USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 666 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 53 SER OG : rot 180:sc= 0.382 USER MOD Set 1.2: B 83 ASN : amide:sc= -1.26 K(o=-1.4,f=-7.7!) USER MOD Set 1.3: B 85 GLN : amide:sc= -0.525 X(o=-1.4,f=-1.2) USER MOD Set 2.1: B 78 ASN : amide:sc= 1.05 K(o=3.5,f=-4.4!) USER MOD Set 2.2: B 81 LYS NZ :NH3+ 156:sc= 2.47 (180deg=0.0372) USER MOD Set 3.1: B 63 THR OG1 : rot -57:sc= 1.73 USER MOD Set 3.2: B 75 GLN : amide:sc= 0.229! K(o=2!,f=-4.7) USER MOD Set 4.1: B 72 GLN : amide:sc= 1.92 K(o=5,f=-7.4) USER MOD Set 4.2: B 73 GLN : amide:sc= 2.23 K(o=5,f=-5.2) USER MOD Set 4.3: B 74 GLN : amide:sc= 0.826! C(o=5!,f=-1.8!) USER MOD Set 5.1: B 66 SER OG : rot -97:sc= 2.1 USER MOD Set 5.2: B 71 GLN : amide:sc= 0.683 K(o=2.8,f=0.075) USER MOD Set 6.1: A 18 SER OG : rot -99:sc= 2.06 USER MOD Set 6.2: B 93 GLN : amide:sc= 0.813 K(o=2.9,f=-1.8!) USER MOD Single : A 12 GLN : amide:sc= 1.04 K(o=1,f=-1.9) USER MOD Single : A 14 HIS : no HD1:sc= -0.944 K(o=-0.94,f=-5.4!) USER MOD Single : A 15 THR OG1 : rot 88:sc= 1.23 USER MOD Single : A 19 ASN : amide:sc= 1.07 K(o=1.1,f=-4!) USER MOD Single : A 20 THR OG1 : rot -75:sc= 1.22 USER MOD Single : A 23 THR OG1 : rot 98:sc= 1.29 USER MOD Single : B 51 SER OG : rot 37:sc=-0.00182 USER MOD Single : B 55 SER OG : rot 180:sc= 0.0528 USER MOD Single : B 58 GLN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : B 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 SER OG : rot 145:sc= 1.19 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 82 SER OG : rot -94:sc= 1.22 USER MOD Single : B 87 MET CE :methyl 142:sc= -1.17 (180deg=-2.67) USER MOD Single : B 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 95 THR OG1 : rot 80:sc= 1.16 USER MOD Single : B 97 LYS NZ :NH3+ 159:sc= 1.07 (180deg=0.664) USER MOD Single : B 98 TYR OH : rot 154:sc= 1.85 USER MOD ----------------------------------------------------------------- ATOM 65 N GLU A 6 11.712 -10.566 -2.780 1.00 10.00 N ATOM 66 CA GLU A 6 10.477 -9.908 -3.131 1.00 10.00 C ATOM 67 C GLU A 6 9.515 -9.879 -1.959 1.00 10.00 C ATOM 68 O GLU A 6 9.139 -8.795 -1.554 1.00 10.00 O ATOM 69 CB GLU A 6 9.772 -10.411 -4.392 1.00 10.00 C ATOM 70 CG GLU A 6 8.590 -9.457 -4.634 1.00 10.00 C ATOM 71 CD GLU A 6 8.140 -9.387 -6.080 1.00 10.00 C ATOM 72 OE1 GLU A 6 7.719 -10.434 -6.624 1.00 10.00 O ATOM 73 OE2 GLU A 6 8.172 -8.260 -6.634 1.00 10.00 O ATOM 0 HA GLU A 6 10.793 -8.896 -3.384 1.00 10.00 H new ATOM 0 HB2 GLU A 6 10.452 -10.412 -5.244 1.00 10.00 H new ATOM 0 HB3 GLU A 6 9.424 -11.436 -4.261 1.00 10.00 H new ATOM 0 HG2 GLU A 6 7.749 -9.774 -4.017 1.00 10.00 H new ATOM 0 HG3 GLU A 6 8.870 -8.457 -4.302 1.00 10.00 H new ATOM 80 N ARG A 7 9.122 -11.028 -1.403 1.00 10.00 N ATOM 81 CA ARG A 7 8.015 -11.011 -0.430 1.00 10.00 C ATOM 82 C ARG A 7 8.307 -10.136 0.780 1.00 10.00 C ATOM 83 O ARG A 7 7.422 -9.401 1.188 1.00 10.00 O ATOM 84 CB ARG A 7 7.551 -12.424 -0.045 1.00 10.00 C ATOM 85 CG ARG A 7 6.113 -12.711 -0.510 1.00 10.00 C ATOM 86 CD ARG A 7 5.035 -11.766 0.065 1.00 10.00 C ATOM 87 NE ARG A 7 4.964 -11.787 1.530 1.00 10.00 N ATOM 88 CZ ARG A 7 4.341 -12.646 2.314 1.00 10.00 C ATOM 89 NH1 ARG A 7 3.732 -13.713 1.849 1.00 10.00 N ATOM 90 NH2 ARG A 7 4.327 -12.421 3.602 1.00 10.00 N ATOM 0 H ARG A 7 9.528 -11.944 -1.594 1.00 10.00 H new ATOM 0 HA ARG A 7 7.172 -10.542 -0.937 1.00 10.00 H new ATOM 0 HB2 ARG A 7 8.226 -13.158 -0.484 1.00 10.00 H new ATOM 0 HB3 ARG A 7 7.611 -12.542 1.037 1.00 10.00 H new ATOM 0 HG2 ARG A 7 6.082 -12.653 -1.598 1.00 10.00 H new ATOM 0 HG3 ARG A 7 5.858 -13.735 -0.238 1.00 10.00 H new ATOM 0 HD2 ARG A 7 5.240 -10.748 -0.267 1.00 10.00 H new ATOM 0 HD3 ARG A 7 4.063 -12.045 -0.343 1.00 10.00 H new ATOM 0 HE ARG A 7 5.464 -11.036 2.007 1.00 10.00 H new ATOM 0 HH11 ARG A 7 3.729 -13.903 0.847 1.00 10.00 H new ATOM 0 HH12 ARG A 7 3.262 -14.352 2.490 1.00 10.00 H new ATOM 0 HH21 ARG A 7 4.791 -11.596 3.981 1.00 10.00 H new ATOM 0 HH22 ARG A 7 3.852 -13.071 4.228 1.00 10.00 H new ATOM 104 N ALA A 8 9.547 -10.143 1.284 1.00 10.00 N ATOM 105 CA ALA A 8 10.007 -9.223 2.311 1.00 10.00 C ATOM 106 C ALA A 8 10.002 -7.759 1.844 1.00 10.00 C ATOM 107 O ALA A 8 9.447 -6.919 2.553 1.00 10.00 O ATOM 108 CB ALA A 8 11.401 -9.653 2.785 1.00 10.00 C ATOM 0 H ALA A 8 10.264 -10.801 0.980 1.00 10.00 H new ATOM 0 HA ALA A 8 9.307 -9.270 3.145 1.00 10.00 H new ATOM 0 HB1 ALA A 8 11.751 -8.966 3.556 1.00 10.00 H new ATOM 0 HB2 ALA A 8 11.351 -10.662 3.194 1.00 10.00 H new ATOM 0 HB3 ALA A 8 12.093 -9.637 1.943 1.00 10.00 H new ATOM 114 N LEU A 9 10.565 -7.424 0.668 1.00 10.00 N ATOM 115 CA LEU A 9 10.588 -6.026 0.237 1.00 10.00 C ATOM 116 C LEU A 9 9.197 -5.498 -0.192 1.00 10.00 C ATOM 117 O LEU A 9 8.890 -4.332 0.038 1.00 10.00 O ATOM 118 CB LEU A 9 11.823 -5.701 -0.646 1.00 10.00 C ATOM 119 CG LEU A 9 11.702 -5.355 -2.137 1.00 10.00 C ATOM 120 CD1 LEU A 9 11.336 -6.539 -3.007 1.00 10.00 C ATOM 121 CD2 LEU A 9 10.783 -4.155 -2.397 1.00 10.00 C ATOM 0 H LEU A 9 10.996 -8.084 0.021 1.00 10.00 H new ATOM 0 HA LEU A 9 10.774 -5.390 1.102 1.00 10.00 H new ATOM 0 HB2 LEU A 9 12.334 -4.863 -0.172 1.00 10.00 H new ATOM 0 HB3 LEU A 9 12.490 -6.561 -0.578 1.00 10.00 H new ATOM 0 HG LEU A 9 12.707 -5.058 -2.436 1.00 10.00 H new ATOM 0 HD11 LEU A 9 11.268 -6.219 -4.047 1.00 10.00 H new ATOM 0 HD12 LEU A 9 12.101 -7.310 -2.913 1.00 10.00 H new ATOM 0 HD13 LEU A 9 10.375 -6.942 -2.688 1.00 10.00 H new ATOM 0 HD21 LEU A 9 10.736 -3.958 -3.468 1.00 10.00 H new ATOM 0 HD22 LEU A 9 9.783 -4.376 -2.025 1.00 10.00 H new ATOM 0 HD23 LEU A 9 11.176 -3.278 -1.883 1.00 10.00 H new ATOM 133 N LEU A 10 8.345 -6.354 -0.758 1.00 10.00 N ATOM 134 CA LEU A 10 6.927 -6.165 -1.077 1.00 10.00 C ATOM 135 C LEU A 10 6.125 -5.941 0.206 1.00 10.00 C ATOM 136 O LEU A 10 5.378 -4.971 0.292 1.00 10.00 O ATOM 137 CB LEU A 10 6.513 -7.417 -1.876 1.00 10.00 C ATOM 138 CG LEU A 10 5.061 -7.616 -2.329 1.00 10.00 C ATOM 139 CD1 LEU A 10 4.540 -6.519 -3.253 1.00 10.00 C ATOM 140 CD2 LEU A 10 4.967 -8.910 -3.150 1.00 10.00 C ATOM 0 H LEU A 10 8.659 -7.285 -1.031 1.00 10.00 H new ATOM 0 HA LEU A 10 6.732 -5.277 -1.678 1.00 10.00 H new ATOM 0 HB2 LEU A 10 7.134 -7.445 -2.771 1.00 10.00 H new ATOM 0 HB3 LEU A 10 6.782 -8.285 -1.274 1.00 10.00 H new ATOM 0 HG LEU A 10 4.471 -7.622 -1.412 1.00 10.00 H new ATOM 0 HD11 LEU A 10 3.507 -6.734 -3.527 1.00 10.00 H new ATOM 0 HD12 LEU A 10 4.587 -5.559 -2.740 1.00 10.00 H new ATOM 0 HD13 LEU A 10 5.154 -6.480 -4.153 1.00 10.00 H new ATOM 0 HD21 LEU A 10 3.938 -9.060 -3.476 1.00 10.00 H new ATOM 0 HD22 LEU A 10 5.617 -8.836 -4.022 1.00 10.00 H new ATOM 0 HD23 LEU A 10 5.279 -9.754 -2.535 1.00 10.00 H new ATOM 152 N ASP A 11 6.346 -6.772 1.240 1.00 10.00 N ATOM 153 CA ASP A 11 5.777 -6.578 2.578 1.00 10.00 C ATOM 154 C ASP A 11 6.157 -5.239 3.212 1.00 10.00 C ATOM 155 O ASP A 11 5.261 -4.486 3.598 1.00 10.00 O ATOM 156 CB ASP A 11 6.087 -7.765 3.503 1.00 10.00 C ATOM 157 CG ASP A 11 5.181 -8.986 3.264 1.00 10.00 C ATOM 158 OD1 ASP A 11 4.045 -8.826 2.747 1.00 10.00 O ATOM 159 OD2 ASP A 11 5.604 -10.109 3.633 1.00 10.00 O ATOM 0 H ASP A 11 6.931 -7.604 1.166 1.00 10.00 H new ATOM 0 HA ASP A 11 4.696 -6.540 2.443 1.00 10.00 H new ATOM 0 HB2 ASP A 11 7.127 -8.062 3.363 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.984 -7.444 4.539 1.00 10.00 H new ATOM 164 N GLN A 12 7.450 -4.903 3.311 1.00 10.00 N ATOM 165 CA GLN A 12 7.834 -3.601 3.882 1.00 10.00 C ATOM 166 C GLN A 12 7.342 -2.411 3.051 1.00 10.00 C ATOM 167 O GLN A 12 7.023 -1.369 3.629 1.00 10.00 O ATOM 168 CB GLN A 12 9.338 -3.542 4.205 1.00 10.00 C ATOM 169 CG GLN A 12 10.301 -3.568 3.023 1.00 10.00 C ATOM 170 CD GLN A 12 10.539 -2.233 2.349 1.00 10.00 C ATOM 171 OE1 GLN A 12 10.976 -1.262 2.955 1.00 10.00 O ATOM 172 NE2 GLN A 12 10.291 -2.161 1.061 1.00 10.00 N ATOM 0 H GLN A 12 8.228 -5.492 3.014 1.00 10.00 H new ATOM 0 HA GLN A 12 7.311 -3.509 4.834 1.00 10.00 H new ATOM 0 HB2 GLN A 12 9.527 -2.633 4.776 1.00 10.00 H new ATOM 0 HB3 GLN A 12 9.578 -4.383 4.856 1.00 10.00 H new ATOM 0 HG2 GLN A 12 11.259 -3.959 3.365 1.00 10.00 H new ATOM 0 HG3 GLN A 12 9.919 -4.268 2.280 1.00 10.00 H new ATOM 0 HE21 GLN A 12 9.927 -2.975 0.565 1.00 10.00 H new ATOM 0 HE22 GLN A 12 10.462 -1.291 0.557 1.00 10.00 H new ATOM 181 N LEU A 13 7.191 -2.563 1.723 1.00 10.00 N ATOM 182 CA LEU A 13 6.678 -1.482 0.880 1.00 10.00 C ATOM 183 C LEU A 13 5.157 -1.298 1.045 1.00 10.00 C ATOM 184 O LEU A 13 4.700 -0.152 1.128 1.00 10.00 O ATOM 185 CB LEU A 13 7.124 -1.713 -0.579 1.00 10.00 C ATOM 186 CG LEU A 13 7.056 -0.495 -1.517 1.00 10.00 C ATOM 187 CD1 LEU A 13 7.702 0.757 -0.922 1.00 10.00 C ATOM 188 CD2 LEU A 13 7.823 -0.823 -2.802 1.00 10.00 C ATOM 0 H LEU A 13 7.417 -3.420 1.218 1.00 10.00 H new ATOM 0 HA LEU A 13 7.107 -0.534 1.204 1.00 10.00 H new ATOM 0 HB2 LEU A 13 8.151 -2.079 -0.568 1.00 10.00 H new ATOM 0 HB3 LEU A 13 6.507 -2.506 -1.003 1.00 10.00 H new ATOM 0 HG LEU A 13 6.000 -0.291 -1.692 1.00 10.00 H new ATOM 0 HD11 LEU A 13 7.621 1.580 -1.632 1.00 10.00 H new ATOM 0 HD12 LEU A 13 7.192 1.025 0.004 1.00 10.00 H new ATOM 0 HD13 LEU A 13 8.753 0.560 -0.713 1.00 10.00 H new ATOM 0 HD21 LEU A 13 7.784 0.032 -3.477 1.00 10.00 H new ATOM 0 HD22 LEU A 13 8.862 -1.046 -2.559 1.00 10.00 H new ATOM 0 HD23 LEU A 13 7.370 -1.689 -3.285 1.00 10.00 