USER MOD reduce.3.24.130724 H: found=0, std=0, add=955, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 958 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 119 CYS SG : rot 150:sc= -0.237 USER MOD Set 1.2: A 124 CYS SG : rot 180:sc= 0 USER MOD Set 2.1: A 100 SER OG : rot -101:sc= 0.226 USER MOD Set 2.2: A 103 GLN : amide:sc= -6.57! C(o=-6.3!,f=-2.7!) USER MOD Set 3.1: A 64 ASN : amide:sc= 0.313 K(o=-1,f=-4.7!) USER MOD Set 3.2: A 72 MET CE :methyl -121:sc= -1.06 (180deg=-1.24) USER MOD Set 3.3: A 74 MET CE :methyl -144:sc= -0.259 (180deg=-1.06) USER MOD Single : A 9 GLN : amide:sc= -0.374 K(o=-0.37,f=-1.4!) USER MOD Single : A 13 GLN : amide:sc= -1.29! X(o=-1.3!,f=-0.95) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 MET CE :methyl 160:sc= 0 (180deg=-0.948) USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 ASN : amide:sc= -0.372 X(o=-0.37,f=-0.05) USER MOD Single : A 35 GLN : amide:sc= -0.111 X(o=-0.11,f=-0.55) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 CYS SG : rot 180:sc=-0.00736 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.000491) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -3.44! K(o=-3.4!,f=-0.96) USER MOD Single : A 63 MET CE :methyl 153:sc= -1.77! (180deg=-1.95!) USER MOD Single : A 68 SER OG : rot 180:sc= 0.0248 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -114:sc= -1.48 USER MOD Single : A 84 LYS NZ :NH3+ -165:sc=-0.00268 (180deg=-0.0896) USER MOD Single : A 85 TYR OH : rot -64:sc= 0.564 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 157:sc= -0.409 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -4.34 K(o=-4.3,f=-6.2!) USER MOD Single : A 105 THR OG1 : rot 87:sc= 1.26 USER MOD Single : A 106 GLN : amide:sc= 1.15 K(o=1.1,f=-0.13) USER MOD Single : A 108 ASN : amide:sc= -0.758 K(o=-0.76,f=-4.9!) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HD1:sc= -0.324 K(o=-0.32,f=-1.1) USER MOD Single : A 120 HIS : no HD1:sc=-0.00154 X(o=-0.0015,f=0) USER MOD Single : A 127 ASN : amide:sc= -0.0619 K(o=-0.062,f=-1.4!) USER MOD Single : A 129 THR OG1 : rot -41:sc= 1.07 USER MOD Single : A 135 HIS : no HD1:sc= -9.18! C(o=-9.2!,f=-9!) USER MOD Single : A 137 SER OG : rot -59:sc= 1.23 USER MOD Single : A 139 TYR OH : rot 48:sc= -1.7 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 8 -1.971 22.768 5.589 1.00 0.00 N ATOM 67 CA GLU A 8 -1.915 21.538 6.369 1.00 0.00 C ATOM 68 C GLU A 8 -2.075 20.316 5.470 1.00 0.00 C ATOM 69 O GLU A 8 -1.318 19.351 5.577 1.00 0.00 O ATOM 70 CB GLU A 8 -3.003 21.540 7.445 1.00 0.00 C ATOM 71 CG GLU A 8 -4.411 21.669 6.887 1.00 0.00 C ATOM 72 CD GLU A 8 -5.473 21.636 7.968 1.00 0.00 C ATOM 73 OE1 GLU A 8 -5.523 22.582 8.781 1.00 0.00 O ATOM 74 OE2 GLU A 8 -6.254 20.661 8.002 1.00 0.00 O ATOM 0 HA GLU A 8 -0.938 21.488 6.851 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -2.933 20.618 8.022 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -2.818 22.363 8.135 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -4.493 22.603 6.331 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -4.593 20.860 6.180 1.00 0.00 H new ATOM 81 N GLN A 9 -3.066 20.365 4.586 1.00 0.00 N ATOM 82 CA GLN A 9 -3.326 19.261 3.669 1.00 0.00 C ATOM 83 C GLN A 9 -2.026 18.726 3.078 1.00 0.00 C ATOM 84 O GLN A 9 -1.660 17.573 3.301 1.00 0.00 O ATOM 85 CB GLN A 9 -4.263 19.712 2.547 1.00 0.00 C ATOM 86 CG GLN A 9 -4.958 18.563 1.835 1.00 0.00 C ATOM 87 CD GLN A 9 -5.547 18.974 0.500 1.00 0.00 C ATOM 88 OE1 GLN A 9 -5.050 19.890 -0.155 1.00 0.00 O ATOM 89 NE2 GLN A 9 -6.612 18.296 0.089 1.00 0.00 N ATOM 0 H GLN A 9 -3.702 21.156 4.485 1.00 0.00 H new ATOM 0 HA GLN A 9 -3.804 18.459 4.232 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -5.017 20.381 2.962 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -3.693 20.288 1.818 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -4.245 17.753 1.679 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -5.751 18.172 2.473 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -6.991 17.544 0.664 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -7.051 18.527 -0.802 1.00 0.00 H new ATOM 98 N ALA A 10 -1.333 19.572 2.322 1.00 0.00 N ATOM 99 CA ALA A 10 -0.073 19.185 1.700 1.00 0.00 C ATOM 100 C ALA A 10 0.777 18.353 2.654 1.00 0.00 C ATOM 101 O ALA A 10 1.355 17.340 2.261 1.00 0.00 O ATOM 102 CB ALA A 10 0.693 20.419 1.247 1.00 0.00 C ATOM 0 H ALA A 10 -1.623 20.530 2.126 1.00 0.00 H new ATOM 0 HA ALA A 10 -0.300 18.572 0.828 1.00 0.00 H new ATOM 0 HB1 ALA A 10 1.632 20.115 0.784 1.00 0.00 H new ATOM 0 HB2 ALA A 10 0.095 20.973 0.524 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.902 21.054 2.108 1.00 0.00 H new ATOM 108 N GLU A 11 0.849 18.787 3.908 1.00 0.00 N ATOM 109 CA GLU A 11 1.630 18.082 4.917 1.00 0.00 C ATOM 110 C GLU A 11 1.031 16.709 5.207 1.00 0.00 C ATOM 111 O GLU A 11 1.747 15.710 5.279 1.00 0.00 O ATOM 112 CB GLU A 11 1.700 18.903 6.206 1.00 0.00 C ATOM 113 CG GLU A 11 2.329 20.274 6.021 1.00 0.00 C ATOM 114 CD GLU A 11 2.867 20.849 7.318 1.00 0.00 C ATOM 115 OE1 GLU A 11 3.859 20.302 7.843 1.00 0.00 O ATOM 116 OE2 GLU A 11 2.295 21.846 7.806 1.00 0.00 O ATOM 0 H GLU A 11 0.376 19.624 4.249 1.00 0.00 H new ATOM 0 HA GLU A 11 2.639 17.944 4.528 1.00 0.00 H new ATOM 0 HB2 GLU A 11 0.693 19.025 6.604 1.00 0.00 H new ATOM 0 HB3 GLU A 11 2.271 18.348 6.950 1.00 0.00 H new ATOM 0 HG2 GLU A 11 3.139 20.203 5.296 1.00 0.00 H new ATOM 0 HG3 GLU A 11 1.588 20.957 5.605 1.00 0.00 H new ATOM 123 N ALA A 12 -0.287 16.668 5.374 1.00 0.00 N ATOM 124 CA ALA A 12 -0.983 15.419 5.655 1.00 0.00 C ATOM 125 C ALA A 12 -0.411 14.273 4.826 1.00 0.00 C ATOM 126 O ALA A 12 -0.093 13.210 5.358 1.00 0.00 O ATOM 127 CB ALA A 12 -2.473 15.573 5.388 1.00 0.00 C ATOM 0 H ALA A 12 -0.894 17.486 5.319 1.00 0.00 H new ATOM 0 HA ALA A 12 -0.837 15.180 6.708 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -2.980 14.632 5.602 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -2.878 16.357 6.027 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -2.630 15.840 4.343 1.00 0.00 H new ATOM 133 N GLN A 13 -0.284 14.498 3.522 1.00 0.00 N ATOM 134 CA GLN A 13 0.248 13.483 2.621 1.00 0.00 C ATOM 135 C GLN A 13 1.742 13.281 2.850 1.00 0.00 C ATOM 136 O GLN A 13 2.185 12.188 3.206 1.00 0.00 O ATOM 137 CB GLN A 13 -0.008 13.879 1.166 1.00 0.00 C ATOM 138 CG GLN A 13 -1.347 13.398 0.631 1.00 0.00 C ATOM 139 CD GLN A 13 -1.533 13.707 -0.841 1.00 0.00 C ATOM 140 OE1 GLN A 13 -0.710 13.330 -1.676 1.00 0.00 O ATOM 141 NE2 GLN A 13 -2.619 14.398 -1.169 1.00 0.00 N ATOM 0 H GLN A 13 -0.542 15.373 3.067 1.00 0.00 H new ATOM 0 HA GLN A 13 -0.263 12.543 2.830 1.00 0.00 H new ATOM 0 HB2 GLN A 13 0.039 14.965 1.080 1.00 0.00 H new ATOM 0 HB3 GLN A 13 0.789 13.475 0.542 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -1.430 12.322 0.786 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -2.150 13.865 1.201 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -3.275 14.691 -0.445 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -2.797 14.636 -2.145 1.00 0.00 H new ATOM 150 N LEU A 14 2.516 14.341 2.644 1.00 0.00 N ATOM 151 CA LEU A 14 3.962 14.281 2.828 1.00 0.00 C ATOM 152 C LEU A 14 4.316 13.578 4.135 1.00 0.00 C ATOM 153 O LEU A 14 4.928 12.510 4.130 1.00 0.00 O ATOM 154 CB LEU A 14 4.557 15.690 2.817 1.00 0.00 C ATOM 155 CG LEU A 14 6.043 15.794 3.160 1.00 0.00 C ATOM 156 CD1 LEU A 14 6.880 15.027 2.148 1.00 0.00 C ATOM 157 CD2 LEU A 14 6.476 17.252 3.218 1.00 0.00 C ATOM 0 H LEU A 14 2.166 15.253 2.349 1.00 0.00 H new ATOM 0 HA LEU A 14 4.385 13.708 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 14 4.402 16.120 1.828 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.998 16.304 3.523 1.00 0.00 H new ATOM 0 HG LEU A 14 6.201 15.349 4.142 1.00 0.00 H new ATOM 0 HD11 LEU A 14 7.935 15.113 2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 14 6.588 13.977 2.156 1.00 0.00 H new ATOM 0 HD13 LEU A 14 6.717 15.441 1.153 