B 98 5.641 0.834 -15.743 1.00 0.00 H new ATOM 0 HG22 THR B 98 5.148 -0.800 -16.246 1.00 0.00 H new ATOM 0 HG23 THR B 98 3.931 0.349 -15.642 1.00 0.00 H new ATOM 2812 N ASP B 99 5.518 -3.467 -12.815 1.00 0.00 N ATOM 2813 CA ASP B 99 6.353 -4.141 -11.839 1.00 0.00 C ATOM 2814 C ASP B 99 7.780 -3.644 -12.066 1.00 0.00 C ATOM 2815 O ASP B 99 8.257 -3.504 -13.197 1.00 0.00 O ATOM 2816 CB ASP B 99 6.278 -5.666 -11.943 1.00 0.00 C ATOM 2817 CG ASP B 99 7.038 -6.269 -10.752 1.00 0.00 C ATOM 2818 OD1 ASP B 99 8.288 -6.297 -10.816 1.00 0.00 O ATOM 2819 OD2 ASP B 99 6.374 -6.581 -9.741 1.00 0.00 O ATOM 0 H ASP B 99 5.554 -3.892 -13.741 1.00 0.00 H new ATOM 0 HA ASP B 99 6.003 -3.907 -10.833 1.00 0.00 H new ATOM 0 HB2 ASP B 99 5.239 -5.996 -11.937 1.00 0.00 H new ATOM 0 HB3 ASP B 99 6.715 -6.004 -12.883 1.00 0.00 H new ATOM 2824 N GLN B 100 8.457 -3.342 -10.974 1.00 0.00 N ATOM 2825 CA GLN B 100 9.858 -2.984 -10.921 1.00 0.00 C ATOM 2826 C GLN B 100 10.280 -3.317 -9.487 1.00 0.00 C ATOM 2827 O GLN B 100 9.487 -3.064 -8.570 1.00 0.00 O ATOM 2828 CB GLN B 100 10.070 -1.494 -11.267 1.00 0.00 C ATOM 2829 CG GLN B 100 11.213 -1.237 -12.270 1.00 0.00 C ATOM 2830 CD GLN B 100 10.703 -0.643 -13.582 1.00 0.00 C ATOM 2831 OE1 GLN B 100 11.206 0.351 -14.082 1.00 0.00 O ATOM 2832 NE2 GLN B 100 9.659 -1.196 -14.159 1.00 0.00 N ATOM 0 H GLN B 100 8.019 -3.340 -10.053 1.00 0.00 H new ATOM 0 HA GLN B 100 10.459 -3.525 -11.652 1.00 0.00 H new ATOM 0 HB2 GLN B 100 9.144 -1.092 -11.677 1.00 0.00 H new ATOM 0 HB3 GLN B 100 10.277 -0.945 -10.349 1.00 0.00 H new ATOM 0 HG2 GLN B 100 11.941 -0.559 -11.824 1.00 0.00 H new ATOM 0 HG3 GLN B 100 11.733 -2.173 -12.474 1.00 0.00 H new ATOM 0 HE21 GLN B 100 9.231 -2.027 -13.750 1.00 0.00 H new ATOM 0 HE22 GLN B 100 9.277 -0.794 -15.015 1.00 0.00 H new ATOM 2841 N PRO B 101 11.479 -3.884 -9.272 1.00 0.00 N ATOM 2842 CA PRO B 101 11.861 -4.438 -7.982 1.00 0.00 C ATOM 2843 C PRO B 101 12.168 -3.342 -6.952 1.00 0.00 C ATOM 2844 O PRO B 101 11.966 -2.150 -7.179 1.00 0.00 O ATOM 2845 CB PRO B 101 13.056 -5.353 -8.289 1.00 0.00 C ATOM 2846 CG PRO B 101 13.722 -4.639 -9.458 1.00 0.00 C ATOM 2847 CD PRO B 101 12.530 -4.114 -10.253 1.00 0.00 C ATOM 0 HA PRO B 101 11.054 -5.001 -7.513 1.00 0.00 H new ATOM 0 HB2 PRO B 101 13.726 -5.446 -7.435 1.00 0.00 H new ATOM 0 HB3 PRO B 101 12.738 -6.361 -8.556 1.00 0.00 H new ATOM 0 HG2 PRO B 101 14.372 -3.831 -9.122 1.00 0.00 H new ATOM 0 HG3 PRO B 101 14.336 -5.317 -10.050 1.00 0.00 H new ATOM 0 HD2 PRO B 101 12.784 -3.194 -10.779 1.00 0.00 H new ATOM 0 HD3 PRO B 101 12.213 -4.835 -11.006 1.00 0.00 H new ATOM 2855 N CYS B 102 12.661 -3.764 -5.793 1.00 0.00 N ATOM 2856 CA CYS B 102 13.074 -2.892 -4.712 1.00 0.00 C ATOM 2857 C CYS B 102 14.555 -2.456 -4.861 1.00 0.00 C ATOM 2858 O CYS B 102 15.157 -2.558 -5.931 1.00 0.00 O ATOM 2859 CB CYS B 102 12.726 -3.702 -3.454 1.00 0.00 C ATOM 2860 SG CYS B 102 12.563 -2.787 -1.887 1.00 0.00 S ATOM 0 H CYS B 102 12.786 -4.753 -5.578 1.00 0.00 H new ATOM 0 HA CYS B 102 12.569 -1.926 -4.686 1.00 0.00 H new ATOM 0 HB2 CYS B 102 11.787 -4.224 -3.638 1.00 0.00 H new ATOM 0 HB3 CYS B 102 13.494 -4.464 -3.321 1.00 0.00 H new ATOM 2865 N VAL B 103 15.134 -1.986 -3.755 1.00 0.00 N ATOM 2866 CA VAL B 103 16.577 -1.714 -3.593 1.00 0.00 C ATOM 2867 C VAL B 103 17.070 -0.613 -4.566 1.00 0.00 C ATOM 2868 O VAL B 103 18.185 -0.660 -5.079 1.00 0.00 O ATOM 2869 CB VAL B 103 17.425 -3.020 -3.658 1.00 0.00 C ATOM 2870 CG1 VAL B 103 18.819 -2.853 -3.012 1.00 0.00 C ATOM 2871 CG2 VAL B 103 16.753 -4.194 -2.910 1.00 0.00 C ATOM 0 H VAL B 103 14.598 -1.774 -2.913 1.00 0.00 H new ATOM 0 HA VAL B 103 16.724 -1.313 -2.590 1.00 0.00 H new ATOM 0 HB VAL B 103 17.512 -3.231 -4.724 1.00 0.00 H new ATOM 0 HG11 VAL B 103 19.368 -3.792 -3.084 1.00 0.00 H new ATOM 0 HG12 VAL B 103 19.370 -2.069 -3.532 1.00 0.00 H new ATOM 0 HG13 VAL B 103 18.704 -2.580 -1.963 1.00 0.00 H new ATOM 0 HG21 VAL B 103 17.382 -5.081 -2.984 1.00 0.00 H new ATOM 0 HG22 VAL B 103 16.621 -3.929 -1.861 1.00 0.00 H new ATOM 0 HG23 VAL B 103 15.780 -4.401 -3.357 1.00 0.00 H new ATOM 2881 N ALA B 104 16.198 0.360 -4.872 1.00 0.00 N ATOM 2882 CA ALA B 104 16.472 1.622 -5.590 1.00 0.00 C ATOM 2883 C ALA B 104 16.769 1.546 -7.105 1.00 0.00 C ATOM 2884 O ALA B 104 16.698 2.568 -7.785 1.00 0.00 O ATOM 2885 CB ALA B 104 17.597 2.375 -4.859 1.00 0.00 C ATOM 0 H ALA B 104 15.216 0.284 -4.608 1.00 0.00 H new ATOM 0 HA ALA B 104 15.522 2.155 -5.565 1.00 0.00 H new ATOM 0 HB1 ALA B 104 17.808 3.309 -5.380 1.00 0.00 H new ATOM 0 HB2 ALA B 104 17.285 2.592 -3.837 1.00 0.00 H new ATOM 0 HB3 ALA B 104 18.496 1.758 -4.841 1.00 0.00 H new ATOM 2891 N GLU B 105 17.073 