H new ATOM 200 N HIS A 14 4.361 -2.382 1.151 1.00 10.00 N ATOM 201 CA HIS A 14 2.936 -2.219 1.488 1.00 10.00 C ATOM 202 C HIS A 14 2.734 -1.840 2.966 1.00 10.00 C ATOM 203 O HIS A 14 1.791 -1.109 3.275 1.00 10.00 O ATOM 204 CB HIS A 14 2.054 -3.392 1.017 1.00 10.00 C ATOM 205 CG HIS A 14 2.046 -4.638 1.862 1.00 10.00 C ATOM 206 ND1 HIS A 14 1.570 -4.728 3.164 1.00 10.00 N ATOM 207 CD2 HIS A 14 2.470 -5.869 1.452 1.00 10.00 C ATOM 208 CE1 HIS A 14 1.742 -6.007 3.528 1.00 10.00 C ATOM 209 NE2 HIS A 14 2.285 -6.720 2.519 1.00 10.00 N ATOM 0 H HIS A 14 4.667 -3.345 1.014 1.00 10.00 H new ATOM 0 HA HIS A 14 2.577 -1.368 0.909 1.00 10.00 H new ATOM 0 HB2 HIS A 14 1.028 -3.032 0.939 1.00 10.00 H new ATOM 0 HB3 HIS A 14 2.371 -3.669 0.012 1.00 10.00 H new ATOM 0 HD2 HIS A 14 2.871 -6.125 0.483 1.00 10.00 H new ATOM 0 HE1 HIS A 14 1.482 -6.411 4.495 1.00 10.00 H new ATOM 0 HE2 HIS A 14 2.517 -7.713 2.542 1.00 10.00 H new ATOM 217 N THR A 15 3.659 -2.200 3.871 1.00 10.00 N ATOM 218 CA THR A 15 3.688 -1.716 5.262 1.00 10.00 C ATOM 219 C THR A 15 3.900 -0.220 5.299 1.00 10.00 C ATOM 220 O THR A 15 3.107 0.481 5.920 1.00 10.00 O ATOM 221 CB THR A 15 4.783 -2.379 6.111 1.00 10.00 C ATOM 222 OG1 THR A 15 4.738 -3.782 6.016 1.00 10.00 O ATOM 223 CG2 THR A 15 4.608 -2.072 7.606 1.00 10.00 C ATOM 0 H THR A 15 4.419 -2.845 3.654 1.00 10.00 H new ATOM 0 HA THR A 15 2.721 -1.982 5.688 1.00 10.00 H new ATOM 0 HB THR A 15 5.721 -1.980 5.725 1.00 10.00 H new ATOM 0 HG1 THR A 15 5.283 -4.076 5.257 1.00 10.00 H new ATOM 0 HG21 THR A 15 5.402 -2.559 8.173 1.00 10.00 H new ATOM 0 HG22 THR A 15 4.657 -0.995 7.764 1.00 10.00 H new ATOM 0 HG23 THR A 15 3.641 -2.445 7.943 1.00 10.00 H new ATOM 231 N LEU A 16 4.924 0.295 4.606 1.00 10.00 N ATOM 232 CA LEU A 16 5.130 1.723 4.410 1.00 10.00 C ATOM 233 C LEU A 16 3.832 2.392 3.920 1.00 10.00 C ATOM 234 O LEU A 16 3.370 3.336 4.555 1.00 10.00 O ATOM 235 CB LEU A 16 6.287 1.912 3.406 1.00 10.00 C ATOM 236 CG LEU A 16 6.551 3.382 3.007 1.00 10.00 C ATOM 237 CD1 LEU A 16 7.571 4.037 3.941 1.00 10.00 C ATOM 238 CD2 LEU A 16 7.038 3.434 1.557 1.00 10.00 C ATOM 0 H LEU A 16 5.638 -0.282 4.163 1.00 10.00 H new ATOM 0 HA LEU A 16 5.395 2.202 5.352 1.00 10.00 H new ATOM 0 HB2 LEU A 16 7.198 1.496 3.837 1.00 10.00 H new ATOM 0 HB3 LEU A 16 6.069 1.337 2.506 1.00 10.00 H new ATOM 0 HG LEU A 16 5.620 3.941 3.097 1.00 10.00 H new ATOM 0 HD11 LEU A 16 7.735 5.070 3.634 1.00 10.00 H new ATOM 0 HD12 LEU A 16 7.193 4.018 4.963 1.00 10.00 H new ATOM 0 HD13 LEU A 16 8.513 3.490 3.892 1.00 10.00 H new ATOM 0 HD21 LEU A 16 7.225 4.470 1.273 1.00 10.00 H new ATOM 0 HD22 LEU A 16 7.959 2.860 1.462 1.00 10.00 H new ATOM 0 HD23 LEU A 16 6.277 3.010 0.902 1.00 10.00 H new ATOM 250 N LEU A 17 3.215 1.905 2.840 1.00 10.00 N ATOM 251 CA LEU A 17 1.939 2.438 2.352 1.00 10.00 C ATOM 252 C LEU A 17 0.742 2.239 3.301 1.00 10.00 C ATOM 253 O LEU A 17 -0.333 2.761 3.031 1.00 10.00 O ATOM 254 CB LEU A 17 1.639 1.912 0.947 1.00 10.00 C ATOM 255 CG LEU A 17 2.533 2.467 -0.186 1.00 10.00 C ATOM 256 CD1 LEU A 17 2.802 1.417 -1.272 1.00 10.00 C ATOM 257 CD2 LEU A 17 2.045 3.735 -0.870 1.00 10.00 C ATOM 0 H LEU A 17 3.583 1.135 2.282 1.00 10.00 H new ATOM 0 HA LEU A 17 2.072 3.519 2.313 1.00 10.00 H new ATOM 0 HB2 LEU A 17 1.733 0.826 0.959 1.00 10.00 H new ATOM 0 HB3 LEU A 17 0.600 2.140 0.709 1.00 10.00 H new ATOM 0 HG LEU A 17 3.445 2.731 0.349 1.00 10.00 H new ATOM 0 HD11 LEU A 17 3.434 1.850 -2.048 1.00 10.00 H new ATOM 0 HD12 LEU A 17 3.307 0.558 -0.830 1.00 10.00 H new ATOM 0 HD13 LEU A 17 1.857 1.097 -1.710 1.00 10.00 H new ATOM 0 HD21 LEU A 17 2.754 4.026 -1.645 1.00 10.00 H new ATOM 0 HD22 LEU A 17 1.069 3.553 -1.321 1.00 10.00 H new ATOM 0 HD23 LEU A 17 1.962 4.536 -0.135 1.00 10.00 H new ATOM 269 N SER A 18 0.870 1.540 4.438 1.00 10.00 N ATOM 270 CA SER A 18 -0.257 1.171 5.314 1.00 10.00 C ATOM 271 C SER A 18 0.026 1.315 6.814 1.00 10.00 C ATOM 272 O SER A 18 -0.747 0.859 7.659 1.00 10.00 O ATOM 273 CB SER A 18 -0.703 -0.227 4.946 1.00 10.00 C ATOM 274 OG SER A 18 0.267 -1.187 5.289 1.00 10.00 O ATOM 0 H SER A 18 1.771 1.209 4.782 1.00 10.00 H new ATOM 0 HA SER A 18 -1.062 1.885 5.141 1.00 10.00 H new ATOM 0 HB2 SER A 18 -1.639 -0.457 5.455 1.00 10.00 H new ATOM 0 HB3 SER A 18 -0.902 -0.276 3.875 1.00 10.00 H new ATOM 0 HG SER A 18 0.795 -1.416 4.496 1.00 10.00 H new ATOM 280 N ASN A 19 1.084 2.034 7.149 1.00 10.00 N ATOM 281 CA ASN A 19 1.665 2.339 8.453 1.00 10.00 C ATOM 282 C ASN A 19 0.714 2.948 9.515 1.00 10.00 C ATOM 283 O ASN A 19 1.124 3.137 10.659 1.00 10.00 O ATOM 284 CB ASN A 19 2.836 3.278 8.104 1.00 10.00 C ATOM 285 CG ASN A 19 2.309 4.656 7.693 1.00 10.00 C ATOM 286 OD1 ASN A 19 1.732 5.403 8.467 1.00 10.00 O ATOM 287 ND2 ASN A 19 2.407 5.005 6.430 1.00 10.00 N ATOM 0 H ASN A 19 1.632 2.479 6.413 1.00 10.00 H new ATOM 0 HA ASN A 19 1.957 1.418 8.958 1.00 10.00 H new ATOM 0 HB2 ASN A 19 3.500 3.377 8.963 1.00 10.00 H new ATOM 0 HB3 ASN A 19 3.425 2.850 7.293 1.00 10.00 H new ATOM 0 HD21 ASN A 19 2.005 5.887 6.112 1.00 10.00 H new ATOM 0 HD22 ASN A 19 2.885 4.394 5.768 1.00 10.00 H new ATOM 294 N THR A 20 -0.526 3.280 9.123 1.00 10.00 N ATOM 295 CA THR A 20 -1.729 3.843 9.793 1.00 10.00 C ATOM 296 C THR A 20 -2.151 5.208 9.237 1.00 10.00 C ATOM 297 O THR A 20 -3.324 5.555 9.410 1.00 10.00 O ATOM 298 CB THR A 20 -1.714 3.890 11.340 1.00 10.00 C ATOM 299 OG1 THR A 20 -0.596 4.579 11.842 1.00 10.00 O ATOM 300 CG2 THR A 20 -1.800 2.489 11.949 1.00 10.00 C ATOM 0 H THR A 20 -0.755 3.132 8.140 1.00 10.00 H new ATOM 0 HA THR A 20 -2.479 3.095 9.536 1.00 10.00 H new ATOM 0 HB THR A 20 -2.603 4.446 11.638 1.00 10.00 H new ATOM 0 HG1 THR A 20 0.201 4.015 11.758 1.00 10.00 H new ATOM 0 HG21 THR A 20 -1.787 2.563 13.036 1.00 10.00 H new ATOM 0 HG22 THR A 20 -2.725 2.009 11.629 1.00 10.00 H new ATOM 0 HG23 THR A 20 -0.949 1.895 11.616 1.00 10.00 H new ATOM 308 N ASP A 21 -1.278 5.928 8.513 1.00 10.00 N ATOM 309 CA ASP A 21 -1.652 7.175 7.840 1.00 10.00 C ATOM 310 C ASP A 21 -2.659 6.974 6.686 1.00 10.00 C ATOM 311 O ASP A 21 -2.676 5.952 5.987 1.00 10.00 O ATOM 312 CB ASP A 21 -0.405 7.927 7.342 1.00 10.00 C ATOM 313 CG ASP A 21 -0.758 9.284 6.691 1.00 10.00 C ATOM 314 OD1 ASP A 21 -1.654 9.980 7.238 1.00 10.00 O ATOM 315 OD2 ASP A 21 -0.220 9.577 5.596 1.00 10.00 O ATOM 0 H ASP A 21 -0.302 5.662 8.381 1.00 10.00 H new ATOM 0 HA ASP A 21 -2.160 7.780 8.591 1.00 10.00 H new ATOM 0 HB2 ASP A 21 0.274 8.094 8.178 1.00 10.00 H new ATOM 0 HB3 ASP A 21 0.126 7.307 6.619 1.00 10.00 H new ATOM 320 N ALA A 22 -3.475 7.994 6.472 1.00 10.00 N ATOM 321 CA ALA A 22 -4.383 8.182 5.346 1.00 10.00 C ATOM 322 C ALA A 22 -4.414 9.628 4.805 1.00 10.00 C ATOM 323 O ALA A 22 -5.055 9.886 3.791 1.00 10.00 O ATOM 324 CB ALA A 22 -5.786 7.724 5.774 1.00 10.00 C ATOM 0 H ALA A 22 -3.525 8.772 7.130 1.00 10.00 H new ATOM 0 HA ALA A 22 -4.015 7.578 4.516 1.00 10.00 H new ATOM 0 HB1 ALA A 22 -6.481 7.857 4.945 1.00 10.00 H new ATOM 0 HB2 ALA A 22 -5.755 6.672 6.056 1.00 10.00 H new ATOM 0 HB3 ALA A 22 -6.119 8.318 6.625 1.00 10.00 H new ATOM 330 N THR A 23 -3.680 10.562 5.438 1.00 10.00 N ATOM 331 CA THR A 23 -3.740 12.014 5.232 1.00 10.00 C ATOM 332 C THR A 23 -3.648 12.429 3.767 1.00 10.00 C ATOM 333 O THR A 23 -4.525 13.134 3.273 1.00 10.00 O ATOM 334 CB THR A 23 -2.662 12.721 6.064 1.00 10.00 C ATOM 335 OG1 THR A 23 -2.646 12.265 7.402 1.00 10.00 O ATOM 336 CG2 THR A 23 -2.871 14.234 6.123 1.00 10.00 C ATOM 0 H THR A 23 -2.992 10.305 6.146 1.00 10.00 H new ATOM 0 HA THR A 23 -4.726 12.329 5.573 1.00 10.00 H new ATOM 0 HB THR A 23 -1.723 12.487 5.562 1.00 10.00 H new ATOM 0 HG1 THR A 23 -1.947 11.587 7.508 1.00 10.00 H new ATOM 0 HG21 THR A 23 -2.082 14.687 6.723 1.00 10.00 H new ATOM 0 HG22 THR A 23 -2.841 14.645 5.114 1.00 10.00 H new ATOM 0 HG23 THR A 23 -3.840 14.450 6.574 1.00 10.00 H new ATOM 344 N GLY A 24 -2.610 11.970 3.064 1.00 10.00 N ATOM 345 CA GLY A 24 -2.499 12.140 1.614 1.00 10.00 C ATOM 346 C GLY A 24 -2.876 10.896 0.819 1.00 10.00 C ATOM 347 O GLY A 24 -3.297 11.017 -0.335 1.00 10.00 O ATOM 0 H GLY A 24 -1.825 11.471 3.483 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -3.139 12.966 1.304 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -1.475 12.421 1.368 1.00 10.00 H new ATOM 351 N LEU A 25 -2.761 9.709 1.424 1.00 10.00 N ATOM 352 CA LEU A 25 -3.082 8.446 0.765 1.00 10.00 C ATOM 353 C LEU A 25 -4.563 8.340 0.401 1.00 10.00 C ATOM 354 O LEU A 25 -4.869 7.657 -0.578 1.00 10.00 O ATOM 355 CB LEU A 25 -2.601 7.253 1.599 1.00 10.00 C ATOM 356 CG LEU A 25 -1.077 7.061 1.504 1.00 10.00 C ATOM 357 CD1 LEU A 25 -0.267 8.053 2.352 1.00 10.00 C ATOM 358 CD2 LEU A 25 -0.711 5.661 1.965 1.00 10.00 C ATOM 0 H LEU A 25 -2.442 9.601 2.387 1.00 10.00 H new ATOM 0 HA LEU A 25 -2.539 8.424 -0.180 1.00 10.00 H new ATOM 0 HB2 LEU A 25 -2.884 7.402 2.641 1.00 10.00 H new ATOM 0 HB3 LEU A 25 -3.103 6.347 1.259 1.00 10.00 H new ATOM 0 HG LEU A 25 -0.824 7.233 0.458 1.00 10.00 H new ATOM 0 HD11 LEU A 25 0.797 7.851 2.230 1.00 10.00 H new ATOM 0 HD12 LEU A 25 -0.483 9.071 2.027 1.00 10.00 H new ATOM 0 HD13 LEU A 25 -0.540 7.942 3.401 1.00 10.00 H new ATOM 0 HD21 LEU A 25 0.369 5.526 1.897 1.00 10.00 H new ATOM 0 HD22 LEU A 25 -1.030 5.523 2.998 1.00 10.00 H new ATOM 0 HD23 LEU A 25 -1.209 4.927 1.331 1.00 10.00 H new ATOM 370 N GLU A 26 -5.448 