1.00 0.00 H new ATOM 0 HD21 LEU A 14 7.537 17.307 3.463 1.00 0.00 H new ATOM 0 HD22 LEU A 14 6.303 17.722 2.250 1.00 0.00 H new ATOM 0 HD23 LEU A 14 5.899 17.773 3.982 1.00 0.00 H new ATOM 169 N ALA A 15 3.924 14.183 5.251 1.00 0.00 N ATOM 170 CA ALA A 15 4.196 13.613 6.565 1.00 0.00 C ATOM 171 C ALA A 15 4.129 12.090 6.527 1.00 0.00 C ATOM 172 O ALA A 15 5.106 11.409 6.835 1.00 0.00 O ATOM 173 CB ALA A 15 3.216 14.161 7.591 1.00 0.00 C ATOM 0 H ALA A 15 3.417 15.068 5.272 1.00 0.00 H new ATOM 0 HA ALA A 15 5.207 13.899 6.856 1.00 0.00 H new ATOM 0 HB1 ALA A 15 3.431 13.727 8.567 1.00 0.00 H new ATOM 0 HB2 ALA A 15 3.315 15.245 7.646 1.00 0.00 H new ATOM 0 HB3 ALA A 15 2.199 13.904 7.296 1.00 0.00 H new ATOM 179 N GLU A 16 2.969 11.563 6.148 1.00 0.00 N ATOM 180 CA GLU A 16 2.775 10.120 6.072 1.00 0.00 C ATOM 181 C GLU A 16 3.908 9.458 5.294 1.00 0.00 C ATOM 182 O GLU A 16 4.554 8.530 5.783 1.00 0.00 O ATOM 183 CB GLU A 16 1.432 9.797 5.413 1.00 0.00 C ATOM 184 CG GLU A 16 0.900 8.417 5.759 1.00 0.00 C ATOM 185 CD GLU A 16 -0.388 8.089 5.030 1.00 0.00 C ATOM 186 OE1 GLU A 16 -0.652 8.711 3.980 1.00 0.00 O ATOM 187 OE2 GLU A 16 -1.133 7.208 5.509 1.00 0.00 O ATOM 0 H GLU A 16 2.150 12.113 5.889 1.00 0.00 H new ATOM 0 HA GLU A 16 2.777 9.726 7.088 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.700 10.546 5.715 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.540 9.875 4.331 1.00 0.00 H new ATOM 0 HG2 GLU A 16 1.653 7.669 5.512 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.730 8.356 6.834 1.00 0.00 H new ATOM 194 N LEU A 17 4.145 9.943 4.079 1.00 0.00 N ATOM 195 CA LEU A 17 5.200 9.399 3.231 1.00 0.00 C ATOM 196 C LEU A 17 6.517 9.303 3.995 1.00 0.00 C ATOM 197 O LEU A 17 7.027 8.208 4.238 1.00 0.00 O ATOM 198 CB LEU A 17 5.382 10.271 1.988 1.00 0.00 C ATOM 199 CG LEU A 17 4.122 10.534 1.163 1.00 0.00 C ATOM 200 CD1 LEU A 17 4.418 11.505 0.030 1.00 0.00 C ATOM 201 CD2 LEU A 17 3.560 9.230 0.617 1.00 0.00 C ATOM 0 H LEU A 17 3.621 10.711 3.660 1.00 0.00 H new ATOM 0 HA LEU A 17 4.905 8.396 2.924 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.795 11.230 2.299 1.00 0.00 H new ATOM 0 HB3 LEU A 17 6.123 9.799 1.343 1.00 0.00 H new ATOM 0 HG LEU A 17 3.373 10.985 1.814 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.509 11.680 -0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.773 12.449 0.443 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.184 11.083 -0.620 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.663 9.437 0.032 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.305 8.750 -0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 17 3.308 8.567 1.445 1.00 0.00 H new ATOM 213 N ASP A 18 7.061 10.454 4.373 1.00 0.00 N ATOM 214 CA ASP A 18 8.317 10.499 5.113 1.00 0.00 C ATOM 215 C ASP A 18 8.371 9.393 6.162 1.00 0.00 C ATOM 216 O ASP A 18 9.408 8.758 6.358 1.00 0.00 O ATOM 217 CB ASP A 18 8.490 11.863 5.784 1.00 0.00 C ATOM 218 CG ASP A 18 9.824 11.996 6.491 1.00 0.00 C ATOM 219 OD1 ASP A 18 10.838 12.244 5.805 1.00 0.00 O ATOM 220 OD2 ASP A 18 9.855 11.852 7.731 1.00 0.00 O ATOM 0 H ASP A 18 6.652 11.368 4.179 1.00 0.00 H new ATOM 0 HA ASP A 18 9.132 10.344 4.406 1.00 0.00 H new ATOM 0 HB2 ASP A 18 8.400 12.648 5.033 1.00 0.00 H new ATOM 0 HB3 ASP A 18 7.685 12.016 6.502 1.00 0.00 H new ATOM 225 N LEU A 19 7.247 9.166 6.833 1.00 0.00 N ATOM 226 CA LEU A 19 7.166 8.137 7.863 1.00 0.00 C ATOM 227 C LEU A 19 7.261 6.744 7.250 1.00 0.00 C ATOM 228 O LEU A 19 8.172 5.976 7.563 1.00 0.00 O ATOM 229 CB LEU A 19 5.859 8.273 8.646 1.00 0.00 C ATOM 230 CG LEU A 19 5.420 7.042 9.441 1.00 0.00 C ATOM 231 CD1 LEU A 19 6.456 6.693 10.498 1.00 0.00 C ATOM 232 CD2 LEU A 19 4.060 7.278 10.082 1.00 0.00 C ATOM 0 H LEU A 19 6.379 9.681 6.682 1.00 0.00 H new ATOM 0 HA LEU A 19 8.007 8.273 8.544 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.958 9.110 9.337 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.065 8.530 7.946 1.00 0.00 H new ATOM 0 HG LEU A 19 5.334 6.201 8.754 1.00 0.00 H new ATOM 0 HD11 LEU A 19 6.127 5.815 11.054 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.410 6.481 10.016 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.574 7.533 11.183 1.00 0.00 H new ATOM 0 HD21 LEU A 19 3.764 6.392 10.643 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.119 8.132 10.757 1.00 0.00 H new ATOM 0 HD23 LEU A 19 3.322 7.479 9.306 1.00 0.00 H new ATOM 244 N LEU A 20 6.316 6.424 6.372 1.00 0.00 N ATOM 245 CA LEU A 20 6.294 5.123 5.711 1.00 0.00 C ATOM 246 C LEU A 20 7.707 4.668 5.358 1.00 0.00 C ATOM 247 O LEU A 20 8.095 3.537 5.648 1.00 0.00 O ATOM 248 CB LEU A 20 5.435 5.186 4.447 1.00 0.00 C ATOM 249 CG LEU A 20 3.926 5.057 4.654 1.00 0.00 C ATOM 250 CD1 LEU A 20 3.180 5.401 3.374 1.00 0.00 C ATOM 251 CD2 LEU A 20 3.569 3.653 5.121 1.00 0.00 C ATOM 0 H LEU A 20 5.555 7.047 6.101 1.00 0.00 H new ATOM 0 HA LEU A 20 5.861 4.399 6.401 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.633 6.133 3.944 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.758 4.393 3.772 1.00 0.00 H new ATOM 0 HG LEU A 20 3.623 5.763 5.427 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.107 5.304 3.541 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.410 6.426 3.083 1.00 0.00 H new ATOM 0 HD13 LEU A 20 3.487 4.720 2.580 1.00 0.00 H new ATOM 0 HD21 LEU A 20 2.491 3.580 5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 20 3.886 2.928 4.371 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.074 3.444 6.064 1.00 0.00 H new ATOM 263 N ALA A 21 8.470 5.558 4.732 1.00 0.00 N ATOM 264 CA ALA A 21 9.841 5.249 4.343 1.00 0.00 C ATOM 265 C ALA A 21 10.593 4.565 5.480 1.00 0.00 C ATOM 266 O ALA A 21 11.254 3.547 5.276 1.00 0.00 O ATOM 267 CB ALA A 21 10.566 6.516 3.915 1.00 0.00 C ATOM 0 H ALA A 21 8.162 6.498 4.483 1.00 0.00 H new ATOM 0 HA ALA A 21 9.807 4.560 3.499 1.00 0.00 H new ATOM 0 HB1 ALA A 21 11.588 6.271 3.627 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.048 6.963 3.067 1.00 0.00 H new ATOM 0 HB3 ALA A 21 10.582 7.224 4.744 1.00 0.00 H new ATOM 273 N SER A 22 10.488 5.131 6.678 1.00 0.00 N ATOM 274 CA SER A 22 11.163 4.578 7.847 1.00 0.00 C ATOM 275 C SER A 22 10.431 3.342 8.362 1.00 0.00 C ATOM 276 O SER A 22 11.055 2.354 8.746 1.00 0.00 O ATOM 277 CB SER A 22 11.254 5.630 8.954 1.00 0.00 C ATOM 278 OG SER A 22 12.335 6.517 8.728 1.00 0.00 O ATOM 0 H SER A 22 9.942 5.972 6.865 1.00 0.00 H new ATOM 0 HA SER A 22 12.170 4.285 7.551 1.00 0.00 H new ATOM 0 HB2 SER A 22 10.322 6.193 9.002 1.00 0.00 H new ATOM 0 HB3 SER A 22 11.379 5.138 9.918 1.00 0.00 H new ATOM 0 HG SER A 22 12.370 7.180 9.449 1.00 0.00 H new ATOM 284 N MET A 23 9.104 3.407 8.366 1.00 0.00 N ATOM 285 CA MET A 23 8.286 2.293 8.833 1.00 0.00 C ATOM 286 C MET A 23 8.748 0.981 8.206 1.00 0.00 C ATOM 287 O MET A 23 8.724 -0.068 8.851 1.00 0.00 O ATOM 288 CB MET A 23 6.813 2.540 8.501 1.00 0.00 C ATOM 289 CG MET A 23 6.150 3.565 9.407 1.00 0.00 C ATOM 290 SD MET A 23 6.246 3.116 11.151 1.00 0.00 S ATOM 291 CE MET A 23 4.849 2.004 11.291 1.00 0.00 C ATOM 0 H MET A 23 8.572 4.218 8.051 1.00 0.00 H new ATOM 0 HA MET A 23 8.399 2.219 9.915 1.00 0.00 H new ATOM 0 HB2 MET A 23 6.733 2.876 7.467 1.00 0.00 H new ATOM 0 HB3 MET A 23 6.270 1.598 8.573 1.00 0.00 H new ATOM 0 HG2 MET A 23 6.624 4.535 9.259 1.00 0.00 H new ATOM 0 HG3 MET A 23 5.104 3.674 9.121 1.00 0.00 H new ATOM 0 HE1 MET A 23 4.970 1.377 12.174 1.00 0.00 H new ATOM 0 HE2 MET A 23 3.930 2.584 11.380 1.00 0.00 H new ATOM 0 HE3 MET A 23 4.795 1.374 10.403 1.00 0.00 H new ATOM 301 N PHE A 24 9.167 1.046 6.947 1.00 0.00 N ATOM 302 CA PHE A 24 9.632 -0.137 6.234 1.00 0.00 C ATOM 303 C PHE A 24 11.145 -0.096 6.040 1.00 0.00 C ATOM 304 O PHE A 24 11.650 0.200 4.957 1.00 0.00 O ATOM 305 CB PHE A 24 8.936 -0.247 4.876 1.00 0.00 C ATOM 306 CG PHE A 24 7.453 -0.462 4.978 1.00 0.00 C ATOM 307 CD1 PHE A 24 6.598 0.606 5.198 1.00 0.00 C ATOM 308 CD2 PHE A 24 6.914 -1.733 