0.360 -7.631 1.00 0.00 N ATOM 2892 CA GLU B 105 17.569 0.113 -8.993 1.00 0.00 C ATOM 2893 C GLU B 105 16.621 0.559 -10.129 1.00 0.00 C ATOM 2894 O GLU B 105 15.507 1.015 -9.870 1.00 0.00 O ATOM 2895 CB GLU B 105 17.893 -1.385 -9.094 1.00 0.00 C ATOM 2896 CG GLU B 105 16.631 -2.266 -9.171 1.00 0.00 C ATOM 2897 CD GLU B 105 16.317 -2.694 -10.610 1.00 0.00 C ATOM 2898 OE1 GLU B 105 17.187 -3.353 -11.212 1.00 0.00 O ATOM 2899 OE2 GLU B 105 15.257 -2.300 -11.152 1.00 0.00 O ATOM 0 H GLU B 105 16.976 -0.502 -7.094 1.00 0.00 H new ATOM 0 HA GLU B 105 18.453 0.733 -9.143 1.00 0.00 H new ATOM 0 HB2 GLU B 105 18.507 -1.560 -9.977 1.00 0.00 H new ATOM 0 HB3 GLU B 105 18.486 -1.683 -8.229 1.00 0.00 H new ATOM 0 HG2 GLU B 105 16.769 -3.152 -8.551 1.00 0.00 H new ATOM 0 HG3 GLU B 105 15.781 -1.719 -8.762 1.00 0.00 H new ATOM 2906 N ARG B 106 17.018 0.366 -11.396 1.00 0.00 N ATOM 2907 CA ARG B 106 16.121 0.558 -12.547 1.00 0.00 C ATOM 2908 C ARG B 106 16.559 -0.290 -13.752 1.00 0.00 C ATOM 2909 O ARG B 106 17.118 0.238 -14.715 1.00 0.00 O ATOM 2910 CB ARG B 106 15.982 2.067 -12.867 1.00 0.00 C ATOM 2911 CG ARG B 106 14.671 2.473 -13.564 1.00 0.00 C ATOM 2912 CD ARG B 106 14.375 1.733 -14.873 1.00 0.00 C ATOM 2913 NE ARG B 106 13.234 2.337 -15.584 1.00 0.00 N ATOM 2914 CZ ARG B 106 12.442 1.706 -16.446 1.00 0.00 C ATOM 2915 NH1 ARG B 106 12.649 0.455 -16.800 1.00 0.00 N ATOM 2916 NH2 ARG B 106 11.412 2.342 -16.963 1.00 0.00 N ATOM 0 H ARG B 106 17.962 0.075 -11.651 1.00 0.00 H new ATOM 0 HA ARG B 106 15.126 0.197 -12.289 1.00 0.00 H new ATOM 0 HB2 ARG B 106 16.069 2.628 -11.937 1.00 0.00 H new ATOM 0 HB3 ARG B 106 16.818 2.366 -13.499 1.00 0.00 H new ATOM 0 HG2 ARG B 106 13.844 2.305 -12.874 1.00 0.00 H new ATOM 0 HG3 ARG B 106 14.703 3.543 -13.769 1.00 0.00 H new ATOM 0 HD2 ARG B 106 15.257 1.754 -15.513 1.00 0.00 H new ATOM 0 HD3 ARG B 106 14.161 0.686 -14.661 1.00 0.00 H new ATOM 0 HE ARG B 106 13.035 3.320 -15.400 1.00 0.00 H new ATOM 0 HH11 ARG B 106 13.437 -0.062 -16.410 1.00 0.00 H new ATOM 0 HH12 ARG B 106 12.021 0.002 -17.464 1.00 0.00 H new ATOM 0 HH21 ARG B 106 11.227 3.310 -16.702 1.00 0.00 H new ATOM 0 HH22 ARG B 106 10.799 1.866 -17.625 1.00 0.00 H new TER 2930 ARG B 106 HETATM 2931 CD CD A 107 11.820 -0.509 -1.443 1.00 0.00 CD HETATM 2932 CD CD B 107 -1.453 -13.816 1.030 1.00 0.00 CD