9.069 1.098 1.00 10.00 N ATOM 371 CA GLU A 26 -6.849 9.250 0.718 1.00 10.00 C ATOM 372 C GLU A 26 -6.976 9.614 -0.770 1.00 10.00 C ATOM 373 O GLU A 26 -7.817 9.036 -1.447 1.00 10.00 O ATOM 374 CB GLU A 26 -7.458 10.331 1.638 1.00 10.00 C ATOM 375 CG GLU A 26 -8.657 11.118 1.085 1.00 10.00 C ATOM 376 CD GLU A 26 -9.869 10.275 0.662 1.00 10.00 C ATOM 377 OE1 GLU A 26 -10.028 9.150 1.183 1.00 10.00 O ATOM 378 OE2 GLU A 26 -10.651 10.793 -0.174 1.00 10.00 O ATOM 0 H GLU A 26 -5.200 9.557 1.959 1.00 10.00 H new ATOM 0 HA GLU A 26 -7.400 8.318 0.847 1.00 10.00 H new ATOM 0 HB2 GLU A 26 -7.766 9.852 2.567 1.00 10.00 H new ATOM 0 HB3 GLU A 26 -6.672 11.043 1.892 1.00 10.00 H new ATOM 0 HG2 GLU A 26 -8.981 11.831 1.843 1.00 10.00 H new ATOM 0 HG3 GLU A 26 -8.322 11.697 0.224 1.00 10.00 H new ATOM 385 N GLU A 27 -6.135 10.506 -1.311 1.00 10.00 N ATOM 386 CA GLU A 27 -6.179 10.904 -2.717 1.00 10.00 C ATOM 387 C GLU A 27 -5.894 9.725 -3.663 1.00 10.00 C ATOM 388 O GLU A 27 -6.671 9.447 -4.575 1.00 10.00 O ATOM 389 CB GLU A 27 -5.164 12.036 -2.950 1.00 10.00 C ATOM 390 CG GLU A 27 -5.263 12.698 -4.328 1.00 10.00 C ATOM 391 CD GLU A 27 -6.482 13.610 -4.395 1.00 10.00 C ATOM 392 OE1 GLU A 27 -6.440 14.692 -3.766 1.00 10.00 O ATOM 393 OE2 GLU A 27 -7.533 13.173 -4.912 1.00 10.00 O ATOM 0 H GLU A 27 -5.401 10.973 -0.778 1.00 10.00 H new ATOM 0 HA GLU A 27 -7.187 11.253 -2.942 1.00 10.00 H new ATOM 0 HB2 GLU A 27 -5.305 12.798 -2.183 1.00 10.00 H new ATOM 0 HB3 GLU A 27 -4.157 11.638 -2.823 1.00 10.00 H new ATOM 0 HG2 GLU A 27 -4.359 13.274 -4.527 1.00 10.00 H new ATOM 0 HG3 GLU A 27 -5.331 11.933 -5.102 1.00 10.00 H new ATOM 400 N ILE A 28 -4.790 9.003 -3.412 1.00 10.00 N ATOM 401 CA ILE A 28 -4.406 7.806 -4.167 1.00 10.00 C ATOM 402 C ILE A 28 -5.508 6.745 -4.053 1.00 10.00 C ATOM 403 O ILE A 28 -5.845 6.082 -5.034 1.00 10.00 O ATOM 404 CB ILE A 28 -3.061 7.220 -3.653 1.00 10.00 C ATOM 405 CG1 ILE A 28 -1.976 8.247 -3.284 1.00 10.00 C ATOM 406 CG2 ILE A 28 -2.523 6.221 -4.687 1.00 10.00 C ATOM 407 CD1 ILE A 28 -1.515 9.137 -4.440 1.00 10.00 C ATOM 0 H ILE A 28 -4.133 9.240 -2.669 1.00 10.00 H new ATOM 0 HA ILE A 28 -4.275 8.092 -5.211 1.00 10.00 H new ATOM 0 HB ILE A 28 -3.297 6.733 -2.707 1.00 10.00 H new ATOM 0 HG12 ILE A 28 -2.354 8.883 -2.483 1.00 10.00 H new ATOM 0 HG13 ILE A 28 -1.112 7.715 -2.887 1.00 10.00 H new ATOM 0 HG21 ILE A 28 -1.579 5.805 -4.334 1.00 10.00 H new ATOM 0 HG22 ILE A 28 -3.245 5.416 -4.825 1.00 10.00 H new ATOM 0 HG23 ILE A 28 -2.362 6.731 -5.637 1.00 10.00 H new ATOM 0 HD11 ILE A 28 -0.750 9.828 -4.085 1.00 10.00 H new ATOM 0 HD12 ILE A 28 -1.102 8.516 -5.235 1.00 10.00 H new ATOM 0 HD13 ILE A 28 -2.364 9.702 -4.825 1.00 10.00 H new ATOM 419 N ASP A 29 -6.083 6.596 -2.860 1.00 10.00 N ATOM 420 CA ASP A 29 -7.047 5.562 -2.534 1.00 10.00 C ATOM 421 C ASP A 29 -8.408 5.874 -3.159 1.00 10.00 C ATOM 422 O ASP A 29 -9.028 4.963 -3.715 1.00 10.00 O ATOM 423 CB ASP A 29 -7.048 5.393 -1.008 1.00 10.00 C ATOM 424 CG ASP A 29 -5.793 4.650 -0.503 1.00 10.00 C ATOM 425 OD1 ASP A 29 -4.921 4.246 -1.300 1.00 10.00 O ATOM 426 OD2 ASP A 29 -5.718 4.464 0.731 1.00 10.00 O ATOM 0 H ASP A 29 -5.880 7.214 -2.074 1.00 10.00 H new ATOM 0 HA ASP A 29 -6.777 4.598 -2.965 1.00 10.00 H new ATOM 0 HB2 ASP A 29 -7.102 6.374 -0.536 1.00 10.00 H new ATOM 0 HB3 ASP A 29 -7.940 4.844 -0.706 1.00 10.00 H new ATOM 431 N ARG A 30 -8.857 7.148 -3.183 1.00 10.00 N ATOM 432 CA ARG A 30 -10.046 7.523 -3.959 1.00 10.00 C ATOM 433 C ARG A 30 -9.806 7.417 -5.465 1.00 10.00 C ATOM 434 O ARG A 30 -10.700 6.951 -6.169 1.00 10.00 O ATOM 435 CB ARG A 30 -10.609 8.886 -3.520 1.00 10.00 C ATOM 436 CG ARG A 30 -9.761 10.107 -3.884 1.00 10.00 C ATOM 437 CD ARG A 30 -10.494 11.382 -3.463 1.00 10.00 C ATOM 438 NE ARG A 30 -9.578 12.527 -3.296 1.00 10.00 N ATOM 439 CZ ARG A 30 -9.500 13.362 -2.264 1.00 10.00 C ATOM 440 NH1 ARG A 30 -10.191 13.204 -1.159 1.00 10.00 N ATOM 441 NH2 ARG A 30 -8.701 14.404 -2.318 1.00 10.00 N ATOM 0 H ARG A 30 -8.418 7.919 -2.680 1.00 10.00 H new ATOM 0 HA ARG A 30 -10.826 6.795 -3.736 1.00 10.00 H new ATOM 0 HB2 ARG A 30 -11.597 9.009 -3.963 1.00 10.00 H new ATOM 0 HB3 ARG A 30 -10.744 8.871 -2.438 1.00 10.00 H new ATOM 0 HG2 ARG A 30 -8.792 10.051 -3.388 1.00 10.00 H new ATOM 0 HG3 ARG A 30 -9.569 10.123 -4.957 1.00 10.00 H new ATOM 0 HD2 ARG A 30 -11.247 11.629 -4.211 1.00 10.00 H new ATOM 0 HD3 ARG A 30 -11.022 11.202 -2.526 1.00 10.00 H new ATOM 0 HE ARG A 30 -8.928 12.698 -4.063 1.00 10.00 H new ATOM 0 HH11 ARG A 30 -10.825 12.411 -1.063 1.00 10.00 H new ATOM 0 HH12 ARG A 30 -10.094 13.875 -0.397 1.00 10.00 H new ATOM 0 HH21 ARG A 30 -8.139 14.573 -3.152 1.00 10.00 H new ATOM 0 HH22 ARG A 30 -8.642 15.043 -1.525 1.00 10.00 H new ATOM 455 N ALA A 31 -8.593 7.715 -5.960 1.00 10.00 N ATOM 456 CA ALA A 31 -8.218 7.457 -7.363 1.00 10.00 C ATOM 457 C ALA A 31 -8.278 5.961 -7.743 1.00 10.00 C ATOM 458 O ALA A 31 -8.388 5.637 -8.928 1.00 10.00 O ATOM 459 CB ALA A 31 -6.837 8.063 -7.651 1.00 10.00 C ATOM 0 H ALA A 31 -7.849 8.138 -5.405 1.00 10.00 H new ATOM 0 HA ALA A 31 -8.959 7.945 -7.996 1.00 10.00 H new ATOM 0 HB1 ALA A 31 -6.564 7.870 -8.688 1.00 10.00 H new ATOM 0 HB2 ALA A 31 -6.869 9.139 -7.478 1.00 10.00 H new ATOM 0 HB3 ALA A 31 -6.097 7.611 -6.991 1.00 10.00 H new ATOM 465 N LEU A 32 -8.241 5.060 -6.748 1.00 10.00 N ATOM 466 CA LEU A 32 -8.392 3.611 -6.898 1.00 10.00 C ATOM 467 C LEU A 32 -9.755 3.106 -6.347 1.00 10.00 C ATOM 468 O LEU A 32 -9.951 1.896 -6.226 1.00 10.00 O ATOM 469 CB LEU A 32 -7.156 2.919 -6.287 1.00 10.00 C ATOM 470 CG LEU A 32 -5.825 3.340 -6.932 1.00 10.00 C ATOM 471 CD1 LEU A 32 -4.671 2.908 -6.032 1.00 10.00 C ATOM 472 CD2 LEU A 32 -5.666 2.758 -8.334 1.00 10.00 C ATOM 0 H LEU A 32 -8.099 5.338 -5.777 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.426 3.344 -7.954 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -7.118 3.140 -5.220 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -7.271 1.839 -6.385 1.00 10.00 H new ATOM 0 HG LEU A 32 -5.819 4.425 -7.037 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -3.725 3.204 -6.486 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -4.771 3.385 -5.057 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -4.691 1.825 -5.909 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -4.713 3.079 -8.755 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -5.691 1.670 -8.281 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.480 3.109 -8.968 1.00 10.00 H new ATOM 484 N GLY A 33 -10.694 4.014 -6.025 1.00 10.00 N ATOM 485 CA GLY A 33 -12.046 3.705 -5.545 1.00 10.00 C ATOM 486 C GLY A 33 -12.116 3.076 -4.144 1.00 10.00 C ATOM 487 O GLY A 33 -13.186 2.654 -3.712 1.00 10.00 O ATOM 0 H GLY A 33 -10.523 5.017 -6.096 1.00 10.00 H new ATOM 0 HA2 GLY A 33 -12.632 4.624 -5.543 1.00 10.00 H new ATOM 0 HA3 GLY A 33 -12.520 3.026 -6.254 1.00 10.00 H new ATOM 491 N ILE A 34 -10.995 2.998 -3.419 1.00 10.00 N ATOM 492 CA ILE A 34 -10.831 2.263 -2.158 1.00 10.00 C ATOM 493 C ILE A 34 -11.862 2.601 -1.064 1.00 10.00 C ATOM 494 O ILE A 34 -12.440 1.655 -0.525 1.00 10.00 O ATOM 495 CB ILE A 34 -9.358 2.289 -1.719 1.00 10.00 C ATOM 496 CG1 ILE A 34 -8.484 1.615 -2.819 1.00 10.00 C ATOM 497 CG2 ILE A 34 -9.161 1.600 -0.374 1.00 10.00 C ATOM 498 CD1 ILE A 34 -6.991 1.557 -2.495 1.00 10.00 C ATOM 0 H ILE A 34 -10.137 3.467 -3.708 1.00 10.00 H new ATOM 0 HA ILE A 34 -11.082 1.220 -2.352 1.00 10.00 H new ATOM 0 HB ILE A 34 -9.049 3.327 -1.594 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -8.847 0.600 -2.983 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -8.619 2.157 -3.755 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -8.108 1.638 -0.096 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -9.755 2.108 0.386 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -9.479 0.560 -0.448 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -6.459 1.073 -3.314 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -6.608 2.569 -2.362 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -6.840 0.988 -1.578 1.00 10.00 H new ATOM 510 N PRO A 35 -12.191 3.876 -0.765 1.00 10.00 N ATOM 511 CA PRO A 35 -13.299 4.214 0.120 1.00 10.00 C ATOM 512 C PRO A 35 -14.637 3.568 -0.291 1.00 10.00 C ATOM 513 O PRO A 35 -15.349 3.054 0.574 1.00 10.00 O ATOM 514 CB PRO A 35 -13.365 5.743 0.126 1.00 10.00 C ATOM 515 CG PRO A 35 -11.915 6.144 -0.140 1.00 10.00 C ATOM 516 CD PRO A 35 -11.477 5.086 -1.148 1.00 10.00 C ATOM 0 HA PRO A 35 -13.126 3.814 1.119 1.00 10.00 H new ATOM 0 HB2 PRO A 35 -14.037 6.122 -0.644 1.00 10.00 H new ATOM 0 HB3 PRO A 35 -13.723 6.129 1.080 1.00 10.00 H new ATOM 0 HG2 PRO A 35 -11.838 7.152 -0.547 1.00 10.00 H new ATOM 0 HG3 PRO A 35 -11.311 6.119 0.767 1.00 10.00 H new ATOM 0 HD2 PRO A 35 -11.726 5.385 -2.166 1.00 10.00 H new ATOM 0 HD3 PRO A 35 -10.398 4.934 -1.116 1.00 10.00 H new ATOM 524 N GLU A 36 -14.975 3.511 -1.586 1.00 10.00 N ATOM 525 CA GLU A 36 -16.179 2.805 -2.041 1.00 10.00 C ATOM 526 C GLU A 36 -16.017 1.280 -2.041 1.00 10.00 C ATOM 527 O GLU A 36 -17.011 0.588 -1.851 1.00 10.00 O ATOM 528 CB GLU A 36 -16.667 3.317 -3.412 1.00 10.00 C ATOM 529 CG GLU A 36 -17.499 4.599 -3.293 1.00 10.00 C ATOM 530 CD GLU A 36 -18.726 4.380 -2.393 1.00 10.00 C ATOM 531 OE1 GLU A 36 -19.682 3.717 -2.853 1.00 10.00 O ATOM 532 OE2 GLU A 36 -18.669 