4.854 1.00 0.00 C ATOM 309 CE1 PHE A 24 5.233 0.410 5.294 1.00 0.00 C ATOM 310 CE2 PHE A 24 5.549 -1.934 4.948 1.00 0.00 C ATOM 311 CZ PHE A 24 4.708 -0.861 5.167 1.00 0.00 C ATOM 0 H PHE A 24 9.194 1.906 6.399 1.00 0.00 H new ATOM 0 HA PHE A 24 9.384 -1.012 6.834 1.00 0.00 H new ATOM 0 HB2 PHE A 24 9.125 0.662 4.305 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.377 -1.072 4.316 1.00 0.00 H new ATOM 0 HD1 PHE A 24 7.003 1.603 5.296 1.00 0.00 H new ATOM 0 HD2 PHE A 24 7.567 -2.576 4.682 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.577 1.250 5.468 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.141 -2.929 4.850 1.00 0.00 H new ATOM 0 HZ PHE A 24 3.642 -1.015 5.239 1.00 0.00 H new ATOM 357 N ASN A 28 14.609 -3.436 0.425 1.00 0.00 N ATOM 358 CA ASN A 28 13.686 -3.621 -0.689 1.00 0.00 C ATOM 359 C ASN A 28 12.262 -3.840 -0.186 1.00 0.00 C ATOM 360 O ASN A 28 11.543 -4.703 -0.688 1.00 0.00 O ATOM 361 CB ASN A 28 14.124 -4.809 -1.549 1.00 0.00 C ATOM 362 CG ASN A 28 15.632 -4.912 -1.666 1.00 0.00 C ATOM 363 OD1 ASN A 28 16.280 -4.052 -2.264 1.00 0.00 O ATOM 364 ND2 ASN A 28 16.199 -5.969 -1.096 1.00 0.00 N ATOM 0 HA ASN A 28 13.702 -2.716 -1.296 1.00 0.00 H new ATOM 0 HB2 ASN A 28 13.732 -5.730 -1.118 1.00 0.00 H new ATOM 0 HB3 ASN A 28 13.691 -4.713 -2.545 1.00 0.00 H new ATOM 0 HD21 ASN A 28 17.210 -6.093 -1.144 1.00 0.00 H new ATOM 0 HD22 ASN A 28 15.623 -6.657 -0.611 1.00 0.00 H new ATOM 371 N GLU A 29 11.863 -3.052 0.807 1.00 0.00 N ATOM 372 CA GLU A 29 10.526 -3.160 1.377 1.00 0.00 C ATOM 373 C GLU A 29 9.578 -2.150 0.737 1.00 0.00 C ATOM 374 O GLU A 29 8.382 -2.408 0.595 1.00 0.00 O ATOM 375 CB GLU A 29 10.573 -2.942 2.891 1.00 0.00 C ATOM 376 CG GLU A 29 11.149 -4.122 3.658 1.00 0.00 C ATOM 377 CD GLU A 29 10.336 -5.389 3.475 1.00 0.00 C ATOM 378 OE1 GLU A 29 9.103 -5.336 3.666 1.00 0.00 O ATOM 379 OE2 GLU A 29 10.934 -6.433 3.140 1.00 0.00 O ATOM 0 H GLU A 29 12.447 -2.332 1.233 1.00 0.00 H new ATOM 0 HA GLU A 29 10.153 -4.163 1.173 1.00 0.00 H new ATOM 0 HB2 GLU A 29 11.170 -2.055 3.104 1.00 0.00 H new ATOM 0 HB3 GLU A 29 9.564 -2.742 3.252 1.00 0.00 H new ATOM 0 HG2 GLU A 29 12.172 -4.300 3.328 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.195 -3.874 4.718 1.00 0.00 H new ATOM 386 N LEU A 30 10.120 -1.000 0.352 1.00 0.00 N ATOM 387 CA LEU A 30 9.324 0.050 -0.273 1.00 0.00 C ATOM 388 C LEU A 30 10.115 0.752 -1.372 1.00 0.00 C ATOM 389 O LEU A 30 11.297 1.052 -1.204 1.00 0.00 O ATOM 390 CB LEU A 30 8.872 1.068 0.776 1.00 0.00 C ATOM 391 CG LEU A 30 8.450 2.438 0.244 1.00 0.00 C ATOM 392 CD1 LEU A 30 7.418 3.072 1.163 1.00 0.00 C ATOM 393 CD2 LEU A 30 9.661 3.347 0.091 1.00 0.00 C ATOM 0 H LEU A 30 11.108 -0.771 0.462 1.00 0.00 H new ATOM 0 HA LEU A 30 8.446 -0.413 -0.723 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.035 0.642 1.330 1.00 0.00 H new ATOM 0 HB3 LEU A 30 9.685 1.212 1.488 1.00 0.00 H new ATOM 0 HG LEU A 30 7.997 2.302 -0.738 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.129 4.046 0.769 1.00 0.00 H new ATOM 0 HD12 LEU A 30 6.539 2.430 1.222 1.00 0.00 H new ATOM 0 HD13 LEU A 30 7.844 3.195 2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 30 9.342 4.318 -0.289 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.143 3.477 1.060 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.367 2.898 -0.608 1.00 0.00 H new ATOM 405 N ILE A 31 9.454 1.013 -2.495 1.00 0.00 N ATOM 406 CA ILE A 31 10.095 1.683 -3.619 1.00 0.00 C ATOM 407 C ILE A 31 9.258 2.861 -4.107 1.00 0.00 C ATOM 408 O ILE A 31 8.103 2.695 -4.498 1.00 0.00 O ATOM 409 CB ILE A 31 10.330 0.713 -4.793 1.00 0.00 C ATOM 410 CG1 ILE A 31 11.183 -0.473 -4.340 1.00 0.00 C ATOM 411 CG2 ILE A 31 10.995 1.438 -5.954 1.00 0.00 C ATOM 412 CD1 ILE A 31 10.371 -1.629 -3.798 1.00 0.00 C ATOM 0 H ILE A 31 8.475 0.771 -2.650 1.00 0.00 H new ATOM 0 HA ILE A 31 11.058 2.048 -3.262 1.00 0.00 H new ATOM 0 HB ILE A 31 9.365 0.334 -5.131 1.00 0.00 H new ATOM 0 HG12 ILE A 31 11.781 -0.823 -5.182 1.00 0.00 H new ATOM 0 HG13 ILE A 31 11.879 -0.137 -3.572 1.00 0.00 H new ATOM 0 HG21 ILE A 31 11.154 0.740 -6.776 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.353 2.253 -6.290 1.00 0.00 H new ATOM 0 HG23 ILE A 31 11.954 1.842 -5.630 1.00 0.00 H new ATOM 0 HD11 ILE A 31 11.041 -2.434 -3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 31 9.793 -1.295 -2.936 1.00 0.00 H new ATOM 0 HD13 ILE A 31 9.693 -1.992 -4.571 1.00 0.00 H new ATOM 424 N VAL A 32 9.851 4.050 -4.084 1.00 0.00 N ATOM 425 CA VAL A 32 9.161 5.256 -4.527 1.00 0.00 C ATOM 426 C VAL A 32 9.604 5.659 -5.929 1.00 0.00 C ATOM 427 O VAL A 32 10.603 6.356 -6.099 1.00 0.00 O ATOM 428 CB VAL A 32 9.412 6.432 -3.564 1.00 0.00 C ATOM 429 CG1 VAL A 32 8.792 7.710 -4.108 1.00 0.00 C ATOM 430 CG2 VAL A 32 8.867 6.112 -2.180 1.00 0.00 C ATOM 0 H VAL A 32 10.807 4.204 -3.764 1.00 0.00 H new ATOM 0 HA VAL A 32 8.096 5.025 -4.538 1.00 0.00 H new ATOM 0 HB VAL A 32 10.488 6.587 -3.479 1.00 0.00 H new ATOM 0 HG11 VAL A 32 8.980 8.529 -3.414 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.234 7.946 -5.076 1.00 0.00 H new ATOM 0 HG13 VAL A 32 7.717 7.572 -4.224 1.00 0.00 H new ATOM 0 HG21 VAL A 32 9.053 6.953 -1.512 1.00 0.00 H new ATOM 0 HG22 VAL A 32 7.794 5.930 -2.245 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.363 5.223 -1.790 1.00 0.00 H new ATOM 440 N ASN A 33 8.852 5.215 -6.931 1.00 0.00 N ATOM 441 CA ASN A 33 9.167 5.529 -8.320 1.00 0.00 C ATOM 442 C ASN A 33 9.098 7.033 -8.567 1.00 0.00 C ATOM 443 O ASN A 33 10.070 7.644 -9.013 1.00 0.00 O ATOM 444 CB ASN A 33 8.203 4.803 -9.260 1.00 0.00 C ATOM 445 CG ASN A 33 8.630 3.373 -9.535 1.00 0.00 C ATOM 446 OD1 ASN A 33 9.688 3.130 -10.114 1.00 0.00 O ATOM 447 ND2 ASN A 33 7.805 2.420 -9.118 1.00 0.00 N ATOM 0 H ASN A 33 8.021 4.637 -6.807 1.00 0.00 H new ATOM 0 HA ASN A 33 10.184 5.191 -8.521 1.00 0.00 H new ATOM 0 HB2 ASN A 33 7.204 4.803 -8.823 1.00 0.00 H new ATOM 0 HB3 ASN A 33 8.139 5.348 -10.202 1.00 0.00 H new ATOM 0 HD21 ASN A 33 8.038 1.439 -9.274 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.938 2.669 -8.642 1.00 0.00 H new ATOM 454 N ASP A 34 7.945 7.623 -8.273 1.00 0.00 N ATOM 455 CA ASP A 34 7.750 9.056 -8.461 1.00 0.00 C ATOM 456 C ASP A 34 8.479 9.850 -7.381 1.00 0.00 C ATOM 457 O ASP A 34 7.900 10.192 -6.351 1.00 0.00 O ATOM 458 CB ASP A 34 6.259 9.396 -8.441 1.00 0.00 C ATOM 459 CG ASP A 34 5.930 10.605 -9.295 1.00 0.00 C ATOM 460 OD1 ASP A 34 6.550 11.668 -9.084 1.00 0.00 O ATOM 461 OD2 ASP A 34 5.052 10.487 -10.175 1.00 0.00 O ATOM 0 H ASP A 34 7.131 7.131 -7.904 1.00 0.00 H new ATOM 0 HA ASP A 34 8.165 9.330 -9.431 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.689 8.538 -8.796 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.946 9.584 -7.414 1.00 0.00 H new ATOM 466 N GLN A 35 9.754 10.138 -7.625 1.00 0.00 N ATOM 467 CA GLN A 35 10.562 10.890 -6.673 1.00 0.00 C ATOM 468 C GLN A 35 10.216 12.375 -6.718 1.00 0.00 C ATOM 469 O GLN A 35 10.017 13.008 -5.680 1.00 0.00 O ATOM 470 CB GLN A 35 12.050 10.692 -6.967 1.00 0.00 C ATOM 471 CG GLN A 35 12.602 9.373 -6.453 1.00 0.00 C ATOM 472 CD GLN A 35 12.570 9.276 -4.940 1.00 0.00 C ATOM 473 OE1 GLN A 35 12.920 10.226 -4.239 1.00 0.00 O ATOM 474 NE2 GLN A 35 12.148 8.126 -4.428 1.00 0.00 N ATOM 0 H GLN A 35 10.249 9.862 -8.473 1.00 0.00 H new ATOM 0 HA GLN A 35 10.343 10.515 -5.673 1.00 0.00 H new ATOM 0 HB2 GLN A 35 12.209 10.748 -8.044 1.00 0.00 H new ATOM 0 HB3 GLN A 35 12.612 11.511 -6.519 1.00 0.00 H new ATOM 0 HG2 GLN A 35 12.025 8.552 -6.878 1.00 0.00 H new ATOM 0 HG3 GLN A 35 13.629 9.254 -6.799 1.00 0.00 H new ATOM 0 HE21 GLN A 35 11.867 7.365 -5.046 1.00 0.00 H new ATOM 0 HE22 GLN A 35 12.104 8.004 -3.416 1.00 0.00 H new ATOM 483 N LEU A 36 10.146 12.925 -7.925 1.00 0.00 N ATOM 484 CA LEU A 36 9.824 14.336 -8.106 1.00 0.00 C ATOM 485 C LEU A 36 8.574 14.714 -7.318 1.00 0.00 C ATOM 486 O LEU A 36 8.540 15.743 -6.644 1.00 0.00 O ATOM 487 CB LEU A 36 9.620 14.647 -9.589 1.00 0.00 C ATOM 488 CG LEU A 36 9.475 16.126 -9.951 1.00 0.00 C ATOM 489 CD1 LEU A 36 10.842 16.772 -10.110 1.00 0.00 C ATOM 490 CD2 LEU A 36 8.657 16.286 -11.224 1.00 0.00 C ATOM 0 H LEU A 36 10.308 12.415 -8.793 1.00 0.00 H new ATOM 0 HA LEU A 36 10.660 14.925 -7.730 1.00 0.00 H new ATOM 0 HB2 LEU A 36 10.464 14.239 -10.145 1.00 0.00 H new ATOM 0 HB3 LEU A 36 8.729 14.121 -9.931 1.00 0.00 H new ATOM 0 HG LEU A 36 8.949 16.629 -9.139 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.720 17.824 -10.368 1.00 0.00 H new ATOM 0 HD12 LEU A 36 11.395 16.689 -9.174 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.393 16.266 -10.903 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.564 17.345 -11.466 1.00 0.00 H new ATOM 0 HD22 LEU A 36 9.155 15.768 -12.044 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.665 15.860 -11.075 1.00 0.00 H new ATOM 502 N ALA A 37 7.548 13.874 -7.407 1.00 0.00 N ATOM 503 CA ALA A 37 6.297 14.118 -6.700 1.00 0.00 C ATOM 504 C ALA A 37 6.556 14.628 -5.286 1.00 0.00 C ATOM 505 O ALA A 37 5.867 15.526 -4.803 1.00 0.00 O ATOM 506 CB ALA A 37 5.457 12.850 -6.660 1.00 0.00 C ATOM 0 H ALA A 37 7.559 13.018 -7.962 1.00 0.00 H new ATOM 0 HA ALA A 37 5.747 14.888 -7.241 1.00 0.00 H new ATOM 0 HB1 ALA A 37 4.526 13.047 -6.129 1.00 0.00 H new ATOM 0 HB2 ALA A 37 5.234 12.529 -7.678 1.00 0.00 H new ATOM 0 HB3 ALA A 37 6.009 12.064 -6.145 1.00 0.00 H new ATOM 512 N VAL A 38 7.554 14.048 -4.626 1.00 0.00 N ATOM 513 CA VAL A 38 7.904 14.445 -3.268 1.00 0.00 C ATOM 514 C VAL A 38 8.706 15.742 -3.263 1.00 0.00 C ATOM 515 O VAL A 38 8.271 16.750 -2.709 1.00 0.00 O ATOM 516 CB VAL A 38 8.719 13.348 -2.556 1.00 0.00 C ATOM 517 CG1 VAL A 38 9.139 13.811 -1.169 1.00 0.00 C ATOM 518 CG2 VAL A 38 7.918 12.058 -2.476 1.00 0.00 C ATOM 0 H VAL A 38 8.134 13.302 -5.010 1.00 0.00 H new ATOM 0 HA VAL A 38 6.968 14.599 -2.732 1.00 0.00 H new ATOM 0 HB VAL A 38 9.621 13.154 -3.137 1.00 0.00 H new ATOM 0 HG11 VAL A 38 9.713 13.024 -0.681 1.00 0.00 H new ATOM 0 HG12 VAL A 38 9.753 14.708 -1.255 1.00 0.00 H new ATOM 0 HG13 VAL A 38 8.252 14.034 -0.576 1.00 0.00 H new ATOM 0 HG21 VAL A 38 8.508 11.294 -1.970 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.999 12.235 -1.918 1.00 0.00 H new ATOM 0 HG23 VAL A 38 7.672 11.719 -3.482 1.00 0.00 H new ATOM 528 N ALA A 39 9.880 15.707 -3.885 1.00 0.00 N ATOM 529 CA ALA A 39 10.742 16.881 -3.955 1.00 0.00 C ATOM 530 C ALA A 39 9.926 18.147 -4.194 1.00 0.00 C ATOM 531 O ALA A 39 10.182 19.185 -3.584 1.00 0.00 O ATOM 532 CB ALA A 39 11.782 16.707 -5.051 1.00 0.00 C ATOM 0 H ALA A 39 10.256 14.879 -4.347 1.00 0.00 H new ATOM 0 HA ALA A 39 11.253 16.984 -2.998 1.00 0.00 H new ATOM 0 HB1 ALA A 39 12.419 17.591 -5.092 1.00 0.00 H new ATOM 0 HB2 ALA A 39 12.392 15.830 -4.837 1.00 0.00 H new ATOM 0 HB3 ALA A 39 11.281 16.576 -6.010 1.00 0.00 H new ATOM 538 N GLU A 40 8.945 18.055 -5.086 1.00 0.00 N ATOM 539 CA GLU A 40 8.094 19.195 -5.405 1.00 0.00 C ATOM 540 C GLU A 40 7.073 19.439 -4.297 1.00 0.00 C ATOM 541 O GLU A 40 6.751 20.584 -3.976 1.00 0.00 O ATOM 542 CB GLU A 40 7.373 18.965 -6.735 1.00 0.00 C ATOM 543 CG GLU A 40 8.245 19.223 -7.952 1.00 0.00 C ATOM 544 CD GLU A 40 8.424 20.702 -8.238 1.00 0.00 C ATOM 545 OE1 GLU A 40 7.428 21.359 -8.607 1.00 0.00 O ATOM 546 OE2 GLU A 40 9.559 21.201 -8.094 1.00 0.00 O ATOM 0 H GLU A 40 8.720 17.203 -5.600 1.00 0.00 H new ATOM 0 HA GLU A 40 8.729 20.077 -5.491 1.00 0.00 H new ATOM 0 HB2 GLU A 40 7.011 17.938 -6.769 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.498 19.613 -6.781 1.00 0.00 H new ATOM 0 HG2 GLU A 40 9.222 18.766 -7.798 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.801 18.740 -8.822 1.00 0.00 H new ATOM 553 N LEU A 41 6.568 18.357 -3.717 1.00 0.00 N ATOM 554 CA LEU A 41 5.584 18.452 -2.644 1.00 0.00 C ATOM 555 C LEU A 41 6.133 19.257 -1.471 1.00 0.00 C ATOM 556 O LEU A 41 5.417 20.049 -0.858 1.00 0.00 O ATOM 557 CB LEU A 41 5.177 17.054 -2.173 1.00 0.00 C ATOM 558 CG LEU A 41 4.218 17.000 -0.984 1.00 0.00 C ATOM 559 CD1 LEU A 41 2.934 17.752 -1.298 1.00 0.00 C ATOM 560 CD2 LEU A 41 3.915 15.557 -0.608 1.00 0.00 C ATOM 0 H LEU A 41 6.823 17.403 -3.971 1.00 0.00 H new ATOM 0 HA LEU A 41 4.706 18.967 -3.034 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.716 16.530 -3.010 1.00 0.00 H new ATOM 0 HB3 LEU A 41 6.080 16.503 -1.911 1.00 0.00 H new ATOM 0 HG LEU A 41 4.698 17.483 -0.133 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.264 17.702 -0.440 1.00 0.00 H new ATOM 0 HD12 LEU A 41 3.167 18.794 -1.517 1.00 0.00 H new ATOM 0 HD13 LEU A 41 2.449 17.299 -2.163 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.231 15.538 0.240 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.456 15.049 -1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 41 4.841 15.049 -0.339 1.00 0.00 H new ATOM 572 N LYS A 42 7.409 19.051 -1.164 1.00 0.00 N ATOM 573 CA LYS A 42 8.057 19.759 -0.067 1.00 0.00 C ATOM 574 C LYS A 42 8.036 21.266 -0.304 1.00 0.00 C ATOM 575 O LYS A 42 7.598 22.033 0.553 1.00 0.00 O ATOM 576 CB LYS A 42 9.500 19.278 0.097 1.00 0.00 C ATOM 577 CG LYS A 42 9.623 17.976 0.869 1.00 0.00 C ATOM 578 CD LYS A 42 10.841 17.180 0.429 1.00 0.00 C ATOM 579 CE LYS A 42 11.379 16.315 1.559 1.00 0.00 C ATOM 580 NZ LYS A 42 12.291 17.078 2.455 1.00 0.00 N ATOM 0 H LYS A 42 8.016 18.398 -1.660 1.00 0.00 H new ATOM 0 HA LYS A 42 7.503 19.545 0.847 1.00 0.00 H new ATOM 0 HB2 LYS A 42 9.946 19.149 -0.889 1.00 0.00 H new ATOM 0 HB3 LYS A 42 10.075 20.050 0.608 1.00 0.00 H new ATOM 0 HG2 LYS A 42 9.693 18.189 1.936 1.00 0.00 H new ATOM 0 HG3 LYS A 42 8.724 17.378 0.722 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.578 16.549 -0.420 1.00 0.00 H new ATOM 0 HD3 LYS A 42 11.620 17.863 0.089 1.00 0.00 H new ATOM 0 HE2 LYS A 42 10.547 15.918 2.140 1.00 0.00 H new ATOM 0 HE3 LYS A 42 11.912 15.461 1.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 12.636 16.454 3.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 13.098 17.435 1.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 11.776 17.878 2.874 1.00 0.00 H new ATOM 594 N ASP A 43 8.510 21.682 -1.473 1.00 0.00 N ATOM 595 CA ASP A 43 8.544 23.097 -1.824 1.00 0.00 C ATOM 596 C ASP A 43 7.191 23.754 -1.565 1.00 0.00 C ATOM 597 O ASP A 43 7.112 24.802 -0.924 1.00 0.00 O ATOM 598 CB ASP A 43 8.936 23.271 -3.293 1.00 0.00 C ATOM 599 CG ASP A 43 9.358 24.691 -3.615 1.00 0.00 C ATOM 600 OD1 ASP A 43 8.529 25.610 -3.447 1.00 0.00 O ATOM 601 OD2 ASP A 43 10.518 24.884 -4.034 1.00 0.00 O ATOM 0 H ASP A 43 8.876 21.060 -2.194 1.00 0.00 H new ATOM 0 HA ASP A 43 9.291 23.584 -1.196 1.00 0.00 H new ATOM 0 HB2 ASP A 43 9.753 22.589 -3.531 1.00 0.00 H new ATOM 0 HB3 ASP A 43 8.094 22.993 -3.926 1.00 0.00 H new ATOM 606 N CYS A 44 6.131 23.131 -2.068 1.00 0.00 N ATOM 607 CA CYS A 44 4.782 23.655 -1.893 1.00 0.00 C ATOM 608 C CYS A 44 4.573 24.155 -0.467 1.00 0.00 C ATOM 609 O CYS A 44 4.320 25.340 -0.245 1.00 0.00 O ATOM 610 CB CYS A 44 3.747 22.580 -2.225 1.00 0.00 C ATOM 611 SG CYS A 44 2.109 22.888 -1.522 1.00 0.00 S ATOM 0 H CYS A 44 6.180 22.262 -2.600 1.00 0.00 H new ATOM 0 HA CYS A 44 4.655 24.495 -2.576 1.00 0.00 H new ATOM 0 HB2 CYS A 44 3.656 22.501 -3.308 1.00 0.00 H new ATOM 0 HB3 CYS A 44 4.110 21.618 -1.864 1.00 0.00 H new ATOM 0 HG CYS A 44 1.304 21.925 -1.860 1.00 0.00 H new ATOM 617 N ILE A 45 4.680 23.245 0.495 1.00 0.00 N ATOM 618 CA ILE A 45 4.503 23.593 1.899 1.00 0.00 C ATOM 619 C ILE A 45 5.427 24.737 2.302 1.00 0.00 C ATOM 620 O ILE A 45 5.014 25.666 2.995 1.00 0.00 O ATOM 621 CB ILE A 45 4.770 22.385 2.817 1.00 0.00 C ATOM 622 CG1 ILE A 45 3.854 21.219 2.440 1.00 0.00 C ATOM 623 CG2 ILE A 45 4.570 22.773 4.274 1.00 0.00 C ATOM 624 CD1 ILE A 45 4.453 19.861 2.734 1.00 0.00 C ATOM 0 H ILE A 45 4.889 22.261 0.328 1.00 0.00 H new ATOM 0 HA ILE A 45 3.466 23.907 2.018 1.00 0.00 H new ATOM 0 HB ILE A 45 5.804 22.068 2.685 