4.830 -1.224 1.00 10.00 O ATOM 0 H GLU A 36 -14.434 3.944 -2.334 1.00 10.00 H new ATOM 0 HA GLU A 36 -16.952 3.035 -1.307 1.00 10.00 H new ATOM 0 HB2 GLU A 36 -15.807 3.504 -4.055 1.00 10.00 H new ATOM 0 HB3 GLU A 36 -17.264 2.543 -3.895 1.00 10.00 H new ATOM 0 HG2 GLU A 36 -16.883 5.400 -2.884 1.00 10.00 H new ATOM 0 HG3 GLU A 36 -17.823 4.919 -4.283 1.00 10.00 H new ATOM 539 N LEU A 37 -14.796 0.734 -2.155 1.00 10.00 N ATOM 540 CA LEU A 37 -14.566 -0.698 -1.931 1.00 10.00 C ATOM 541 C LEU A 37 -14.792 -1.077 -0.454 1.00 10.00 C ATOM 542 O LEU A 37 -15.296 -2.166 -0.177 1.00 10.00 O ATOM 543 CB LEU A 37 -13.159 -1.110 -2.403 1.00 10.00 C ATOM 544 CG LEU A 37 -12.912 -0.945 -3.917 1.00 10.00 C ATOM 545 CD1 LEU A 37 -11.440 -1.243 -4.235 1.00 10.00 C ATOM 546 CD2 LEU A 37 -13.791 -1.884 -4.738 1.00 10.00 C ATOM 0 H LEU A 37 -13.958 1.261 -2.400 1.00 10.00 H new ATOM 0 HA LEU A 37 -15.294 -1.250 -2.526 1.00 10.00 H new ATOM 0 HB2 LEU A 37 -12.421 -0.518 -1.862 1.00 10.00 H new ATOM 0 HB3 LEU A 37 -12.991 -2.153 -2.133 1.00 10.00 H new ATOM 0 HG LEU A 37 -13.162 0.082 -4.182 1.00 10.00 H new ATOM 0 HD11 LEU A 37 -11.268 -1.126 -5.305 1.00 10.00 H new ATOM 0 HD12 LEU A 37 -10.802 -0.550 -3.687 1.00 10.00 H new ATOM 0 HD13 LEU A 37 -11.204 -2.265 -3.939 1.00 10.00 H new ATOM 0 HD21 LEU A 37 -13.588 -1.738 -5.799 1.00 10.00 H new ATOM 0 HD22 LEU A 37 -13.574 -2.917 -4.466 1.00 10.00 H new ATOM 0 HD23 LEU A 37 -14.840 -1.669 -4.537 1.00 10.00 H new ATOM 558 N VAL A 38 -14.483 -0.176 0.491 1.00 10.00 N ATOM 559 CA VAL A 38 -14.840 -0.305 1.917 1.00 10.00 C ATOM 560 C VAL A 38 -16.358 -0.213 2.089 1.00 10.00 C ATOM 561 O VAL A 38 -16.974 -1.182 2.544 1.00 10.00 O ATOM 562 CB VAL A 38 -14.125 0.747 2.794 1.00 10.00 C ATOM 563 CG1 VAL A 38 -14.541 0.674 4.268 1.00 10.00 C ATOM 564 CG2 VAL A 38 -12.604 0.658 2.690 1.00 10.00 C ATOM 0 H VAL A 38 -13.968 0.680 0.284 1.00 10.00 H new ATOM 0 HA VAL A 38 -14.501 -1.284 2.255 1.00 10.00 H new ATOM 0 HB VAL A 38 -14.445 1.710 2.396 1.00 10.00 H new ATOM 0 HG11 VAL A 38 -14.007 1.436 4.835 1.00 10.00 H new ATOM 0 HG12 VAL A 38 -15.614 0.845 4.352 1.00 10.00 H new ATOM 0 HG13 VAL A 38 -14.298 -0.311 4.666 1.00 10.00 H new ATOM 0 HG21 VAL A 38 -12.151 1.419 3.325 1.00 10.00 H new ATOM 0 HG22 VAL A 38 -12.274 -0.329 3.014 1.00 10.00 H new ATOM 0 HG23 VAL A 38 -12.300 0.821 1.656 1.00 10.00 H new ATOM 765 N SER B 51 11.446 -9.924 -8.708 1.00 10.00 N ATOM 766 CA SER B 51 11.371 -8.944 -7.643 1.00 10.00 C ATOM 767 C SER B 51 11.148 -7.664 -8.439 1.00 10.00 C ATOM 768 O SER B 51 12.098 -7.139 -9.000 1.00 10.00 O ATOM 769 CB SER B 51 12.629 -8.863 -6.777 1.00 10.00 C ATOM 770 OG SER B 51 12.824 -10.082 -6.089 1.00 10.00 O ATOM 0 HA SER B 51 10.598 -9.174 -6.909 1.00 10.00 H new ATOM 0 HB2 SER B 51 13.496 -8.646 -7.401 1.00 10.00 H new ATOM 0 HB3 SER B 51 12.537 -8.044 -6.063 1.00 10.00 H new ATOM 0 HG SER B 51 12.556 -10.829 -6.664 1.00 10.00 H new ATOM 776 N ILE B 52 9.908 -7.178 -8.573 1.00 10.00 N ATOM 777 CA ILE B 52 9.619 -6.086 -9.525 1.00 10.00 C ATOM 778 C ILE B 52 9.792 -4.713 -8.844 1.00 10.00 C ATOM 779 O ILE B 52 9.976 -3.698 -9.512 1.00 10.00 O ATOM 780 CB ILE B 52 8.217 -6.221 -10.180 1.00 10.00 C ATOM 781 CG1 ILE B 52 7.779 -7.645 -10.605 1.00 10.00 C ATOM 782 CG2 ILE B 52 8.146 -5.340 -11.458 1.00 10.00 C ATOM 783 CD1 ILE B 52 7.258 -8.502 -9.453 1.00 10.00 C ATOM 0 H ILE B 52 9.100 -7.512 -8.048 1.00 10.00 H new ATOM 0 HA ILE B 52 10.344 -6.164 -10.335 1.00 10.00 H new ATOM 0 HB ILE B 52 7.540 -5.908 -9.385 1.00 10.00 H new ATOM 0 HG12 ILE B 52 7.002 -7.564 -11.365 1.00 10.00 H new ATOM 0 HG13 ILE B 52 8.626 -8.152 -11.068 1.00 10.00 H new ATOM 0 HG21 ILE B 52 7.161 -5.438 -11.913 1.00 10.00 H new ATOM 0 HG22 ILE B 52 8.320 -4.298 -11.191 1.00 10.00 H new ATOM 0 HG23 ILE B 52 8.907 -5.665 -12.167 1.00 10.00 H new ATOM 0 HD11 ILE B 52 6.971 -9.484 -9.830 1.00 10.00 H new ATOM 0 HD12 ILE B 52 8.040 -8.616 -8.702 1.00 10.00 H new ATOM 0 HD13 ILE B 52 6.391 -8.019 -9.003 1.00 10.00 H new ATOM 795 N SER B 53 9.849 -4.686 -7.508 1.00 10.00 N ATOM 796 CA SER B 53 9.971 -3.486 -6.680 1.00 10.00 C ATOM 797 C SER B 53 11.365 -3.083 -6.155 1.00 10.00 C ATOM 798 O SER B 53 11.377 -2.107 -5.424 1.00 10.00 O ATOM 799 CB SER B 53 8.975 -3.577 -5.508 1.00 10.00 C ATOM 800 OG SER B 53 8.939 -4.891 -4.985 1.00 10.00 O ATOM 0 H SER B 53 9.809 -5.540 -6.951 1.00 10.00 H new ATOM 0 HA SER B 53 9.745 -2.680 -7.378 1.00 10.00 H new ATOM 0 HB2 SER B 53 9.262 -2.876 -4.724 1.00 10.00 H new ATOM 0 HB3 SER B 53 7.980 -3.287 -5.846 1.00 10.00 H new ATOM 0 HG SER B 53 8.302 -4.930 -4.241 1.00 10.00 H new ATOM 806 N PRO B 54 12.553 -3.669 -6.473 1.00 10.00 N ATOM 807 CA PRO B 54 13.840 -3.191 -5.935 1.00 10.00 C ATOM 808 C PRO B 54 14.189 -1.745 -6.375 1.00 10.00 C ATOM 809 O PRO B 54 15.033 -1.078 -5.772 1.00 10.00 O ATOM 810 CB PRO B 54 14.889 -4.208 -6.380 1.00 10.00 C ATOM 811 CG PRO B 54 14.307 -4.748 -7.682 1.00 10.00 C ATOM 812 CD PRO B 54 12.801 -4.733 -7.425 1.00 10.00 C ATOM 0 HA PRO B 54 13.795 -3.124 -4.848 1.00 10.00 H new ATOM 0 HB2 PRO B 54 15.863 -3.743 -6.535 1.00 10.00 H new ATOM 0 HB3 PRO B 54 15.026 -4.997 -5.641 1.00 10.00 H new ATOM 0 HG2 PRO B 54 14.576 -4.123 -8.533 1.00 10.00 H new ATOM 0 HG3 PRO B 54 14.668 -5.753 -7.898 1.00 10.00 H new ATOM 0 HD2 PRO B 54 12.252 -4.560 -8.351 1.00 10.00 H new ATOM 0 HD3 PRO B 54 12.466 -5.692 -7.030 1.00 10.00 H new ATOM 820 N SER B 55 13.551 -1.265 -7.432 1.00 10.00 N ATOM 821 CA SER B 55 13.562 0.118 -7.880 1.00 10.00 C ATOM 822 C SER B 55 12.616 0.982 -7.035 1.00 10.00 C ATOM 823 O SER B 55 13.034 1.984 -6.448 1.00 10.00 O ATOM 824 CB SER B 55 13.149 0.129 -9.359 1.00 10.00 C ATOM 825 OG SER B 55 11.955 -0.611 -9.553 1.00 10.00 O ATOM 0 H SER B 55 12.982 -1.862 -8.032 1.00 10.00 H new ATOM 0 HA SER B 55 14.559 0.544 -7.763 1.00 10.00 H new ATOM 0 HB2 SER B 55 13.004 1.156 -9.693 1.00 10.00 H new ATOM 0 HB3 SER B 55 13.948 -0.295 -9.968 1.00 10.00 H new ATOM 0 HG SER B 55 11.708 -0.590 -10.501 1.00 10.00 H new ATOM 831 N ALA B 56 11.339 0.586 -6.915 1.00 10.00 N ATOM 832 CA ALA B 56 10.342 1.201 -6.035 1.00 10.00 C ATOM 833 C ALA B 56 10.777 1.193 -4.545 1.00 10.00 C ATOM 834 O ALA B 56 10.467 2.119 -3.796 1.00 10.00 O ATOM 835 CB ALA B 56 9.023 0.448 -6.254 1.00 10.00 C ATOM 0 H ALA B 56 10.963 -0.198 -7.448 1.00 10.00 H new ATOM 0 HA ALA B 56 10.225 2.256 -6.284 1.00 10.00 H new ATOM 0 HB1 ALA B 56 8.250 0.875 -5.615 1.00 10.00 H new ATOM 0 HB2 ALA B 56 8.722 0.537 -7.298 1.00 10.00 H new ATOM 0 HB3 ALA B 56 9.159 -0.604 -6.005 1.00 10.00 H new ATOM 841 N LEU B 57 11.616 0.242 -4.132 1.00 10.00 N ATOM 842 CA LEU B 57 12.291 0.179 -2.841 1.00 10.00 C ATOM 843 C LEU B 57 13.185 1.400 -2.591 1.00 10.00 C ATOM 844 O LEU B 57 13.480 1.696 -1.434 1.00 10.00 O ATOM 845 CB LEU B 57 13.104 -1.126 -2.853 1.00 10.00 C ATOM 846 CG LEU B 57 14.136 -1.408 -1.737 1.00 10.00 C ATOM 847 CD1 LEU B 57 13.456 -1.687 -0.397 1.00 10.00 C ATOM 848 CD2 LEU B 57 14.972 -2.615 -2.181 1.00 10.00 C ATOM 0 H LEU B 57 11.855 -0.551 -4.728 1.00 10.00 H new ATOM 0 HA LEU B 57 11.567 0.190 -2.026 1.00 10.00 H new ATOM 0 HB2 LEU B 57 12.392 -1.951 -2.851 1.00 10.00 H new ATOM 0 HB3 LEU B 57 13.636 -1.167 -3.803 1.00 10.00 H new ATOM 0 HG LEU B 57 14.767 -0.532 -1.587 1.00 10.00 H new ATOM 0 HD11 LEU B 57 14.214 -1.881 0.362 1.00 10.00 H new ATOM 0 HD12 LEU B 57 12.861 -0.822 -0.104 1.00 10.00 H new ATOM 0 HD13 LEU B 57 12.807 -2.558 -0.492 1.00 10.00 H new ATOM 0 HD21 LEU B 57 15.714 -2.845 -1.416 1.00 10.00 H new ATOM 0 HD22 LEU B 57 14.320 -3.476 -2.324 1.00 10.00 H new ATOM 0 HD23 LEU B 57 15.477 -2.383 -3.118 1.00 10.00 H new ATOM 860 N GLN B 58 13.619 2.086 -3.648 1.00 10.00 N ATOM 861 CA GLN B 58 14.284 3.381 -3.569 1.00 10.00 C ATOM 862 C GLN B 58 13.235 4.486 -3.748 1.00 10.00 C ATOM 863 O GLN B 58 13.027 5.324 -2.865 1.00 10.00 O ATOM 864 CB GLN B 58 15.410 3.430 -4.619 1.00 10.00 C ATOM 865 CG GLN B 58 16.483 2.358 -4.386 1.00 10.00 C ATOM 866 CD GLN B 58 17.217 2.032 -5.688 1.00 10.00 C ATOM 867 OE1 GLN B 58 18.069 2.776 -6.146 1.00 10.00 O ATOM 868 NE2 GLN B 58 16.952 0.896 -6.314 1.00 10.00 N ATOM 0 H GLN B 58 13.514 1.747 -4.604 1.00 10.00 H new ATOM 0 HA GLN B 58 14.751 3.536 -2.596 1.00 10.00 H new ATOM 0 HB2 GLN B 58 14.981 3.299 -5.612 1.00 10.00 H new ATOM 0 HB3 GLN B 58 15.876 4.415 -4.600 1.00 10.00 H new ATOM 0 HG2 GLN B 58 17.196 2.707 -3.639 1.00 10.00 H new ATOM 0 HG3 GLN B 58 16.021 1.455 -3.988 1.00 10.00 H new ATOM 0 HE21 GLN B 58 16.243 0.263 -5.944 1.00 10.00 H new ATOM 0 HE22 GLN B 58 17.457 0.653 -7.166 1.00 10.00 H new ATOM 877 N ASP B 59 12.565 4.469 -4.903 1.00 10.00 N ATOM 878 CA ASP B 59 11.692 5.543 -5.376 1.00 10.00 C ATOM 879 C ASP B 59 10.339 5.640 -4.651 1.00 10.00 C ATOM 880 O ASP B 59 10.005 6.693 -4.113 1.00 10.00 O ATOM 881 CB ASP B 59 11.533 5.402 -6.899 1.00 10.00 C ATOM 882 CG ASP B 59 11.548 6.748 -7.607 1.00 10.00 C ATOM 883 OD1 ASP B 59 12.637 7.341 -7.738 1.00 10.00 O ATOM 884 OD2 ASP B 59 10.465 7.287 -7.903 1.00 10.00 O ATOM 0 H ASP B 59 12.617 3.684 -5.553 1.00 10.00 H new ATOM 0 HA ASP B 59 12.172 6.491 -5.133 1.00 10.00 H new ATOM 0 HB2 ASP B 59 12.337 4.779 -7.290 1.00 10.00 H new ATOM 0 HB3 ASP B 59 10.597 4.889 -7.119 1.00 10.00 H new ATOM 889 N LEU B 60 9.550 4.554 -4.575 1.00 10.00 N ATOM 890 CA LEU B 60 