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.913 21.317 2.981 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.619 21.281 1.378 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.762 21.909 4.910 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.259 23.576 4.535 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.545 23.112 4.423 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.749 19.082 2.442 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.379 19.743 2.172 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.663 19.779 3.800 1.00 0.00 H new ATOM 636 N GLU A 46 6.679 24.663 1.861 1.00 0.00 N ATOM 637 CA GLU A 46 7.661 25.694 2.176 1.00 0.00 C ATOM 638 C GLU A 46 7.223 27.049 1.627 1.00 0.00 C ATOM 639 O GLU A 46 7.469 28.089 2.239 1.00 0.00 O ATOM 640 CB GLU A 46 9.029 25.319 1.603 1.00 0.00 C ATOM 641 CG GLU A 46 9.736 24.223 2.383 1.00 0.00 C ATOM 642 CD GLU A 46 11.079 23.853 1.783 1.00 0.00 C ATOM 643 OE1 GLU A 46 11.970 24.726 1.739 1.00 0.00 O ATOM 644 OE2 GLU A 46 11.237 22.689 1.359 1.00 0.00 O ATOM 0 H GLU A 46 7.037 23.901 1.285 1.00 0.00 H new ATOM 0 HA GLU A 46 7.737 25.767 3.261 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.904 24.995 0.570 1.00 0.00 H new ATOM 0 HB3 GLU A 46 9.662 26.206 1.585 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.880 24.550 3.413 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.101 23.338 2.416 1.00 0.00 H new ATOM 783 N SER A 55 2.745 15.485 -10.793 1.00 0.00 N ATOM 784 CA SER A 55 2.762 14.030 -10.884 1.00 0.00 C ATOM 785 C SER A 55 2.235 13.399 -9.599 1.00 0.00 C ATOM 786 O SER A 55 2.391 13.953 -8.510 1.00 0.00 O ATOM 787 CB SER A 55 4.181 13.532 -11.165 1.00 0.00 C ATOM 788 OG SER A 55 4.442 13.493 -12.557 1.00 0.00 O ATOM 0 HA SER A 55 2.111 13.735 -11.707 1.00 0.00 H new ATOM 0 HB2 SER A 55 4.903 14.185 -10.675 1.00 0.00 H new ATOM 0 HB3 SER A 55 4.311 12.537 -10.739 1.00 0.00 H new ATOM 0 HG SER A 55 5.356 13.173 -12.710 1.00 0.00 H new ATOM 794 N LYS A 56 1.608 12.235 -9.732 1.00 0.00 N ATOM 795 CA LYS A 56 1.057 11.525 -8.584 1.00 0.00 C ATOM 796 C LYS A 56 2.151 10.771 -7.835 1.00 0.00 C ATOM 797 O LYS A 56 3.163 10.383 -8.419 1.00 0.00 O ATOM 798 CB LYS A 56 -0.032 10.550 -9.035 1.00 0.00 C ATOM 799 CG LYS A 56 -1.408 11.184 -9.144 1.00 0.00 C ATOM 800 CD LYS A 56 -2.418 10.224 -9.749 1.00 0.00 C ATOM 801 CE LYS A 56 -3.538 10.967 -10.461 1.00 0.00 C ATOM 802 NZ LYS A 56 -3.114 11.457 -11.802 1.00 0.00 N ATOM 0 H LYS A 56 1.469 11.763 -10.625 1.00 0.00 H new ATOM 0 HA LYS A 56 0.620 12.261 -7.909 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.244 10.132 -10.003 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -0.079 9.719 -8.331 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.746 11.494 -8.155 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -1.348 12.084 -9.757 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -1.915 9.561 -10.453 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.839 9.595 -8.964 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -4.399 10.307 -10.571 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -3.859 11.811 -9.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.758 12.211 -12.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.145 11.831 -11.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.142 10.672 -12.483 1.00 0.00 H new ATOM 816 N VAL A 57 1.940 10.564 -6.539 1.00 0.00 N ATOM 817 CA VAL A 57 2.907 9.853 -5.711 1.00 0.00 C ATOM 818 C VAL A 57 2.850 8.351 -5.965 1.00 0.00 C ATOM 819 O VAL A 57 1.999 7.650 -5.416 1.00 0.00 O ATOM 820 CB VAL A 57 2.666 10.119 -4.213 1.00 0.00 C ATOM 821 CG1 VAL A 57 3.705 9.397 -3.368 1.00 0.00 C ATOM 822 CG2 VAL A 57 2.679 11.613 -3.928 1.00 0.00 C ATOM 0 H VAL A 57 1.108 10.879 -6.040 1.00 0.00 H new ATOM 0 HA VAL A 57 3.893 10.227 -5.985 1.00 0.00 H new ATOM 0 HB VAL A 57 1.683 9.731 -3.947 1.00 0.00 H new ATOM 0 HG11 VAL A 57 3.519 9.597 -2.313 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.641 8.324 -3.551 1.00 0.00 H new ATOM 0 HG13 VAL A 57 4.701 9.752 -3.634 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.507 11.782 -2.865 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.646 12.029 -4.210 1.00 0.00 H new ATOM 0 HG23 VAL A 57 1.893 12.100 -4.505 1.00 0.00 H new ATOM 832 N TYR A 58 3.760 7.863 -6.800 1.00 0.00 N ATOM 833 CA TYR A 58 3.812 6.444 -7.129 1.00 0.00 C ATOM 834 C TYR A 58 4.863 5.727 -6.286 1.00 0.00 C ATOM 835 O TYR A 58 6.045 6.069 -6.324 1.00 0.00 O ATOM 836 CB TYR A 58 4.120 6.255 -8.616 1.00 0.00 C ATOM 837 CG TYR A 58 4.083 4.811 -9.063 1.00 0.00 C ATOM 838 CD1 TYR A 58 3.085 3.951 -8.620 1.00 0.00 C ATOM 839 CD2 TYR A 58 5.045 4.306 -9.929 1.00 0.00 C ATOM 840 CE1 TYR A 58 3.048 2.631 -9.026 1.00 0.00 C ATOM 841 CE2 TYR A 58 5.015 2.988 -10.341 1.00 0.00 C ATOM 842 CZ TYR A 58 4.015 2.154 -9.886 1.00 0.00 C ATOM 843 OH TYR A 58 3.981 0.840 -10.293 1.00 0.00 O ATOM 0 H TYR A 58 4.472 8.429 -7.261 1.00 0.00 H new ATOM 0 HA TYR A 58 2.837 6.010 -6.908 1.00 0.00 H new ATOM 0 HB2 TYR A 58 3.401 6.827 -9.203 1.00 0.00 H new ATOM 0 HB3 TYR A 58 5.106 6.668 -8.830 1.00 0.00 H new ATOM 0 HD1 TYR A 58 2.326 4.321 -7.947 1.00 0.00 H new ATOM 0 HD2 TYR A 58 5.830 4.956 -10.286 1.00 0.00 H new ATOM 0 HE1 TYR A 58 2.266 1.976 -8.672 1.00 0.00 H new ATOM 0 HE2 TYR A 58 5.770 2.613 -11.016 1.00 0.00 H new ATOM 0 HH TYR A 58 4.732 0.665 -10.898 1.00 0.00 H new ATOM 853 N PHE A 59 4.422 4.731 -5.526 1.00 0.00 N ATOM 854 CA PHE A 59 5.322 3.965 -4.672 1.00 0.00 C ATOM 855 C PHE A 59 4.773 2.563 -4.421 1.00 0.00 C ATOM 856 O PHE A 59 3.682 2.400 -3.874 1.00 0.00 O ATOM 857 CB PHE A 59 5.535 4.687 -3.340 1.00 0.00 C ATOM 858 CG PHE A 59 4.323 4.679 -2.453 1.00 0.00 C ATOM 859 CD1 PHE A 59 3.264 5.539 -2.696 1.00 0.00 C ATOM 860 CD2 PHE A 59 4.242 3.810 -1.377 1.00 0.00 C ATOM 861 CE1 PHE A 59 2.148 5.533 -1.881 1.00 0.00 C ATOM 862 CE2 PHE A 59 3.128 3.799 -0.559 1.00 0.00 C ATOM 863 CZ PHE A 59 2.079 4.662 -0.812 1.00 0.00 C ATOM 0 H PHE A 59 3.447 4.435 -5.484 1.00 0.00 H new ATOM 0 HA PHE A 59 6.279 3.875 -5.185 1.00 0.00 H new ATOM 0 HB2 PHE A 59 6.365 4.219 -2.811 1.00 0.00 H new ATOM 0 HB3 PHE A 59 5.824 5.719 -3.538 1.00 0.00 H new ATOM 0 HD1 PHE A 59 3.311 6.222 -3.532 1.00 0.00 H new ATOM 0 HD2 PHE A 59 5.059 3.133 -1.175 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.330 6.209 -2.080 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.078 3.117 0.277 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.207 4.655 -0.175 1.00 0.00 H new ATOM 873 N THR A 60 5.537 1.553 -4.825 1.00 0.00 N ATOM 874 CA THR A 60 5.128 0.166 -4.647 1.00 0.00 C ATOM 875 C THR A 60 5.796 -0.451 -3.424 1.00 0.00 C ATOM 876 O THR A 60 7.009 -0.338 -3.244 1.00 0.00 O ATOM 877 CB THR A 60 5.466 -0.684 -5.886 1.00 0.00 C ATOM 878 OG1 THR A 60 4.951 -0.056 -7.066 1.00 0.00 O ATOM 879 CG2 THR A 60 4.887 -2.084 -5.757 1.00 0.00 C ATOM 0 H THR A 60 6.443 1.670 -5.278 1.00 0.00 H new ATOM 0 HA THR A 60 4.047 0.172 -4.504 1.00 0.00 H new ATOM 0 HB THR A 60 6.551 -0.763 -5.960 1.00 0.00 H new ATOM 0 HG1 THR A 60 5.171 -0.602 -7.850 1.00 0.00 H new ATOM 0 HG21 THR A 60 5.139 -2.665 -6.644 1.00 0.00 H new ATOM 0 HG22 THR A 60 5.303 -2.570 -4.875 1.00 0.00 H new ATOM 0 HG23 THR A 60 3.803 -2.022 -5.660 1.00 0.00 H new ATOM 887 N ILE A 61 4.997 -1.104 -2.586 1.00 0.00 N ATOM 888 CA ILE A 61 5.513 -1.741 -1.380 1.00 0.00 C ATOM 889 C ILE A 61 5.615 -3.252 -1.557 1.00 0.00 C ATOM 890 O ILE A 61 4.658 -3.904 -1.972 1.00 0.00 O ATOM 891 CB ILE A 61 4.625 -1.437 -0.159 1.00 0.00 C ATOM 892 CG1 ILE A 61 4.644 0.061 0.152 1.00 0.00 C ATOM 893 CG2 ILE A 61 5.090 -2.240 1.047 1.00 0.00 C ATOM 894 CD1 ILE A 61 3.670 0.465 1.237 1.00 0.00 C ATOM 0 H ILE A 61 3.991 -1.206 -2.720 1.00 0.00 H new ATOM 0 HA ILE A 61 6.508 -1.330 -1.207 1.00 0.00 H new ATOM 0 HB ILE A 61 3.601 -1.728 -0.391 1.00 0.00 H new ATOM 0 HG12 ILE A 61 5.651 0.349 0.454 1.00 0.00 H new ATOM 0 HG13 ILE A 61 4.413 0.616 -0.757 1.00 0.00 H new ATOM 0 HG21 ILE A 61 4.453 -2.014 1.902 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.030 -3.305 0.820 1.00 0.00 H new ATOM 0 HG23 ILE A 61 6.121 -1.977 1.284 1.00 0.00 H new ATOM 0 HD11 ILE A 61 3.738 1.540 1.405 1.00 0.00 H new ATOM 0 HD12 ILE A 61 2.656 0.209 0.930 1.00 0.00 H new ATOM 0 HD13 ILE A 61 3.914 -0.062 2.159 1.00 0.00 H new ATOM 906 N ASN A 62 6.782 -3.803 -1.238 1.00 0.00 N ATOM 907 CA ASN A 62 7.009 -5.238 -1.361 1.00 0.00 C ATOM 908 C ASN A 62 6.928 -5.920 0.002 1.00 0.00 C ATOM 909 O ASN A 62 7.735 -5.650 0.891 1.00 0.00 O ATOM 910 CB ASN A 62 8.373 -5.507 -1.998 1.00 0.00 C ATOM 911 CG ASN A 62 8.410 -5.129 -3.466 1.00 0.00 C ATOM 912 OD1 ASN A 62 7.602 -5.607 -4.262 1.00 0.00 O ATOM 913 ND2 ASN A 62 9.352 -4.267 -3.831 1.00 0.00 N ATOM 0 H ASN A 62 7.585 -3.277 -0.892 1.00 0.00 H new ATOM 0 HA ASN A 62 6.229 -5.651 -2.001 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.138 -4.946 -1.462 1.00 0.00 H new ATOM 0 HB3 ASN A 62 8.619 -6.564 -1.891 1.00 0.00 H new ATOM 0 HD21 ASN A 62 9.427 -3.976 -4.806 1.00 0.00 H new ATOM 0 HD22 ASN A 62 10.001 -3.896 -3.137 1.00 0.00 H new ATOM 920 N MET A 63 5.949 -6.805 0.157 1.00 0.00 N ATOM 921 CA MET A 63 5.764 -7.527 1.411 1.00 0.00 C ATOM 922 C MET A 63 5.906 -9.031 1.198 1.00 0.00 C ATOM 923 O MET A 63 5.164 -9.630 0.421 1.00 0.00 O ATOM 924 CB MET A 63 4.391 -7.212 2.008 1.00 0.00 C ATOM 925 CG MET A 63 4.247 -5.772 2.475 1.00 0.00 C ATOM 926 SD MET A 63 2.531 -5.221 2.508 1.00 0.00 S ATOM 927 CE MET A 63 1.820 -6.398 3.656 1.00 0.00 C ATOM 0 H MET A 63 5.272 -7.040 -0.569 1.00 0.00 H new ATOM 0 HA MET A 63 6.538 -7.202 2.106 1.00 0.00 H new ATOM 0 HB2 MET A 63 3.623 -7.422 1.263 1.00 0.00 H new ATOM 0 HB3 MET A 63 4.209 -7.879 2.851 1.00 0.00 H new ATOM 0 HG2 MET A 63 4.676 -5.673 3.472 1.00 0.00 H new ATOM 0 HG3 MET A 63 4.821 -5.121 1.815 1.00 0.00 H new ATOM 0 HE1 MET A 63 0.957 -5.950 4.148 1.00 0.00 H new ATOM 0 HE2 MET A 63 1.506 -7.290 3.114 1.00 0.00 H new ATOM 0 HE3 MET A 63 2.564 -6.671 4.405 1.00 0.00 H new ATOM 937 N ASN A 64 6.864 -9.635 1.894 1.00 0.00 N ATOM 938 CA ASN A 64 7.103 -11.069 1.779 1.00 0.00 C ATOM 939 C ASN A 64 6.293 -11.840 2.817 1.00 0.00 C ATOM 940 O ASN A 64 6.423 -11.607 4.020 1.00 0.00 O ATOM 941 CB ASN A 64 8.593 -11.373 1.950 1.00 0.00 C ATOM 942 CG ASN A 64 9.247 -10.493 2.997 1.00 0.00 C ATOM 943 OD1 ASN A 64 9.303 -9.272 2.851 1.00 0.00 O ATOM 944 ND2 ASN A 64 9.747 -11.111 4.061 1.00 0.00 N ATOM 0 H ASN A 64 7.487 -9.154 2.543 1.00 0.00 H new ATOM 0 HA ASN A 64 6.785 -11.387 0.786 1.00 0.00 H new ATOM 0 HB2 ASN A 64 8.718 -12.419 2.230 1.00 0.00 H new ATOM 0 HB3 ASN A 64 9.101 -11.236 0.995 1.00 0.00 H new ATOM 0 HD21 ASN A 64 10.200 -10.571 4.798 1.00 0.00 H new ATOM 0 HD22 ASN A 64 9.678 -12.126 4.141 1.00 0.00 H new ATOM 951 N LEU A 65 5.459 -12.759 2.345 1.00 0.00 N ATOM 952 CA LEU A 65 4.628 -13.565 3.232 1.00 0.00 C ATOM 953 C LEU A 65 4.427 -14.967 2.664 1.00 0.00 C ATOM 954 O LEU A 65 4.641 -15.203 1.475 1.00 0.00 O ATOM 955 CB LEU A 65 3.272 -12.891 3.446 1.00 0.00 C ATOM 956 CG LEU A 65 3.262 -11.364 3.368 1.00 0.00 C ATOM 957 CD1 LEU A 65 1.932 -10.865 2.824 1.00 0.00 C ATOM 958 CD2 LEU A 65 3.542 -10.758 4.735 1.00 0.00 C ATOM 0 H LEU A 65 5.340 -12.965 1.353 1.00 0.00 H new ATOM 0 HA LEU A 65 5.140 -13.650 4.191 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.575 -13.277 2.702 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.892 -13.187 4.423 1.00 0.00 H new ATOM 0 HG LEU A 65 4.051 -11.050 2.685 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.944 -9.776 2.776 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.772 -11.271 1.825 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.125 -11.190 3.481 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.531 -9.671 4.660 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.776 -11.081 5.440 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.520 -11.088 5.086 1.00 0.00 H new ATOM 970 N ASP A 66 4.012 -15.893 3.522 1.00 0.00 N ATOM 971 CA ASP A 66 3.779 -17.271 3.105 1.00 0.00 C ATOM 972 C ASP A 66 2.349 -17.454 2.607 1.00 0.00 C ATOM 973 O ASP A 66 1.408 -16.891 3.168 1.00 0.00 O ATOM 974 CB ASP A 66 4.055 -18.230 4.265 1.00 0.00 C ATOM 975 CG ASP A 66 3.062 -18.068 5.399 1.00 0.00 C ATOM 976 OD1 ASP A 66 2.711 -16.914 5.720 1.00 0.00 O ATOM 977 OD2 ASP A 66 2.635 -19.096 5.964 1.00 0.00 O ATOM 0 H ASP A 66 3.830 -15.714 4.510 1.00 0.00 H new ATOM 0 HA ASP A 66 4.461 -17.497 2.286 1.00 0.00 H new ATOM 0 HB2 ASP A 66 4.021 -19.256 3.900 1.00 0.00 H new ATOM 0 HB3 ASP A 66 5.063 -18.059 4.642 1.00 0.00 H new ATOM 982 N VAL A 67 2.192 -18.243 1.549 1.00 0.00 N ATOM 983 CA VAL A 67 0.877 -18.500 0.975 1.00 0.00 C ATOM 984 C VAL A 67 0.477 -19.961 1.149 1.00 0.00 C ATOM 985 O VAL A 67 -0.646 -20.264 1.552 1.00 0.00 O ATOM 986 CB VAL A 67 0.839 -18.143 -0.523 1.00 0.00 C ATOM 987 CG1 VAL A 67 0.770 -16.636 -0.711 1.00 0.00 C ATOM 988 CG2 VAL A 67 2.049 -18.724 -1.239 1.00 0.00 C ATOM 0 H VAL A 67 2.960 -18.715 1.072 1.00 0.00 H new ATOM 0 HA VAL A 67 0.169 -17.867 1.510 1.00 0.00 H new ATOM 0 HB VAL A 67 -0.058 -18.580 -0.961 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.744 -16.403 -1.775 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.131 -16.251 -0.233 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.647 -16.172 -0.260 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.006 -18.462 -2.296 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.961 -18.318 -0.801 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.048 -19.809 -1.133 1.00 0.00 H new ATOM 998 N SER A 68 1.404 -20.863 0.843 1.00 0.00 N ATOM 999 CA SER A 68 1.147 -22.293 0.962 1.00 0.00 C ATOM 1000 C SER A 68 2.427 -23.095 0.742 1.00 0.00 C ATOM 1001 O SER A 68 3.493 -22.529 0.501 1.00 0.00 O ATOM 1002 CB SER A 68 0.080 -22.727 -0.045 1.00 0.00 C ATOM 1003 OG SER A 68 -0.555 -23.924 0.369 1.00 0.00 O ATOM 0 H SER A 68 2.340 -20.629 0.511 1.00 0.00 H new ATOM 0 HA SER A 68 0.785 -22.489 1.971 1.00 0.00 H new ATOM 0 HB2 SER A 68 -0.663 -21.937 -0.156 1.00 0.00 H new ATOM 0 HB3 SER A 68 0.537 -22.874 -1.024 1.00 0.00 H new ATOM 0 HG SER A 68 -1.234 -24.179 -0.290 1.00 0.00 H new ATOM 1009 N ASP A 69 2.311 -24.415 0.826 1.00 0.00 N ATOM 1010 CA ASP A 69 3.458 -25.297 0.635 1.00 0.00 C ATOM 1011 C ASP A 69 4.683 -24.760 1.368 1.00 0.00 C ATOM 1012 O ASP A 69 5.762 -24.641 0.788 1.00 0.00 O ATOM 1013 CB ASP A 69 3.767 -25.451 -0.855 1.00 0.00 C ATOM 1014 CG ASP A 69 2.741 -26.307 -1.572 1.00 0.00 C ATOM 1015 OD1 ASP A 69 2.198 -27.238 -0.941 1.00 0.00 O ATOM 1016 OD2 ASP A 69 2.482 -26.046 -2.766 1.00 0.00 O ATOM 0 H ASP A 69 1.435 -24.899 1.025 1.00 0.00 H new ATOM 0 HA ASP A 69 3.208 -26.274 1.049 1.00 0.00 H new ATOM 0 HB2 ASP A 69 3.803 -24.466 -1.320 1.00 0.00 H new ATOM 0 HB3 ASP A 69 4.755 -25.896 -0.974 1.00 0.00 H new ATOM 1021 N GLU A 70 4.508 -24.438 2.646 1.00 0.00 N ATOM 1022 CA GLU A 70 5.600 -23.912 3.457 1.00 0.00 C ATOM 1023 C GLU A 70 6.530 -23.040 2.618 1.00 0.00 C ATOM 1024 O GLU A 70 7.737 -22.992 2.855 1.00 0.00 O ATOM 1025 CB GLU A 70 6.392 -25.058 4.091 1.00 0.00 C ATOM 1026 CG GLU A 70 7.273 -25.807 3.105 1.00 0.00 C ATOM 1027 CD GLU A 70 7.826 -27.097 3.680 1.00 0.00 C ATOM 1028 OE1 GLU A 70 8.615 -27.026 4.645 1.00 0.00 O ATOM 1029 OE2 GLU A 70 7.469 -28.177 3.164 1.00 0.00 O ATOM 0 H GLU A 70 3.621 -24.532 3.142 1.00 0.00 H new ATOM 0 HA GLU A 70 5.168 -23.297 4.247 1.00 0.00 H new ATOM 0 HB2 GLU A 70 7.015 -24.659 4.891 1.00 0.00 H new ATOM 0 HB3 GLU A 70 5.695 -25.760 4.549 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.698 -26.031 2.207 1.00 0.00 H new ATOM 0 HG3 GLU A 70 8.100 -25.165 2.802 1.00 0.00 H new ATOM 1036 N LYS A 71 5.959 -22.352 1.636 1.00 0.00 N ATOM 1037 CA LYS A 71 6.734 -21.480 0.761 1.00 0.00 C ATOM 1038 C LYS A 71 6.423 -20.013 1.040 1.00 0.00 C ATOM 1039 O LYS A 71 5.440 -19.694 1.707 1.00 0.00 O ATOM 1040 CB LYS A 71 6.441 -21.805 -0.706 1.00 0.00 C ATOM 1041 CG LYS A 71 7.363 -22.860 -1.292 1.00 0.00 C ATOM 1042 CD LYS A 71 7.552 -22.667 -2.787 1.00 0.00 C ATOM 1043 CE LYS A 71 6.242 -22.835 -3.541 1.00 0.00 C ATOM 1044 NZ LYS A 71 6.448 -22.854 -5.015 1.00 0.00 N ATOM 0 H LYS A 71 4.961 -22.381 1.426 1.00 0.00 H new ATOM 0 HA LYS A 71 7.791 -21.653 0.961 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.410 -22.146 -0.795 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.526 -20.892 -1.296 1.00 0.00 H new ATOM 0 HG2 LYS A 71 8.331 -22.816 -0.793 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.951 -23.851 -1.101 1.00 0.00 H new ATOM 0 HD2 LYS A 71 7.958 -21.674 -2.978 1.00 0.00 H new ATOM 0 HD3 LYS A 71 8.282 -23.387 -3.158 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.760 -23.762 -3.230 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.566 -22.021 -3.