8.260 4.539 -3.868 1.00 10.00 C ATOM 891 C LEU B 60 8.479 4.674 -2.356 1.00 10.00 C ATOM 892 O LEU B 60 7.728 5.365 -1.671 1.00 10.00 O ATOM 893 CB LEU B 60 7.481 3.257 -4.219 1.00 10.00 C ATOM 894 CG LEU B 60 6.048 3.107 -3.682 1.00 10.00 C ATOM 895 CD1 LEU B 60 5.210 4.375 -3.768 1.00 10.00 C ATOM 896 CD2 LEU B 60 5.338 2.058 -4.531 1.00 10.00 C ATOM 0 H LEU B 60 9.791 3.660 -5.004 1.00 10.00 H new ATOM 0 HA LEU B 60 7.663 5.392 -4.190 1.00 10.00 H new ATOM 0 HB2 LEU B 60 7.439 3.180 -5.305 1.00 10.00 H new ATOM 0 HB3 LEU B 60 8.061 2.406 -3.861 1.00 10.00 H new ATOM 0 HG LEU B 60 6.140 2.842 -2.629 1.00 10.00 H new ATOM 0 HD11 LEU B 60 4.215 4.181 -3.369 1.00 10.00 H new ATOM 0 HD12 LEU B 60 5.686 5.166 -3.188 1.00 10.00 H new ATOM 0 HD13 LEU B 60 5.129 4.687 -4.809 1.00 10.00 H new ATOM 0 HD21 LEU B 60 4.317 1.930 -4.172 1.00 10.00 H new ATOM 0 HD22 LEU B 60 5.319 2.384 -5.571 1.00 10.00 H new ATOM 0 HD23 LEU B 60 5.870 1.109 -4.457 1.00 10.00 H new ATOM 908 N LEU B 61 9.575 4.088 -1.864 1.00 10.00 N ATOM 909 CA LEU B 61 10.054 4.278 -0.506 1.00 10.00 C ATOM 910 C LEU B 61 10.261 5.765 -0.215 1.00 10.00 C ATOM 911 O LEU B 61 9.573 6.274 0.668 1.00 10.00 O ATOM 912 CB LEU B 61 11.278 3.397 -0.254 1.00 10.00 C ATOM 913 CG LEU B 61 11.490 3.076 1.240 1.00 10.00 C ATOM 914 CD1 LEU B 61 10.867 1.732 1.619 1.00 10.00 C ATOM 915 CD2 LEU B 61 12.975 3.049 1.616 1.00 10.00 C ATOM 0 H LEU B 61 10.159 3.458 -2.414 1.00 10.00 H new ATOM 0 HA LEU B 61 9.303 3.949 0.212 1.00 10.00 H new ATOM 0 HB2 LEU B 61 11.169 2.465 -0.809 1.00 10.00 H new ATOM 0 HB3 LEU B 61 12.165 3.897 -0.642 1.00 10.00 H new ATOM 0 HG LEU B 61 10.997 3.876 1.792 1.00 10.00 H new ATOM 0 HD11 LEU B 61 11.036 1.539 2.678 1.00 10.00 H new ATOM 0 HD12 LEU B 61 9.795 1.759 1.421 1.00 10.00 H new ATOM 0 HD13 LEU B 61 11.325 0.939 1.028 1.00 10.00 H new ATOM 0 HD21 LEU B 61 13.078 2.819 2.677 1.00 10.00 H new ATOM 0 HD22 LEU B 61 13.485 2.286 1.028 1.00 10.00 H new ATOM 0 HD23 LEU B 61 13.420 4.023 1.411 1.00 10.00 H new ATOM 927 N ARG B 62 11.143 6.489 -0.946 1.00 10.00 N ATOM 928 CA ARG B 62 11.311 7.928 -0.688 1.00 10.00 C ATOM 929 C ARG B 62 9.998 8.698 -0.833 1.00 10.00 C ATOM 930 O ARG B 62 9.761 9.613 -0.053 1.00 10.00 O ATOM 931 CB ARG B 62 12.478 8.566 -1.468 1.00 10.00 C ATOM 932 CG ARG B 62 12.331 8.862 -2.970 1.00 10.00 C ATOM 933 CD ARG B 62 11.456 10.066 -3.384 1.00 10.00 C ATOM 934 NE ARG B 62 11.734 10.465 -4.781 1.00 10.00 N ATOM 935 CZ ARG B 62 11.381 9.778 -5.859 1.00 10.00 C ATOM 936 NH1 ARG B 62 10.322 9.011 -5.905 1.00 10.00 N ATOM 937 NH2 ARG B 62 12.131 9.832 -6.928 1.00 10.00 N ATOM 0 H ARG B 62 11.727 6.112 -1.692 1.00 10.00 H new ATOM 0 HA ARG B 62 11.602 8.010 0.359 1.00 10.00 H new ATOM 0 HB2 ARG B 62 12.721 9.507 -0.975 1.00 10.00 H new ATOM 0 HB3 ARG B 62 13.342 7.912 -1.350 1.00 10.00 H new ATOM 0 HG2 ARG B 62 13.329 9.016 -3.380 1.00 10.00 H new ATOM 0 HG3 ARG B 62 11.924 7.971 -3.449 1.00 10.00 H new ATOM 0 HD2 ARG B 62 10.402 9.808 -3.278 1.00 10.00 H new ATOM 0 HD3 ARG B 62 11.647 10.906 -2.717 1.00 10.00 H new ATOM 0 HE ARG B 62 12.238 11.340 -4.927 1.00 10.00 H new ATOM 0 HH11 ARG B 62 9.722 8.920 -5.085 1.00 10.00 H new ATOM 0 HH12 ARG B 62 10.096 8.504 -6.761 1.00 10.00 H new ATOM 0 HH21 ARG B 62 12.979 10.399 -6.928 1.00 10.00 H new ATOM 0 HH22 ARG B 62 11.868 9.307 -7.762 1.00 10.00 H new ATOM 951 N THR B 63 9.136 8.303 -1.774 1.00 10.00 N ATOM 952 CA THR B 63 7.834 8.921 -2.084 1.00 10.00 C ATOM 953 C THR B 63 6.815 8.883 -0.961 1.00 10.00 C ATOM 954 O THR B 63 5.902 9.715 -0.994 1.00 10.00 O ATOM 955 CB THR B 63 7.301 8.256 -3.360 1.00 10.00 C ATOM 956 OG1 THR B 63 7.844 9.009 -4.432 1.00 10.00 O ATOM 957 CG2 THR B 63 5.812 8.016 -3.589 1.00 10.00 C ATOM 0 H THR B 63 9.333 7.502 -2.374 1.00 10.00 H new ATOM 0 HA THR B 63 7.999 9.989 -2.229 1.00 10.00 H new ATOM 0 HB THR B 63 7.617 7.217 -3.264 1.00 10.00 H new ATOM 0 HG1 THR B 63 7.582 9.949 -4.337 1.00 10.00 H new ATOM 0 HG21 THR B 63 5.666 7.534 -4.556 1.00 10.00 H new ATOM 0 HG22 THR B 63 5.422 7.373 -2.800 1.00 10.00 H new ATOM 0 HG23 THR B 63 5.283 8.969 -3.575 1.00 10.00 H new ATOM 965 N LEU B 64 6.982 7.968 0.004 1.00 10.00 N ATOM 966 CA LEU B 64 6.169 7.917 1.211 1.00 10.00 C ATOM 967 C LEU B 64 6.970 8.134 2.502 1.00 10.00 C ATOM 968 O LEU B 64 6.380 8.456 3.529 1.00 10.00 O ATOM 969 CB LEU B 64 5.362 6.625 1.254 1.00 10.00 C ATOM 970 CG LEU B 64 3.873 6.886 1.507 1.00 10.00 C ATOM 971 CD1 LEU B 64 3.122 7.156 0.197 1.00 10.00 C ATOM 972 CD2 LEU B 64 3.302 5.643 2.159 1.00 10.00 C ATOM 0 H LEU B 64 7.694 7.239 -0.039 1.00 10.00 H new ATOM 0 HA LEU B 64 5.478 8.759 1.160 1.00 10.00 H new ATOM 0 HB2 LEU B 64 5.481 6.091 0.311 1.00 10.00 H new ATOM 0 HB3 LEU B 64 5.755 5.978 2.038 1.00 10.00 H new ATOM 0 HG LEU B 64 3.760 7.765 2.142 1.00 10.00 H new ATOM 0 HD11 LEU B 64 2.069 7.337 0.412 1.00 10.00 H new ATOM 0 HD12 LEU B 64 3.548 8.032 -0.293 1.00 10.00 H new ATOM 0 HD13 LEU B 64 3.215 6.291 -0.460 1.00 10.00 H new ATOM 0 HD21 LEU B 64 2.240 5.790 2.356 1.00 10.00 H new ATOM 0 HD22 LEU B 64 3.433 4.790 1.493 1.00 10.00 H new ATOM 0 HD23 LEU B 64 3.822 5.453 3.098 1.00 10.00 H new ATOM 984 N LYS B 65 8.295 7.954 2.478 1.00 10.00 N ATOM 985 CA LYS B 65 9.181 8.382 3.570 1.00 10.00 C ATOM 986 C LYS B 65 9.059 9.908 3.700 1.00 10.00 C ATOM 987 O LYS B 65 9.015 10.433 4.805 1.00 10.00 O ATOM 988 CB LYS B 65 10.614 7.926 3.302 1.00 10.00 C ATOM 989 CG LYS B 65 10.773 6.428 3.592 1.00 10.00 C ATOM 990 CD LYS B 65 10.948 6.101 5.083 1.00 10.00 C ATOM 991 CE LYS B 65 11.243 4.610 5.261 1.00 10.00 C ATOM 992 NZ LYS B 65 11.330 4.221 6.689 1.00 10.00 N ATOM 0 H LYS B 65 8.785 7.508 1.702 1.00 10.00 H new ATOM 0 HA LYS B 65 8.891 7.924 4.516 1.00 10.00 H new ATOM 0 HB2 LYS B 65 10.877 8.130 2.264 1.00 10.00 H new ATOM 0 HB3 LYS B 65 11.304 8.496 3.924 1.00 10.00 H new ATOM 0 HG2 LYS B 65 9.898 5.899 3.214 1.00 10.00 H new ATOM 0 HG3 LYS B 65 11.636 6.051 3.043 1.00 10.00 H new ATOM 0 HD2 LYS B 65 11.762 6.694 5.501 1.00 10.00 H new ATOM 0 HD3 LYS B 65 10.045 6.369 5.631 1.00 10.00 H new ATOM 0 HE2 LYS B 65 10.461 4.026 4.775 1.00 10.00 H new ATOM 0 HE3 LYS B 65 12.181 4.365 4.762 1.00 10.00 H new ATOM 0 HZ1 LYS B 65 11.531 3.203 6.760 1.00 10.00 H new ATOM 0 HZ2 LYS B 65 12.093 4.757 7.149 1.00 10.00 H new ATOM 0 HZ3 LYS B 65 10.427 4.429 7.161 1.00 10.00 H new ATOM 1006 N SER B 66 8.999 10.604 2.555 1.00 10.00 N ATOM 1007 CA SER B 66 8.620 12.015 2.473 1.00 10.00 C ATOM 1008 C SER B 66 7.119 12.062 2.840 1.00 10.00 C ATOM 1009 O SER B 66 6.336 11.294 2.275 1.00 10.00 O ATOM 1010 CB SER B 66 8.921 12.586 1.081 1.00 10.00 C ATOM 1011 OG SER B 66 8.493 11.756 0.027 1.00 10.00 O ATOM 0 H SER B 66 9.217 10.192 1.648 1.00 10.00 H new ATOM 0 HA SER B 66 9.194 12.640 3.156 1.00 10.00 H new ATOM 0 HB2 SER B 66 8.439 13.559 0.985 1.00 10.00 H new ATOM 0 HB3 SER B 66 9.995 12.751 0.989 1.00 10.00 H new ATOM 0 HG SER B 66 9.247 11.219 -0.294 1.00 10.00 H new ATOM 1017 N PRO B 67 6.682 12.900 3.793 1.00 10.00 N ATOM 1018 CA PRO B 67 5.339 12.795 4.339 1.00 10.00 C ATOM 1019 C PRO B 67 4.226 13.286 3.414 1.00 10.00 C ATOM 1020 O PRO B 67 4.397 14.217 2.624 1.00 10.00 O ATOM 1021 CB PRO B 67 5.389 13.576 5.651 1.00 10.00 C ATOM 1022 CG PRO B 67 6.404 14.678 5.371 1.00 10.00 C ATOM 1023 CD PRO B 67 7.406 13.992 4.434 1.00 10.00 C ATOM 0 HA PRO B 67 5.074 11.747 4.480 1.00 10.00 H new ATOM 0 HB2 PRO B 67 4.413 13.986 5.911 1.00 10.00 H new ATOM 0 HB3 PRO B 67 5.702 12.944 6.482 1.00 10.00 H new ATOM 0 HG2 PRO B 67 5.940 15.545 4.901 1.00 10.00 H new ATOM 0 HG3 PRO B 67 6.882 15.029 6.286 1.00 10.00 H new ATOM 0 HD2 PRO B 67 7.789 14.693 3.693 1.00 10.00 H new ATOM 0 HD3 PRO B 67 8.265 13.616 4.990 1.00 10.00 H new ATOM 1031 N SER B 68 3.051 12.679 3.620 1.00 10.00 N ATOM 1032 CA SER B 68 1.794 12.695 2.863 1.00 10.00 C ATOM 1033 C SER B 68 1.144 14.081 2.658 1.00 10.00 C ATOM 1034 O SER B 68 -0.033 14.150 2.325 1.00 10.00 O ATOM 1035 CB SER B 68 0.804 11.754 3.576 1.00 10.00 C ATOM 1036 OG SER B 68 1.445 10.637 4.164 1.00 10.00 O ATOM 0 H SER B 68 2.947 12.080 4.439 1.00 10.00 H new ATOM 0 HA SER B 68 2.041 12.366 1.854 1.00 10.00 H new ATOM 0 HB2 SER B 68 0.270 12.310 4.347 1.00 10.00 H new ATOM 0 HB3 SER B 68 0.059 11.406 2.860 1.00 10.00 H new ATOM 0 HG SER B 68 0.994 10.405 5.003 1.00 10.00 H new ATOM 1042 N SER B 69 1.866 15.184 2.874 1.00 10.00 N ATOM 1043 CA SER B 69 1.391 16.552 2.658 1.00 10.00 C ATOM 1044 C SER B 69 1.383 16.895 1.158 1.00 10.00 C ATOM 1045 O SER B 69 0.338 16.717 0.534 1.00 10.00 O ATOM 1046 CB SER B 69 2.150 17.508 3.589 1.00 10.00 C ATOM 1047 OG SER B 69 1.846 18.855 3.266 1.00 10.00 O ATOM 0 H SER B 69 2.827 15.148 3.215 1.00 10.00 H new ATOM 0 HA SER B 69 0.345 16.666 2.942 1.00 10.00 H new ATOM 0 HB2 SER B 69 1.881 17.306 4.626 1.00 10.00 H new ATOM 0 HB3 SER B 69 3.223 17.339 3.499 1.00 10.00 H new ATOM 0 HG SER B 69 2.335 19.454 3.868 1.00 10.00 H new ATOM 1053 N PRO B 70 2.501 17.291 0.494 1.00 10.00 N ATOM 1054 CA PRO B 70 2.509 17.387 -0.970 1.00 10.00 C ATOM 1055 C PRO B 70 2.513 15.995 -1.628 1.00 10.00 C ATOM 1056 O PRO B 70 2.050 15.807 -2.753 1.00 10.00 O ATOM 1057 CB PRO B 70 3.780 18.164 -1.303 1.00 10.00 C ATOM 1058 CG PRO B 70 4.746 17.748 -0.201 1.00 10.00 C ATOM 1059 CD PRO B 70 3.831 17.557 1.019 1.00 10.00 C ATOM 0 HA PRO B 70 1.616 17.883 -1.349 1.00 10.00 H new ATOM 0 HB2 PRO B 70 4.162 17.906 -2.291 1.00 10.00 H new ATOM 0 HB3 PRO B 70 3.606 19.240 -1.300 1.00 10.00 H new ATOM 0 HG2 PRO B 70 5.274 16.829 -0.455 1.00 10.00 H new ATOM 0 HG3 PRO B 70 5.503 18.511 -0.020 1.00 10.00 H new ATOM 0 HD2 PRO B 70 4.177 16.730 1.639 1.00 10.00 H new ATOM 0 HD3 PRO B 70 3.830 18.448 1.648 1.00 10.00 H new ATOM 1067 N GLN B 71 2.999 14.985 -0.888 1.00 10.00 N ATOM 1068 CA GLN B 71 3.153 13.606 -1.332 1.00 10.00 C ATOM 1069 C GLN B 71 1.829 12.879 -1.562 1.00 10.00 C ATOM 1070 O GLN B 71 1.856 11.764 -2.099 1.00 10.00 O ATOM 1071 CB GLN B 71 4.132 12.874 -0.398 1.00 10.00 C ATOM 1072 CG GLN B 71 5.529 13.536 -0.400 1.00 10.00 C ATOM 1073 CD GLN B 71 6.163 13.626 -1.793 1.00 10.00 C ATOM 1074 OE1 GLN B 71 5.812 14.456 -2.617 1.00 10.00 O ATOM 1075 NE2 GLN B 71 7.117 12.787 -2.102 1.00 10.00 N ATOM 0 H GLN B 71 3.306 15.122 0.075 1.00 10.00 H new ATOM 0 HA GLN B 71 3.593 13.613 -2.329 1.00 10.00 H new ATOM 0 HB2 GLN B 71 3.733 12.870 0.616 1.00 10.00 H new ATOM 0 HB3 GLN B 71 4.222 11.833 -0.709 1.00 10.00 H new ATOM 0 HG2 GLN B 71 5.447 14.539 0.018 1.00 10.00 H new ATOM 0 HG3 GLN B 71 6.191 12.970 0.256 1.00 10.00 H new ATOM 0 HE21 GLN B 71 7.421 12.088 -1.424 1.00 10.00 H new ATOM 0 HE22 GLN B 71 7.557 12.831 -3.021 1.00 10.00 H new ATOM 1084 N GLN B 72 0.694 13.529 -1.263 1.00 10.00 N ATOM 1085 CA GLN B 72 -0.664 13.107 -1.621 1.00 10.00 C ATOM 1086 C GLN B 72 -0.868 13.030 -3.142 1.00 10.00 C ATOM 1087 O GLN B 72 -1.779 12.352 -3.613 1.00 10.00 O ATOM 1088 CB GLN B 72 -1.676 14.084 -0.991 1.00 10.00 C ATOM 1089 CG GLN B 72 -1.837 15.469 -1.651 1.00 10.00 C ATOM 1090 CD GLN B 72 -2.887 15.500 -2.762 1.00 10.00 C ATOM 1091 OE1 GLN B 72 -2.588 15.723 -3.929 1.00 10.00 O ATOM 1092 NE2 GLN B 72 -4.152 15.299 -2.404 1.00 10.00 N ATOM 0 H GLN B 72 0.701 14.405 -0.740 1.00 10.00 H new ATOM 0 HA GLN B 72 -0.822 12.101 -1.232 1.00 10.00 H new ATOM 0 HB2 GLN B 72 -2.652 13.599 -0.985 1.00 10.00 H new ATOM 0 HB3 GLN B 72 -1.391 14.239 0.050 1.00 10.00 H new ATOM 0 HG2 GLN B 72 -2.108 16.197 -0.886 1.00 10.00 H new ATOM 0 HG3 GLN B 72 -0.876 15.780 -2.062 1.00 10.00 H new ATOM 0 HE21 GLN B 72 -4.383 15.115 -1.428 1.00 10.00 H new ATOM 0 HE22 GLN B 72 -4.892 15.329 -3.106 1.00 10.00 H new ATOM 1101 N GLN B 73 -0.021 13.726 -3.914 1.00 10.00 N ATOM 1102 CA GLN B 73 -0.038 13.709 -5.372 1.00 10.00 C ATOM 1103 C GLN B 73 0.170 12.304 -5.960 1.00 10.00 C ATOM 1104 O GLN B 73 0.806 11.425 -5.370 1.00 10.00 O ATOM 1105 CB GLN B 73 1.035 14.681 -5.881 1.00 10.00 C ATOM 1106 CG GLN B 73 0.647 16.160 -5.699 1.00 10.00 C ATOM 1107 CD GLN B 73 -0.405 16.591 -6.716 1.00 10.00 C ATOM 1108 OE1 GLN B 73 -0.078 16.910 -7.852 1.00 10.00 O ATOM 1109 NE2 GLN B 73 -1.678 16.600 -6.361 1.00 10.00 N ATOM 0 H GLN B 73 0.707 14.327 -3.528 1.00 10.00 H new ATOM 0 HA GLN B 73 -1.027 14.023 -5.706 1.00 10.00 H new ATOM 0 HB2 GLN B 73 1.970 14.489 -5.354 1.00 10.00 H new ATOM 0 HB3 GLN B 73 1.220 14.488 -6.938 1.00 10.00 H new ATOM 0 HG2 GLN B 73 0.265 16.315 -4.690 1.00 10.00 H new ATOM 0 HG3 GLN B 73 1.534 16.785 -5.804 1.00 10.00 H new ATOM 0 HE21 GLN B 73 -1.945 16.333 -5.413 1.00 10.00 H new ATOM 0 HE22 GLN B 73 -2.393 16.874 -7.035 1.00 10.00 H new ATOM 1118 N GLN B 74 -0.242 12.174 -7.219 1.00 10.00 N ATOM 1119 CA GLN B 74 -0.052 11.051 -8.137 1.00 10.00 C ATOM 1120 C GLN B 74 1.394 10.544 -8.293 1.00 10.00 C ATOM 1121 O GLN B 74 1.608 9.552 -8.986 1.00 10.00 O ATOM 1122 CB GLN B 74 -0.666 11.402 -9.508 1.00 10.00 C ATOM 1123 CG GLN B 74 -0.059 12.628 -10.232 1.00 10.00 C ATOM 1124 CD GLN B 74 -0.406 13.978 -9.584 1.00 10.00 C ATOM 1125 OE1 GLN B 74 -1.369 14.109 -8.847 1.00 10.00 O ATOM 1126 NE2 GLN B 74 0.411 14.998 -9.770 1.00 10.00 N ATOM 0 H GLN B 74 -0.768 12.925 -7.666 1.00 10.00 H new ATOM 0 HA GLN B 74 -0.571 10.209 -7.679 1.00 10.00 H new ATOM 0 HB2 GLN B 74 -0.567 10.535 -10.160 1.00 10.00 H new ATOM 0 HB3 GLN B 74 -1.733 11.578 -9.371 1.00 10.00 H new ATOM 0 HG2 GLN B 74 1.025 12.519 -10.260 1.00 10.00 H new ATOM 0 HG3 GLN B 74 -0.406 12.634 -11.265 1.00 10.00 H new ATOM 0 HE21 GLN B 74 1.219 14.899 -10.384 1.00 10.00 H new ATOM 0 HE22 GLN B 74 0.234 15.885 -9.299 1.00 10.00 H new ATOM 1135 N GLN B 75 2.388 11.159 -7.647 1.00 10.00 N ATOM 1136 CA GLN B 75 3.747 10.627 -7.553 1.00 10.00 C ATOM 1137 C GLN B 75 3.809 9.269 -6.863 1.00 10.00 C ATOM 1138 O GLN B 75 4.648 8.461 -7.255 1.00 10.00 O ATOM 1139 CB GLN B 75 4.676 11.641 -6.859 1.00 10.00 C ATOM 1140 CG GLN B 75 4.299 12.004 -5.401 1.00 10.00 C ATOM 1141 CD GLN B 75 5.139 11.370 -4.296 1.00 10.00 C ATOM 1142 OE1 GLN B 75 6.336 11.126 -4.422 1.00 10.00 O ATOM 1143 NE2 GLN B 75 4.529 11.082 -3.155 1.00 10.00 N ATOM 0 H GLN B 75 2.268 12.052 -7.169 1.00 10.00 H new ATOM 0 HA GLN B 75 4.094 10.467 -8.574 1.00 10.00 H new ATOM 0 HB2 GLN B 75 5.690 11.241 -6.864 1.00 10.00 H new ATOM 0 HB3 GLN B 75 4.691 12.557 -7.450 1.00 10.00 H new ATOM 0 HG2 GLN B 75 4.358 13.087 -5.294 1.00 10.00 H new ATOM 0 HG3 GLN B 75 3.258 11.724 -5.239 1.00 10.00 H new ATOM 0 HE21 GLN B 75 3.535 11.282 -3.043 1.00 10.00 H new ATOM 0 HE22 GLN B 75 5.054 10.660 -2.389 1.00 10.00 H new ATOM 1152 N VAL B 76 2.908 8.976 -5.907 1.00 10.00 N ATOM 1153 CA VAL B 76 2.846 7.620 -5.385 1.00 10.00 C ATOM 1154 C VAL B 76 2.337 6.705 -6.485 1.00 10.00 C ATOM 1155 O VAL B 76 2.997 5.720 -6.800 1.00 10.00 O ATOM 1156 CB VAL B 76 1.957 7.440 -4.136 1.00 10.00 C ATOM 1157 CG1 VAL B 76 2.386 6.160 -3.430 1.00 10.00 C ATOM 1158 CG2 VAL B 76 1.981 8.529 -3.078 1.00 10.00 C ATOM 0 H VAL B 76 2.244 9.636 -5.501 1.00 10.00 H new ATOM 0 HA VAL B 76 3.858 7.371 -5.066 1.00 10.00 H new ATOM 0 HB VAL B 76 0.946 7.447 -4.542 1.00 10.00 H new ATOM 0 HG11 VAL B 76 1.771 6.011 -2.542 1.00 10.00 H new ATOM 0 HG12 VAL B 76 2.261 5.313 -4.105 1.00 10.00 H new ATOM 0 HG13 VAL B 76 3.433 6.239 -3.137 1.00 10.00 H new ATOM 0 HG21 VAL B 76 1.307 8.261 -2.264 1.00 10.00 H new ATOM 0 HG22 VAL B 76 2.994 8.637 -2.690 1.00 10.00 H new ATOM 0 HG23 VAL B 76 1.659 9.472 -3.519 1.00 10.00 H new ATOM 1168 N LEU B 77 1.192 7.062 -7.085 1.00 10.00 N ATOM 1169 CA LEU B 77 0.495 6.280 -8.095 1.00 10.00 C ATOM 1170 C LEU B 77 1.435 5.942 -9.278 1.00 10.00 C ATOM 1171 O LEU B 77 1.491 4.803 -9.754 1.00 10.00 O ATOM 1172 CB LEU B 77 -0.765 7.066 -8.518 1.00 10.00 C ATOM 1173 CG LEU B 77 -1.842 6.336 -9.338 1.00 10.00 C ATOM 1174 CD1 LEU B 77 -1.430 6.031 -10.782 1.00 10.00 C ATOM 1175 CD2 LEU B 77 -2.306 5.045 -8.668 1.00 10.00 C ATOM 0 H LEU B 77 0.715 7.937 -6.866 1.00 10.00 H new ATOM 0 HA LEU B 77 0.181 5.316 -7.695 1.00 10.00 H new ATOM 0 HB2 LEU B 77 -1.238 7.447 -7.613 1.00 10.00 H new ATOM 0 HB3 LEU B 77 -0.438 7.931 -9.095 1.00 10.00 H new ATOM 0 HG LEU B 77 -2.669 7.045 -9.375 1.00 10.00 H new ATOM 0 HD11 LEU B 77 -2.244 5.516 -11.292 1.00 10.00 H new ATOM 0 HD12 LEU B 77 -1.209 6.963 -11.302 1.00 10.00 H new ATOM 0 HD13 LEU B 77 -0.544 5.397 -10.781 1.00 10.00 H new ATOM 0 HD21 LEU B 77 -3.066 4.567 -9.286 1.00 10.00 H new ATOM 0 HD22 LEU B 77 -1.458 4.371 -8.550 1.00 10.00 H new ATOM 0 HD23 LEU B 77 -2.726 5.274 -7.689 1.00 10.00 H new ATOM 1187 N ASN B 78 2.208 6.942 -9.710 1.00 10.00 N ATOM 1188 CA ASN B 78 3.181 6.828 -10.788 1.00 10.00 C ATOM 1189 C ASN B 78 4.264 5.778 -10.520 1.00 10.00 C ATOM 1190 O ASN B 78 4.721 5.152 -11.478 1.00 10.00 O ATOM 1191 CB ASN B 78 3.795 8.213 -11.071 1.00 10.00 C ATOM 1192 CG ASN B 78 4.661 8.191 -12.322 1.00 10.00 C ATOM 1193 OD1 ASN B 78 4.267 7.679 -13.364 1.00 10.00 O ATOM 1194 ND2 ASN B 78 5.878 8.704 -12.252 1.00 10.00 N ATOM 0 H ASN B 78 2.169 7.877 -9.305 1.00 10.00 H new ATOM 0 HA ASN B 78 2.652 6.475 -11.673 1.00 10.00 H new ATOM 0 HB2 ASN B 78 2.999 8.948 -11.190 1.00 10.00 H new ATOM 0 HB3 ASN B 78 4.395 8.528 -10.217 1.00 10.00 H new ATOM 0 HD21 ASN B 78 6.492 8.674 -13.066 1.00 10.00 H new ATOM 0 HD22 ASN B 78 6.203 9.129 -11.384 1.00 10.00 H new ATOM 1201 N ILE B 79 4.682 5.584 -9.268 1.00 10.00 N ATOM 1202 CA ILE B 79 5.649 4.525 -8.937 1.00 10.00 C ATOM 1203 C ILE B 79 4.940 3.206 -8.567 1.00 10.00 C ATOM 1204 O ILE B 79 5.372 2.130 -8.986 1.00 10.00 O ATOM 1205 CB ILE B 79 6.644 5.005 -7.870 1.00 10.00 C ATOM 1206 CG1 ILE B 79 7.249 6.398 -8.182 1.00 10.00 C ATOM 1207 CG2 ILE B 79 7.800 3.990 -7.793 1.00 10.00 C ATOM 1208 CD1 ILE B 79 7.606 7.151 -6.904 1.00 10.00 C ATOM 0 H ILE B 79 4.372 6.138 -8.470 1.00 10.00 H new ATOM 0 HA ILE B 79 6.237 4.303 -9.827 1.00 10.00 H new ATOM 0 HB ILE B 79 6.097 5.086 -6.931 1.00 10.00 H new ATOM 0 HG12 ILE B 79 8.141 6.279 -8.797 1.00 10.00 H new ATOM 0 HG13 ILE B 79 6.537 6.983 -8.764 1.00 10.00 H new ATOM 0 HG21 ILE B 79 8.518 4.313 -7.040 1.00 10.00 H new ATOM 0 HG22 ILE B 79 7.406 3.010 -7.522 1.00 10.00 H new ATOM 0 HG23 ILE B 79 8.294 3.927 -8.762 1.00 10.00 H new ATOM 0 HD11 ILE B 79 8.027 8.123 -7.160 1.00 10.00 H new ATOM 0 HD12 ILE B 79 6.708 7.292 -6.302 1.00 10.00 H new ATOM 0 HD13 ILE B 79 8.338 6.577 -6.336 1.00 10.00 H new ATOM 1220 N LEU B 80 3.795 3.289 -7.876 1.00 10.00 N ATOM 1221 CA LEU B 80 2.894 2.194 -7.508 1.00 10.00 C ATOM 1222 C LEU B 80 2.603 1.248 -8.672 1.00 10.00 C ATOM 1223 O LEU B 80 2.668 0.029 -8.488 1.00 10.00 O ATOM 1224 CB LEU B 80 1.566 2.806 -7.032 1.00 10.00 C ATOM 1225 CG LEU B 80 1.394 2.915 -5.521 1.00 10.00 C ATOM 1226 CD1 LEU B 80 0.283 3.905 -5.151 1.00 10.00 C ATOM 1227 CD2 LEU B 80 0.956 1.564 -4.983 1.00 10.00 C ATOM 0 H LEU B 80 3.452 4.188 -7.537 1.00 10.00 H new ATOM 0 HA LEU B 80 3.381 1.610 -6.727 1.00 10.00 H new ATOM 0 HB2 LEU B 80 1.471 3.803 -7.463 1.00 10.00 H new ATOM 0 HB3 LEU B 80 0.747 2.207 -7.430 1.00 10.00 H new ATOM 0 HG LEU B 80 2.344 3.248 -5.103 1.00 10.00 H new ATOM 0 HD11 LEU B 80 0.188 3.957 -4.066 1.00 10.00 H new ATOM 0 HD12 LEU B 80 0.530 4.892 -5.542 1.00 10.00 H new ATOM 0 HD13 LEU B 80 -0.661 3.570 -5.582 1.00 10.00 H new ATOM 0 HD21 LEU B 80 0.829 1.627 -3.902 1.00 10.00 H new ATOM 0 HD22 LEU B 80 0.010 1.278 -5.444 1.00 10.00 H new ATOM 0 HD23 LEU B 80 1.714 0.816 -5.216 1.00 10.00 H new ATOM 1239 N LYS B 81 2.309 1.799 -9.855 1.00 10.00 N ATOM 1240 CA LYS B 81 1.955 1.006 -11.045 1.00 10.00 C ATOM 1241 C LYS B 81 3.044 0.013 -11.511 1.00 10.00 C ATOM 1242 O LYS B 81 2.752 -0.860 -12.325 1.00 10.00 O ATOM 1243 CB LYS B 81 1.531 1.975 -12.165 1.00 10.00 C ATOM 1244 CG LYS B 81 2.709 2.696 -12.842 1.00 10.00 C ATOM 1245 CD LYS B 81 2.225 3.811 -13.785 1.00 10.00 C ATOM 1246 CE LYS B 81 3.312 4.252 -14.780 1.00 10.00 C ATOM 1247 NZ LYS B 81 4.368 5.089 -14.144 1.00 10.00 N ATOM 0 H LYS B 81 2.309 2.806 -10.018 1.00 10.00 H new ATOM 0 HA LYS B 81 1.125 0.355 -10.771 1.00 10.00 H new ATOM 0 HB2 LYS B 81 0.974 1.421 -12.920 1.00 10.00 H new ATOM 0 HB3 LYS B 81 0.851 2.720 -11.750 1.00 10.00 H new ATOM 0 HG2 LYS B 81 3.362 3.121 -12.080 1.00 10.00 H new ATOM 0 HG3 LYS B 81 3.303 1.975 -13.404 1.00 10.00 H new ATOM 0 HD2 LYS B 81 1.352 3.463 -14.336 1.00 10.00 H new ATOM 0 HD3 LYS B 81 1.907 4.670 -13.194 1.00 10.00 H new ATOM 0 HE2 LYS B 81 3.772 3.369 -15.224 1.00 10.00 H new ATOM 0 HE3 LYS B 81 2.849 4.813 -15.592 1.00 10.00 H new ATOM 0 HZ1 LYS B 81 5.245 5.023 -14.700 1.00 10.00 H new ATOM 0 HZ2 LYS B 81 4.053 6.079 -14.110 1.00 10.00 H new ATOM 0 HZ3 LYS B 81 4.545 4.749 -13.177 1.00 10.00 H new ATOM 1261 N SER B 82 4.286 0.148 -11.021 1.00 10.00 N ATOM 1262 CA SER B 82 5.462 -0.608 -11.479 1.00 10.00 C ATOM 1263 C SER B 82 5.496 -2.075 -11.032 1.00 10.00 C ATOM 1264 O SER B 82 5.576 -2.952 -11.891 1.00 10.00 O ATOM 1265 CB SER B 82 6.755 0.114 -11.091 1.00 10.00 C ATOM 1266 OG SER B 82 6.902 0.227 -9.688 1.00 10.00 O ATOM 0 H SER B 82 4.506 0.806 -10.273 1.00 10.00 H new ATOM 0 HA SER B 82 5.377 -0.645 -12.565 1.00 10.00 H new ATOM 0 HB2 SER B 82 7.608 -0.426 -11.502 1.00 10.00 H new ATOM 0 HB3 SER B 82 6.762 1.109 -11.537 1.00 10.00 H new ATOM 0 HG SER B 82 6.546 1.090 -9.390 1.00 10.00 H new ATOM 1272 N ASN B 83 5.423 -2.367 -9.726 1.00 10.00 N ATOM 1273 CA ASN B 83 5.255 -3.726 -9.222 1.00 10.00 C ATOM 1274 C ASN B 83 3.752 -4.033 -9.107 1.00 10.00 C ATOM 1275 O ASN B 83 3.096 -3.528 -8.192 1.00 10.00 O ATOM 1276 CB ASN B 83 6.011 -3.938 -7.896 1.00 10.00 C ATOM 1277 CG ASN B 83 5.927 -5.391 -7.410 1.00 10.00 C ATOM 1278 OD1 ASN B 83 4.979 -6.133 -7.660 1.00 10.00 O ATOM 1279 ND2 ASN B 83 6.957 -5.857 -6.738 1.00 10.00 N ATOM 0 H ASN B 83 5.480 -1.661 -8.992 1.00 10.00 H new ATOM 0 HA ASN B 83 5.697 -4.433 -9.924 1.00 10.00 H new ATOM 0 HB2 ASN B 83 7.057 -3.660 -8.027 1.00 10.00 H new ATOM 0 HB3 ASN B 83 5.598 -3.277 -7.134 1.00 10.00 H new ATOM 0 HD21 ASN B 83 6.966 -6.829 -6.428 1.00 10.00 H new ATOM 0 HD22 ASN B 83 7.747 -5.247 -6.527 1.00 10.00 H new ATOM 1286 N PRO B 84 3.175 -4.836 -10.016 1.00 10.00 N ATOM 1287 CA PRO B 84 1.729 -5.087 -10.053 1.00 10.00 C ATOM 1288 C PRO B 84 1.226 -5.743 -8.756 1.00 10.00 C ATOM 1289 O PRO B 84 0.107 -5.483 -8.320 1.00 10.00 O ATOM 1290 CB PRO B 84 1.497 -6.012 -11.253 1.00 10.00 C ATOM 1291 CG PRO B 84 2.786 -5.902 -12.077 1.00 10.00 C ATOM 1292 CD PRO B 84 3.838 -5.666 -11.005 1.00 10.00 C ATOM 0 HA PRO B 84 1.177 -4.152 -10.146 1.00 10.00 H new ATOM 0 HB2 PRO B 84 1.316 -7.038 -10.934 1.00 10.00 H new ATOM 0 HB3 PRO B 84 0.628 -5.700 -11.832 1.00 10.00 H new ATOM 0 HG2 PRO B 84 2.983 -6.810 -12.647 1.00 10.00 H new ATOM 0 HG3 PRO B 84 2.743 -5.080 -12.792 1.00 10.00 H new ATOM 0 HD2 PRO B 84 4.178 -6.606 -10.570 1.00 10.00 H new ATOM 0 HD3 PRO B 84 4.717 -5.168 -11.415 1.00 10.00 H new ATOM 1300 N GLN B 85 2.071 -6.558 -8.120 1.00 10.00 N ATOM 1301 CA GLN B 85 1.768 -7.223 -6.854 1.00 10.00 C ATOM 1302 C GLN B 85 1.794 -6.214 -5.696 1.00 10.00 C ATOM 1303 O GLN B 85 0.905 -6.267 -4.857 1.00 10.00 O ATOM 1304 CB GLN B 85 2.769 -8.345 -6.566 1.00 10.00 C ATOM 1305 CG GLN B 85 2.939 -9.357 -7.722 1.00 10.00 C ATOM 1306 CD GLN B 85 4.189 -10.217 -7.560 1.00 10.00 C ATOM 1307 OE1 GLN B 85 4.201 -11.429 -7.738 1.00 10.00 O ATOM 1308 NE2 GLN B 85 5.293 -9.576 -7.249 1.00 10.00 N ATOM 0 H GLN B 85 3.001 -6.777 -8.478 1.00 10.00 H new ATOM 0 HA GLN B 85 0.770 -7.654 -6.940 1.00 10.00 H new ATOM 0 HB2 GLN B 85 3.739 -7.902 -6.341 1.00 10.00 H new ATOM 0 HB3 GLN B 85 2.449 -8.882 -5.673 1.00 10.00 H new ATOM 0 HG2 GLN B 85 2.061 -10.001 -7.770 1.00 10.00 H new ATOM 0 HG3 GLN B 85 2.991 -8.819 -8.668 1.00 10.00 H new ATOM 0 HE21 GLN B 85 5.273 -8.567 -7.103 1.00 10.00 H new ATOM 0 HE22 GLN B 85 6.170 -10.088 -7.154 1.00 10.00 H new ATOM 1317 N LEU B 86 2.761 -5.281 -5.655 1.00 10.00 N ATOM 1318 CA LEU B 86 2.748 -4.141 -4.712 1.00 10.00 C ATOM 1319 C LEU B 86 1.503 -3.280 -4.934 1.00 10.00 C ATOM 1320 O LEU B 86 0.888 -2.874 -3.961 1.00 10.00 O ATOM 1321 CB LEU B 86 4.033 -3.302 -4.808 1.00 10.00 C ATOM 1322 CG LEU B 86 4.265 -2.211 -3.734 1.00 10.00 C ATOM 1323 CD1 LEU B 86 3.601 -0.876 -4.065 1.00 10.00 C ATOM 1324 CD2 LEU B 86 3.870 -2.561 -2.289 1.00 10.00 C ATOM 0 H LEU B 86 3.573 -5.293 -6.272 1.00 10.00 H new ATOM 0 HA LEU B 86 2.711 -4.546 -3.701 1.00 10.00 H new ATOM 0 HB2 LEU B 86 4.882 -3.985 -4.780 1.00 10.00 H new ATOM 0 HB3 LEU B 86 4.045 -2.818 -5.785 1.00 10.00 H new ATOM 0 HG LEU B 86 5.352 -2.136 -3.771 1.00 10.00 H new ATOM 0 HD11 LEU B 86 3.806 -0.160 -3.269 1.00 10.00 H new ATOM 0 HD12 LEU B 86 3.998 -0.496 -5.006 1.00 10.00 H new ATOM 0 HD13 LEU B 86 2.524 -1.018 -4.157 1.00 10.00 H new ATOM 0 HD21 LEU B 86 4.083 -1.713 -1.638 1.00 10.00 H new ATOM 0 HD22 LEU B 86 2.805 -2.791 -2.248 1.00 10.00 H new ATOM 0 HD23 LEU B 86 4.441 -3.427 -1.955 1.00 10.00 H new ATOM 1336 N MET B 87 1.117 -3.029 -6.192 1.00 10.00 N ATOM 1337 CA MET B 87 -0.111 -2.300 -6.517 1.00 10.00 C ATOM 1338 C MET B 87 -1.372 -2.999 -5.981 1.00 10.00 C ATOM 1339 O MET B 87 -2.179 -2.381 -5.282 1.00 10.00 O ATOM 1340 CB MET B 87 -0.162 -2.044 -8.035 1.00 10.00 C ATOM 1341 CG MET B 87 -0.552 -0.595 -8.310 1.00 10.00 C ATOM 1342 SD MET B 87 -2.262 -0.187 -7.895 1.00 10.00 S ATOM 1343 CE MET B 87 -2.132 1.591 -8.104 1.00 10.00 C ATOM 0 H MET B 87 1.648 -3.326 -7.010 1.00 10.00 H new ATOM 0 HA MET B 87 -0.093 -1.336 -6.008 1.00 10.00 H new ATOM 0 HB2 MET B 87 0.810 -2.258 -8.480 1.00 10.00 H new ATOM 0 HB3 MET B 87 -0.882 -2.717 -8.501 1.00 10.00 H new ATOM 0 HG2 MET B 87 0.112 0.060 -7.745 1.00 10.00 H new ATOM 0 HG3 MET B 87 -0.387 -0.382 -9.366 1.00 10.00 H new ATOM 0 HE1 MET B 87 -3.048 1.972 -8.555 1.00 10.00 H new ATOM 0 HE2 MET B 87 -1.983 2.062 -7.132 1.00 10.00 H new ATOM 0 HE3 MET B 87 -1.286 1.820 -8.752 1.00 10.00 H new ATOM 1353 N ALA B 88 -1.523 -4.297 -6.256 1.00 10.00 N ATOM 1354 CA ALA B 88 -2.605 -5.097 -5.691 1.00 10.00 C ATOM 1355 C ALA B 88 -2.533 -5.177 -4.152 1.00 10.00 C ATOM 1356 O ALA B 88 -3.559 -5.035 -3.484 1.00 10.00 O ATOM 1357 CB ALA B 88 -2.574 -6.491 -6.333 1.00 10.00 C ATOM 0 H ALA B 88 -0.901 -4.818 -6.874 1.00 10.00 H new ATOM 0 HA ALA B 88 -3.555 -4.613 -5.917 1.00 10.00 H new ATOM 0 HB1 ALA B 88 -3.378 -7.100 -5.920 1.00 10.00 H new ATOM 0 HB2 ALA B 88 -2.707 -6.398 -7.411 1.00 10.00 H new ATOM 0 HB3 ALA B 88 -1.615 -6.966 -6.125 1.00 10.00 H new ATOM 1363 N ALA B 89 -1.337 -5.374 -3.577 1.00 10.00 N ATOM 1364 CA ALA B 89 -1.095 -5.379 -2.141 1.00 10.00 C ATOM 1365 C ALA B 89 -1.500 -4.041 -1.511 1.00 10.00 C ATOM 1366 O ALA B 89 -2.251 -4.054 -0.545 1.00 10.00 O ATOM 1367 CB ALA B 89 0.367 -5.731 -1.833 1.00 10.00 C ATOM 0 H ALA B 89 -0.491 -5.539 -4.122 1.00 10.00 H new ATOM 0 HA ALA B 89 -1.719 -6.152 -1.693 1.00 10.00 H new ATOM 0 HB1 ALA B 89 0.522 -5.728 -0.754 1.00 10.00 H new ATOM 0 HB2 ALA B 89 0.594 -6.720 -2.230 1.00 10.00 H new ATOM 0 HB3 ALA B 89 1.024 -4.995 -2.296 1.00 10.00 H new ATOM 1373 N PHE B 90 -1.048 -2.915 -2.078 1.00 10.00 N ATOM 1374 CA PHE B 90 -1.476 -1.560 -1.737 1.00 10.00 C ATOM 1375 C PHE B 90 -3.010 -1.502 -1.722 1.00 10.00 C ATOM 1376 O PHE B 90 -3.577 -1.260 -0.667 1.00 10.00 O ATOM 1377 CB PHE B 90 -0.888 -0.544 -2.715 1.00 10.00 C ATOM 1378 CG PHE B 90 -1.333 0.888 -2.465 1.00 10.00 C ATOM 1379 CD1 PHE B 90 -0.890 1.555 -1.319 1.00 10.00 C ATOM 1380 CD2 PHE B 90 -2.114 1.584 -3.403 1.00 10.00 C ATOM 1381 CE1 PHE B 90 -1.150 2.923 -1.142 1.00 10.00 C ATOM 1382 CE2 PHE B 90 -2.368 2.951 -3.233 1.00 10.00 C ATOM 1383 CZ PHE B 90 -1.839 3.639 -2.125 1.00 10.00 C ATOM 0 H PHE B 90 -0.345 -2.928 -2.817 1.00 10.00 H new ATOM 0 HA PHE B 90 -1.107 -1.302 -0.745 1.00 10.00 H new ATOM 0 HB2 PHE B 90 0.200 -0.590 -2.660 1.00 10.00 H new ATOM 0 HB3 PHE B 90 -1.168 -0.828 -3.729 1.00 10.00 H new ATOM 0 HD1 PHE B 90 -0.342 1.012 -0.563 1.00 10.00 H new ATOM 0 HD2 PHE B 90 -2.520 1.063 -4.258 1.00 10.00 H new ATOM 0 HE1 PHE B 90 -0.817 3.423 -0.245 1.00 10.00 H new ATOM 0 HE2 PHE B 90 -2.972 3.479 -3.955 1.00 10.00 H new ATOM 0 