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.531 -22.970 -5.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.884 -21.959 -5.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.073 -23.646 -5.268 1.00 0.00 H new ATOM 1058 N MET A 72 7.267 -19.126 0.524 1.00 0.00 N ATOM 1059 CA MET A 72 7.079 -17.692 0.716 1.00 0.00 C ATOM 1060 C MET A 72 7.111 -16.956 -0.620 1.00 0.00 C ATOM 1061 O MET A 72 7.707 -17.430 -1.587 1.00 0.00 O ATOM 1062 CB MET A 72 8.160 -17.135 1.644 1.00 0.00 C ATOM 1063 CG MET A 72 7.755 -17.120 3.109 1.00 0.00 C ATOM 1064 SD MET A 72 8.923 -16.217 4.144 1.00 0.00 S ATOM 1065 CE MET A 72 8.444 -14.526 3.799 1.00 0.00 C ATOM 0 H MET A 72 8.087 -19.374 -0.030 1.00 0.00 H new ATOM 0 HA MET A 72 6.102 -17.536 1.173 1.00 0.00 H new ATOM 0 HB2 MET A 72 9.066 -17.731 1.532 1.00 0.00 H new ATOM 0 HB3 MET A 72 8.406 -16.120 1.333 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.767 -16.669 3.204 1.00 0.00 H new ATOM 0 HG3 MET A 72 7.673 -18.145 3.470 1.00 0.00 H new ATOM 0 HE1 MET A 72 9.296 -13.983 3.389 1.00 0.00 H new ATOM 0 HE2 MET A 72 7.628 -14.519 3.077 1.00 0.00 H new ATOM 0 HE3 MET A 72 8.117 -14.045 4.721 1.00 0.00 H new ATOM 1075 N ALA A 73 6.464 -15.796 -0.666 1.00 0.00 N ATOM 1076 CA ALA A 73 6.420 -14.994 -1.883 1.00 0.00 C ATOM 1077 C ALA A 73 6.353 -13.506 -1.557 1.00 0.00 C ATOM 1078 O ALA A 73 6.156 -13.121 -0.405 1.00 0.00 O ATOM 1079 CB ALA A 73 5.231 -15.402 -2.741 1.00 0.00 C ATOM 0 H ALA A 73 5.963 -15.391 0.125 1.00 0.00 H new ATOM 0 HA ALA A 73 7.338 -15.176 -2.442 1.00 0.00 H new ATOM 0 HB1 ALA A 73 5.210 -14.795 -3.646 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.321 -16.454 -3.011 1.00 0.00 H new ATOM 0 HB3 ALA A 73 4.309 -15.249 -2.181 1.00 0.00 H new ATOM 1085 N MET A 74 6.520 -12.673 -2.580 1.00 0.00 N ATOM 1086 CA MET A 74 6.478 -11.226 -2.401 1.00 0.00 C ATOM 1087 C MET A 74 5.228 -10.635 -3.046 1.00 0.00 C ATOM 1088 O MET A 74 4.797 -11.080 -4.110 1.00 0.00 O ATOM 1089 CB MET A 74 7.729 -10.581 -3.000 1.00 0.00 C ATOM 1090 CG MET A 74 8.040 -9.209 -2.424 1.00 0.00 C ATOM 1091 SD MET A 74 8.213 -9.233 -0.629 1.00 0.00 S ATOM 1092 CE MET A 74 9.881 -8.608 -0.441 1.00 0.00 C ATOM 0 H MET A 74 6.685 -12.975 -3.540 1.00 0.00 H new ATOM 0 HA MET A 74 6.447 -11.017 -1.332 1.00 0.00 H new ATOM 0 HB2 MET A 74 8.582 -11.238 -2.833 1.00 0.00 H new ATOM 0 HB3 MET A 74 7.601 -10.493 -4.079 1.00 0.00 H new ATOM 0 HG2 MET A 74 8.961 -8.833 -2.869 1.00 0.00 H new ATOM 0 HG3 MET A 74 7.246 -8.515 -2.699 1.00 0.00 H new ATOM 0 HE1 MET A 74 10.366 -9.112 0.395 1.00 0.00 H new ATOM 0 HE2 MET A 74 10.445 -8.795 -1.355 1.00 0.00 H new ATOM 0 HE3 MET A 74 9.848 -7.536 -0.248 1.00 0.00 H new ATOM 1102 N PHE A 75 4.651 -9.631 -2.395 1.00 0.00 N ATOM 1103 CA PHE A 75 3.450 -8.979 -2.904 1.00 0.00 C ATOM 1104 C PHE A 75 3.733 -7.525 -3.270 1.00 0.00 C ATOM 1105 O PHE A 75 4.326 -6.782 -2.488 1.00 0.00 O ATOM 1106 CB PHE A 75 2.328 -9.047 -1.866 1.00 0.00 C ATOM 1107 CG PHE A 75 1.565 -10.340 -1.891 1.00 0.00 C ATOM 1108 CD1 PHE A 75 2.219 -11.549 -1.717 1.00 0.00 C ATOM 1109 CD2 PHE A 75 0.193 -10.346 -2.089 1.00 0.00 C ATOM 1110 CE1 PHE A 75 1.519 -12.741 -1.739 1.00 0.00 C ATOM 1111 CE2 PHE A 75 -0.511 -11.535 -2.112 1.00 0.00 C ATOM 1112 CZ PHE A 75 0.152 -12.734 -1.938 1.00 0.00 C ATOM 0 H PHE A 75 4.996 -9.251 -1.513 1.00 0.00 H new ATOM 0 HA PHE A 75 3.135 -9.506 -3.804 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.754 -8.905 -0.873 1.00 0.00 H new ATOM 0 HB3 PHE A 75 1.636 -8.223 -2.037 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.288 -11.560 -1.562 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -0.331 -9.412 -2.227 1.00 0.00 H new ATOM 0 HE1 PHE A 75 2.040 -13.677 -1.601 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -1.580 -11.527 -2.266 1.00 0.00 H new ATOM 0 HZ PHE A 75 -0.397 -13.664 -1.957 1.00 0.00 H new ATOM 1122 N SER A 76 3.305 -7.127 -4.464 1.00 0.00 N ATOM 1123 CA SER A 76 3.516 -5.764 -4.936 1.00 0.00 C ATOM 1124 C SER A 76 2.253 -4.927 -4.761 1.00 0.00 C ATOM 1125 O SER A 76 1.218 -5.209 -5.366 1.00 0.00 O ATOM 1126 CB SER A 76 3.937 -5.770 -6.407 1.00 0.00 C ATOM 1127 OG SER A 76 5.173 -6.441 -6.580 1.00 0.00 O ATOM 0 H SER A 76 2.810 -7.729 -5.122 1.00 0.00 H new ATOM 0 HA SER A 76 4.312 -5.319 -4.339 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.168 -6.257 -7.007 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.022 -4.745 -6.769 1.00 0.00 H new ATOM 0 HG SER A 76 5.420 -6.433 -7.528 1.00 0.00 H new ATOM 1133 N LEU A 77 2.345 -3.895 -3.928 1.00 0.00 N ATOM 1134 CA LEU A 77 1.210 -3.015 -3.672 1.00 0.00 C ATOM 1135 C LEU A 77 1.427 -1.647 -4.311 1.00 0.00 C ATOM 1136 O LEU A 77 2.023 -0.757 -3.706 1.00 0.00 O ATOM 1137 CB LEU A 77 0.991 -2.859 -2.166 1.00 0.00 C ATOM 1138 CG LEU A 77 0.086 -3.901 -1.508 1.00 0.00 C ATOM 1139 CD1 LEU A 77 0.833 -5.211 -1.314 1.00 0.00 C ATOM 1140 CD2 LEU A 77 -0.442 -3.385 -0.177 1.00 0.00 C ATOM 0 H LEU A 77 3.194 -3.648 -3.419 1.00 0.00 H new ATOM 0 HA LEU A 77 0.323 -3.466 -4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.963 -2.888 -1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 77 0.569 -1.871 -1.981 1.00 0.00 H new ATOM 0 HG LEU A 77 -0.763 -4.084 -2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 77 0.173 -5.940 -0.844 1.00 0.00 H new ATOM 0 HD12 LEU A 77 1.162 -5.589 -2.282 1.00 0.00 H new ATOM 0 HD13 LEU A 77 1.701 -5.044 -0.676 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -1.084 -4.140 0.277 1.00 0.00 H new ATOM 0 HD22 LEU A 77 0.395 -3.173 0.489 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.015 -2.473 -0.342 1.00 0.00 H new ATOM 1152 N ALA A 78 0.936 -1.487 -5.535 1.00 0.00 N ATOM 1153 CA ALA A 78 1.072 -0.227 -6.254 1.00 0.00 C ATOM 1154 C ALA A 78 0.117 0.826 -5.702 1.00 0.00 C ATOM 1155 O ALA A 78 -1.042 0.903 -6.113 1.00 0.00 O ATOM 1156 CB ALA A 78 0.826 -0.438 -7.741 1.00 0.00 C ATOM 0 H ALA A 78 0.440 -2.215 -6.050 1.00 0.00 H new ATOM 0 HA ALA A 78 2.091 0.135 -6.113 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.931 0.512 -8.266 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.552 -1.151 -8.132 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.181 -0.826 -7.892 1.00 0.00 H new ATOM 1162 N CYS A 79 0.609 1.634 -4.770 1.00 0.00 N ATOM 1163 CA CYS A 79 -0.202 2.682 -4.160 1.00 0.00 C ATOM 1164 C CYS A 79 0.087 4.035 -4.801 1.00 0.00 C ATOM 1165 O CYS A 79 1.243 4.388 -5.036 1.00 0.00 O ATOM 1166 CB CYS A 79 0.063 2.750 -2.656 1.00 0.00 C ATOM 1167 SG CYS A 79 -0.933 3.984 -1.786 1.00 0.00 S ATOM 0 H CYS A 79 1.566 1.584 -4.420 1.00 0.00 H new ATOM 0 HA CYS A 79 -1.251 2.438 -4.326 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -0.129 1.770 -2.219 1.00 0.00 H new ATOM 0 HB3 CYS A 79 1.118 2.970 -2.493 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.158 4.920 -1.323 1.00 0.00 H new ATOM 1173 N ILE A 80 -0.971 4.788 -5.083 1.00 0.00 N ATOM 1174 CA ILE A 80 -0.830 6.103 -5.697 1.00 