HZ PHE B 90 -1.964 4.708 -2.035 1.00 10.00 H new ATOM 1393 N ILE B 91 -3.693 -1.789 -2.838 1.00 10.00 N ATOM 1394 CA ILE B 91 -5.166 -1.796 -2.916 1.00 10.00 C ATOM 1395 C ILE B 91 -5.788 -2.645 -1.792 1.00 10.00 C ATOM 1396 O ILE B 91 -6.598 -2.126 -1.023 1.00 10.00 O ATOM 1397 CB ILE B 91 -5.653 -2.200 -4.333 1.00 10.00 C ATOM 1398 CG1 ILE B 91 -5.304 -1.074 -5.338 1.00 10.00 C ATOM 1399 CG2 ILE B 91 -7.166 -2.478 -4.357 1.00 10.00 C ATOM 1400 CD1 ILE B 91 -5.555 -1.402 -6.816 1.00 10.00 C ATOM 0 H ILE B 91 -3.239 -2.025 -3.720 1.00 10.00 H new ATOM 0 HA ILE B 91 -5.520 -0.778 -2.752 1.00 10.00 H new ATOM 0 HB ILE B 91 -5.145 -3.122 -4.617 1.00 10.00 H new ATOM 0 HG12 ILE B 91 -5.883 -0.188 -5.078 1.00 10.00 H new ATOM 0 HG13 ILE B 91 -4.252 -0.816 -5.215 1.00 10.00 H new ATOM 0 HG21 ILE B 91 -7.469 -2.758 -5.366 1.00 10.00 H new ATOM 0 HG22 ILE B 91 -7.397 -3.292 -3.670 1.00 10.00 H new ATOM 0 HG23 ILE B 91 -7.706 -1.581 -4.052 1.00 10.00 H new ATOM 0 HD11 ILE B 91 -5.277 -0.546 -7.431 1.00 10.00 H new ATOM 0 HD12 ILE B 91 -4.955 -2.266 -7.104 1.00 10.00 H new ATOM 0 HD13 ILE B 91 -6.611 -1.628 -6.964 1.00 10.00 H new ATOM 1412 N LYS B 92 -5.392 -3.922 -1.665 1.00 10.00 N ATOM 1413 CA LYS B 92 -5.916 -4.843 -0.650 1.00 10.00 C ATOM 1414 C LYS B 92 -5.735 -4.289 0.765 1.00 10.00 C ATOM 1415 O LYS B 92 -6.703 -4.132 1.518 1.00 10.00 O ATOM 1416 CB LYS B 92 -5.240 -6.219 -0.817 1.00 10.00 C ATOM 1417 CG LYS B 92 -5.655 -7.317 0.187 1.00 10.00 C ATOM 1418 CD LYS B 92 -7.077 -7.867 0.012 1.00 10.00 C ATOM 1419 CE LYS B 92 -8.120 -7.009 0.736 1.00 10.00 C ATOM 1420 NZ LYS B 92 -9.485 -7.325 0.270 1.00 10.00 N ATOM 0 H LYS B 92 -4.691 -4.346 -2.272 1.00 10.00 H new ATOM 0 HA LYS B 92 -6.990 -4.958 -0.796 1.00 10.00 H new ATOM 0 HB2 LYS B 92 -5.448 -6.581 -1.824 1.00 10.00 H new ATOM 0 HB3 LYS B 92 -4.161 -6.080 -0.744 1.00 10.00 H new ATOM 0 HG2 LYS B 92 -4.951 -8.145 0.105 1.00 10.00 H new ATOM 0 HG3 LYS B 92 -5.560 -6.917 1.196 1.00 10.00 H new ATOM 0 HD2 LYS B 92 -7.319 -7.913 -1.050 1.00 10.00 H new ATOM 0 HD3 LYS B 92 -7.120 -8.887 0.393 1.00 10.00 H new ATOM 0 HE2 LYS B 92 -8.051 -7.177 1.811 1.00 10.00 H new ATOM 0 HE3 LYS B 92 -7.909 -5.953 0.565 1.00 10.00 H new ATOM 0 HZ1 LYS B 92 -10.171 -6.730 0.776 1.00 10.00 H new ATOM 0 HZ2 LYS B 92 -9.554 -7.141 -0.751 1.00 10.00 H new ATOM 0 HZ3 LYS B 92 -9.692 -8.327 0.456 1.00 10.00 H new ATOM 1434 N GLN B 93 -4.488 -3.999 1.127 1.00 10.00 N ATOM 1435 CA GLN B 93 -4.072 -3.550 2.444 1.00 10.00 C ATOM 1436 C GLN B 93 -4.610 -2.150 2.783 1.00 10.00 C ATOM 1437 O GLN B 93 -5.017 -1.953 3.923 1.00 10.00 O ATOM 1438 CB GLN B 93 -2.533 -3.626 2.504 1.00 10.00 C ATOM 1439 CG GLN B 93 -1.889 -3.009 3.740 1.00 10.00 C ATOM 1440 CD GLN B 93 -2.255 -3.597 5.097 1.00 10.00 C ATOM 1441 OE1 GLN B 93 -3.182 -4.373 5.264 1.00 10.00 O ATOM 1442 NE2 GLN B 93 -1.547 -3.179 6.123 1.00 10.00 N ATOM 0 H GLN B 93 -3.707 -4.076 0.476 1.00 10.00 H new ATOM 0 HA GLN B 93 -4.498 -4.201 3.207 1.00 10.00 H new ATOM 0 HB2 GLN B 93 -2.237 -4.673 2.447 1.00 10.00 H new ATOM 0 HB3 GLN B 93 -2.128 -3.132 1.621 1.00 10.00 H new ATOM 0 HG2 GLN B 93 -0.807 -3.079 3.625 1.00 10.00 H new ATOM 0 HG3 GLN B 93 -2.140 -1.948 3.755 1.00 10.00 H new ATOM 0 HE21 GLN B 93 -0.773 -2.530 5.978 1.00 10.00 H new ATOM 0 HE22 GLN B 93 -1.772 -3.503 7.064 1.00 10.00 H new ATOM 1451 N ARG B 94 -4.637 -1.198 1.840 1.00 10.00 N ATOM 1452 CA ARG B 94 -5.280 0.109 2.013 1.00 10.00 C ATOM 1453 C ARG B 94 -6.775 -0.048 2.265 1.00 10.00 C ATOM 1454 O ARG B 94 -7.300 0.601 3.155 1.00 10.00 O ATOM 1455 CB ARG B 94 -5.090 1.035 0.811 1.00 10.00 C ATOM 1456 CG ARG B 94 -3.685 1.614 0.620 1.00 10.00 C ATOM 1457 CD ARG B 94 -3.069 2.323 1.824 1.00 10.00 C ATOM 1458 NE ARG B 94 -3.897 3.402 2.389 1.00 10.00 N ATOM 1459 CZ ARG B 94 -3.614 4.091 3.488 1.00 10.00 C ATOM 1460 NH1 ARG B 94 -2.506 3.930 4.166 1.00 10.00 N ATOM 1461 NH2 ARG B 94 -4.403 5.011 3.970 1.00 10.00 N ATOM 0 H ARG B 94 -4.206 -1.317 0.923 1.00 10.00 H new ATOM 0 HA ARG B 94 -4.792 0.563 2.875 1.00 10.00 H new ATOM 0 HB2 ARG B 94 -5.360 0.486 -0.091 1.00 10.00 H new ATOM 0 HB3 ARG B 94 -5.793 1.863 0.902 1.00 10.00 H new ATOM 0 HG2 ARG B 94 -3.019 0.803 0.325 1.00 10.00 H new ATOM 0 HG3 ARG B 94 -3.717 2.319 -0.211 1.00 10.00 H new ATOM 0 HD2 ARG B 94 -2.875 1.586 2.603 1.00 10.00 H new ATOM 0 HD3 ARG B 94 -2.105 2.738 1.531 1.00 10.00 H new ATOM 0 HE ARG B 94 -4.758 3.639 1.896 1.00 10.00 H new ATOM 0 HH11 ARG B 94 -1.812 3.250 3.855 1.00 10.00 H new ATOM 0 HH12 ARG B 94 -2.336 4.485 5.005 1.00 10.00 H new ATOM 0 HH21 ARG B 94 -5.281 5.228 3.499 1.00 10.00 H new ATOM 0 HH22 ARG B 94 -4.142 5.514 4.818 1.00 10.00 H new ATOM 1475 N THR B 95 -7.457 -0.911 1.503 1.00 10.00 N ATOM 1476 CA THR B 95 -8.886 -1.176 1.742 1.00 10.00 C ATOM 1477 C THR B 95 -9.090 -1.719 3.155 1.00 10.00 C ATOM 1478 O THR B 95 -9.869 -1.141 3.906 1.00 10.00 O ATOM 1479 CB THR B 95 -9.529 -2.104 0.689 1.00 10.00 C ATOM 1480 OG1 THR B 95 -9.111 -1.857 -0.634 1.00 10.00 O ATOM 1481 CG2 THR B 95 -11.037 -1.852 0.646 1.00 10.00 C ATOM 0 H THR B 95 -7.052 -1.433 0.726 1.00 10.00 H new ATOM 0 HA THR B 95 -9.402 -0.221 1.643 1.00 10.00 H new ATOM 0 HB THR B 95 -9.238 -3.109 0.993 1.00 10.00 H new ATOM 0 HG1 THR B 95 -8.236 -2.273 -0.784 1.00 10.00 H new ATOM 0 HG21 THR B 95 -11.494 -2.506 -0.097 1.00 10.00 H new ATOM 0 HG22 THR B 95 -11.468 -2.058 1.626 1.00 10.00 H new ATOM 0 HG23 THR B 95 -11.225 -0.812 0.378 1.00 10.00 H new ATOM 1489 N ALA B 96 -8.328 -2.740 3.570 1.00 10.00 N ATOM 1490 CA ALA B 96 -8.290 -3.201 4.957 1.00 10.00 C ATOM 1491 C ALA B 96 -7.982 -2.052 5.928 1.00 10.00 C ATOM 1492 O ALA B 96 -8.714 -1.895 6.894 1.00 10.00 O ATOM 1493 CB ALA B 96 -7.313 -4.370 5.086 1.00 10.00 C ATOM 0 H ALA B 96 -7.719 -3.270 2.946 1.00 10.00 H new ATOM 0 HA ALA B 96 -9.278 -3.564 5.239 1.00 10.00 H new ATOM 0 HB1 ALA B 96 -7.288 -4.710 6.121 1.00 10.00 H new ATOM 0 HB2 ALA B 96 -7.637 -5.188 4.443 1.00 10.00 H new ATOM 0 HB3 ALA B 96 -6.316 -4.046 4.786 1.00 10.00 H new ATOM 1499 N LYS B 97 -6.984 -1.191 5.649 1.00 10.00 N ATOM 1500 CA LYS B 97 -6.602 -0.013 6.450 1.00 10.00 C ATOM 1501 C LYS B 97 -7.745 0.912 6.815 1.00 10.00 C ATOM 1502 O LYS B 97 -7.598 1.638 7.781 1.00 10.00 O ATOM 1503 CB LYS B 97 -5.490 0.804 5.760 1.00 10.00 C ATOM 1504 CG LYS B 97 -4.683 1.705 6.712 1.00 10.00 C ATOM 1505 CD LYS B 97 -4.135 0.961 7.939 1.00 10.00 C ATOM 1506 CE LYS B 97 -3.496 -0.359 7.533 1.00 10.00 C ATOM 1507 NZ LYS B 97 -2.617 -0.895 8.591 1.00 10.00 N ATOM 0 H LYS B 97 -6.397 -1.303 4.823 1.00 10.00 H new ATOM 0 HA LYS B 97 -6.237 -0.439 7.385 1.00 10.00 H new ATOM 0 HB2 LYS B 97 -4.806 0.117 5.262 1.00 10.00 H new ATOM 0 HB3 LYS B 97 -5.939 1.425 4.985 1.00 10.00 H new ATOM 0 HG2 LYS B 97 -3.851 2.148 6.164 1.00 10.00 H new ATOM 0 HG3 LYS B 97 -5.317 2.526 7.047 1.00 10.00 H new ATOM 0 HD2 LYS B 97 -3.400 1.584 8.449 1.00 10.00 H new ATOM 0 HD3 LYS B 97 -4.942 0.776 8.648 1.00 10.00 H new ATOM 0 HE2 LYS B 97 -4.277 -1.086 7.307 1.00 10.00 H new ATOM 0 HE3 LYS B 97 -2.919 -0.217 6.619 1.00 10.00 H new ATOM 0 HZ1 LYS B 97 -2.488 -1.917 8.450 1.00 10.00 H new ATOM 0 HZ2 LYS B 97 -1.693 -0.420 8.548 1.00 10.00 H new ATOM 0 HZ3 LYS B 97 -3.050 -0.726 9.521 1.00 10.00 H new ATOM 1521 N TYR B 98 -8.864 0.859 6.111 1.00 10.00 N ATOM 1522 CA TYR B 98 -10.065 1.631 6.411 1.00 10.00 C ATOM 1523 C TYR B 98 -11.202 0.867 7.063 1.00 10.00 C ATOM 1524 O TYR B 98 -12.128 1.530 7.533 1.00 10.00 O ATOM 1525 CB TYR B 98 -10.525 2.206 5.090 1.00 10.00 C ATOM 1526 CG TYR B 98 -9.497 3.074 4.432 1.00 10.00 C ATOM 1527 CD1 TYR B 98 -8.597 3.844 5.194 1.00 10.00 C ATOM 1528 CD2 TYR B 98 -9.383 3.014 3.032 1.00 10.00 C ATOM 1529 CE1 TYR B 98 -7.647 4.631 4.543 1.00 10.00 C ATOM 1530 CE2 TYR B 98 -8.480 3.853 2.368 1.00 10.00 C ATOM 1531 CZ TYR B 98 -7.650 4.712 3.135 1.00 10.00 C ATOM 1532 OH TYR B 98 -6.771 5.580 2.562 1.00 10.00 O ATOM 0 H TYR B 98 -8.968 0.261 5.291 1.00 10.00 H new ATOM 0 HA TYR B 98 -9.800 2.381 7.157 1.00 10.00 H new ATOM 0 HB2 TYR B 98 -10.785 1.389 4.417 1.00 10.00 H new ATOM 0 HB3 TYR B 98 -11.433 2.788 5.251 1.00 10.00 H new ATOM 0 HD1 TYR B 98 -8.642 3.825 6.273 1.00 10.00 H new ATOM 0 HD2 TYR B 98 -9.991 2.321 2.469 1.00 10.00 H new ATOM 0 HE1 TYR B 98 -6.911 5.177 5.115 1.00 10.00 H new ATOM 0 HE2 TYR B 98 -8.416 3.847 1.290 1.00 10.00 H new ATOM 0 HH TYR B 98 -6.557 5.277 1.655 1.00 10.00 H new ATOM 1542 N VAL B 99 -11.202 -0.477 7.076 1.00 10.00 N ATOM 1543 CA VAL B 99 -12.408 -1.178 7.523 1.00 10.00 C ATOM 1544 C VAL B 99 -12.795 -0.852 8.959 1.00 10.00 C ATOM 1545 O VAL B 99 -13.957 -0.511 9.192 1.00 10.00 O ATOM 1546 CB VAL B 99 -12.551 -2.627 7.030 1.00 10.00 C ATOM 1547 CG1 VAL B 99 -12.419 -2.640 5.495 1.00 10.00 C ATOM 1548 CG2 VAL B 99 -11.579 -3.619 7.662 1.00 10.00 C ATOM 0 H VAL B 99 -10.421 -1.071 6.797 1.00 10.00 H new ATOM 0 HA VAL B 99 -13.239 -0.742 6.969 1.00 10.00 H new ATOM 0 HB VAL B 99 -13.536 -2.970 7.346 1.00 10.00 H new ATOM 0 HG11 VAL B 99 -12.518 -3.662 5.130 1.00 10.00 H new ATOM 0 HG12 VAL B 99 -13.202 -2.021 5.057 1.00 10.00 H new ATOM 0 HG13 VAL B 99 -11.443 -2.246 5.210 1.00 10.00 H new ATOM 0 HG21 VAL B 99 -11.756 -4.613 7.252 1.00 10.00 H new ATOM 0 HG22 VAL B 99 -10.555 -3.314 7.445 1.00 10.00 H new ATOM 0 HG23 VAL B 99 -11.730 -3.639 8.741 1.00 10.00 H new