0.00 C ATOM 1175 C ILE A 80 -1.673 7.144 -4.968 1.00 0.00 C ATOM 1176 O ILE A 80 -2.900 7.048 -4.927 1.00 0.00 O ATOM 1177 CB ILE A 80 -1.239 6.077 -7.182 1.00 0.00 C ATOM 1178 CG1 ILE A 80 -0.327 5.134 -7.969 1.00 0.00 C ATOM 1179 CG2 ILE A 80 -1.193 7.480 -7.769 1.00 0.00 C ATOM 1180 CD1 ILE A 80 -0.750 4.944 -9.408 1.00 0.00 C ATOM 0 H ILE A 80 -1.935 4.510 -4.896 1.00 0.00 H new ATOM 0 HA ILE A 80 0.223 6.375 -5.622 1.00 0.00 H new ATOM 0 HB ILE A 80 -2.262 5.707 -7.255 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.691 5.524 -7.947 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.308 4.163 -7.474 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.485 7.445 -8.819 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.881 8.126 -7.223 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -0.181 7.876 -7.687 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.058 4.264 -9.904 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.756 4.525 -9.439 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -0.742 5.906 -9.920 1.00 0.00 H new ATOM 1192 N LEU A 81 -1.006 8.139 -4.394 1.00 0.00 N ATOM 1193 CA LEU A 81 -1.693 9.201 -3.666 1.00 0.00 C ATOM 1194 C LEU A 81 -1.985 10.386 -4.581 1.00 0.00 C ATOM 1195 O LEU A 81 -1.080 11.027 -5.115 1.00 0.00 O ATOM 1196 CB LEU A 81 -0.851 9.657 -2.474 1.00 0.00 C ATOM 1197 CG LEU A 81 -0.455 8.568 -1.476 1.00 0.00 C ATOM 1198 CD1 LEU A 81 0.803 8.967 -0.722 1.00 0.00 C ATOM 1199 CD2 LEU A 81 -1.596 8.293 -0.506 1.00 0.00 C ATOM 0 H LEU A 81 0.009 8.233 -4.418 1.00 0.00 H new ATOM 0 HA LEU A 81 -2.641 8.804 -3.302 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.059 10.122 -2.854 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.404 10.429 -1.939 1.00 0.00 H new ATOM 0 HG LEU A 81 -0.247 7.653 -2.030 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.069 8.180 -0.017 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.620 9.113 -1.429 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.623 9.895 -0.179 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -1.297 7.516 0.197 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.836 9.204 0.042 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.474 7.962 -1.061 1.00 0.00 H new ATOM 1211 N PRO A 82 -3.279 10.687 -4.765 1.00 0.00 N ATOM 1212 CA PRO A 82 -3.721 11.799 -5.612 1.00 0.00 C ATOM 1213 C PRO A 82 -3.390 13.158 -5.004 1.00 0.00 C ATOM 1214 O PRO A 82 -2.712 13.242 -3.980 1.00 0.00 O ATOM 1215 CB PRO A 82 -5.237 11.604 -5.692 1.00 0.00 C ATOM 1216 CG PRO A 82 -5.588 10.854 -4.453 1.00 0.00 C ATOM 1217 CD PRO A 82 -4.411 9.966 -4.159 1.00 0.00 C ATOM 0 HA PRO A 82 -3.225 11.794 -6.583 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.757 12.561 -5.737 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -5.518 11.046 -6.585 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -5.779 11.536 -3.625 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -6.494 10.266 -4.596 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -4.271 9.827 -3.087 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -4.536 8.975 -4.596 1.00 0.00 H new ATOM 1225 N PHE A 83 -3.873 14.219 -5.641 1.00 0.00 N ATOM 1226 CA PHE A 83 -3.628 15.575 -5.163 1.00 0.00 C ATOM 1227 C PHE A 83 -4.757 16.042 -4.248 1.00 0.00 C ATOM 1228 O PHE A 83 -4.696 17.128 -3.672 1.00 0.00 O ATOM 1229 CB PHE A 83 -3.483 16.537 -6.344 1.00 0.00 C ATOM 1230 CG PHE A 83 -2.630 15.996 -7.456 1.00 0.00 C ATOM 1231 CD1 PHE A 83 -1.273 15.790 -7.268 1.00 0.00 C ATOM 1232 CD2 PHE A 83 -3.185 15.694 -8.688 1.00 0.00 C ATOM 1233 CE1 PHE A 83 -0.486 15.294 -8.289 1.00 0.00 C ATOM 1234 CE2 PHE A 83 -2.403 15.197 -9.714 1.00 0.00 C ATOM 1235 CZ PHE A 83 -1.052 14.996 -9.514 1.00 0.00 C ATOM 0 H PHE A 83 -4.436 14.166 -6.490 1.00 0.00 H new ATOM 0 HA PHE A 83 -2.700 15.569 -4.592 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -4.473 16.770 -6.736 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -3.052 17.473 -5.989 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -0.825 16.020 -6.312 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -4.242 15.849 -8.849 1.00 0.00 H new ATOM 0 HE1 PHE A 83 0.571 15.139 -8.130 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -2.848 14.966 -10.670 1.00 0.00 H new ATOM 0 HZ PHE A 83 -0.439 14.607 -10.313 1.00 0.00 H new ATOM 1245 N LYS A 84 -5.788 15.213 -4.120 1.00 0.00 N ATOM 1246 CA LYS A 84 -6.931 15.537 -3.276 1.00 0.00 C ATOM 1247 C LYS A 84 -6.730 15.008 -1.860 1.00 0.00 C ATOM 1248 O LYS A 84 -6.975 15.715 -0.882 1.00 0.00 O ATOM 1249 CB LYS A 84 -8.214 14.953 -3.873 1.00 0.00 C ATOM 1250 CG LYS A 84 -8.639 15.619 -5.171 1.00 0.00 C ATOM 1251 CD LYS A 84 -10.123 15.429 -5.434 1.00 0.00 C ATOM 1252 CE LYS A 84 -10.382 14.219 -6.318 1.00 0.00 C ATOM 1253 NZ LYS A 84 -9.990 14.470 -7.732 1.00 0.00 N ATOM 0 H LYS A 84 -5.855 14.311 -4.591 1.00 0.00 H new ATOM 0 HA LYS A 84 -7.020 16.622 -3.230 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -8.070 13.887 -4.051 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -9.020 15.048 -3.145 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -8.410 16.684 -5.127 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -8.065 15.203 -5.999 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.649 15.308 -4.487 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -10.526 16.322 -5.911 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -9.827 13.363 -5.934 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -11.439 13.958 -6.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -10.406 13.738 -8.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -10.336 15.405 -8.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -8.954 14.442 -7.815 1.00 0.00 H new ATOM 1267 N TYR A 85 -6.281 13.762 -1.758 1.00 0.00 N ATOM 1268 CA TYR A 85 -6.048 13.138 -0.461 1.00 0.00 C ATOM 1269 C TYR A 85 -5.779 14.191 0.610 1.00 0.00 C ATOM 1270 O TYR A 85 -5.127 15.206 0.369 1.00 0.00 O ATOM 1271 CB TYR A 85 -4.870 12.166 -0.543 1.00 0.00 C ATOM 1272 CG TYR A 85 -4.975 11.003 0.417 1.00 0.00 C ATOM 1273 CD1 TYR A 85 -6.104 10.193 0.436 1.00 0.00 C ATOM 1274 CD2 TYR A 85 -3.947 10.714 1.305 1.00 0.00 C ATOM 1275 CE1 TYR A 85 -6.206 9.130 1.312 1.00 0.00 C ATOM 1276 CE2 TYR A 85 -4.039 9.652 2.184 1.00 0.00 C ATOM 1277 CZ TYR A 85 -5.170 8.863 2.183 1.00 0.00 C ATOM 1278 OH TYR A 85 -5.267 7.805 3.058 1.00 0.00 O ATOM 0 H TYR A 85 -6.071 13.164 -2.558 1.00 0.00 H new ATOM 0 HA TYR A 85 -6.947 12.587 -0.185 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.798 11.781 -1.560 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.947 12.710 -0.342 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -6.916 10.398 -0.246 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -3.060 11.330 1.309 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -7.091 8.512 1.315 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -3.230 9.441 2.868 1.00 0.00 H new ATOM 0 HH TYR A 85 -5.999 7.968 3.688 1.00 0.00 H new ATOM 1288 N PRO A 86 -6.294 13.943 1.824 1.00 0.00 N ATOM 1289 CA PRO A 86 -7.073 12.738 2.123 1.00 0.00 C ATOM 1290 C PRO A 86 -8.435 12.744 1.439 1.00 0.00 C ATOM 1291 O PRO A 86 -9.133 11.730 1.416 1.00 0.00 O ATOM 1292 CB PRO A 86 -7.238 12.791 3.644 1.00 0.00 C ATOM 1293 CG PRO A 86 -7.124 14.236 3.987 1.00 0.00 C ATOM 1294 CD PRO A 86 -6.155 14.822 2.998 1.00 0.00 C ATOM 0 HA PRO A 86 -6.580 11.834 1.765 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -8.202 12.386 3.952 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -6.470 12.203 4.146 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -8.094 14.730 3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.766 14.367 5.008 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -6.402 15.856 2.758 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -5.136 14.819 3.384 1.00 0.00 H new ATOM 1302 N ALA A 87 -8.808 13.891 0.881 1.00 0.00 N ATOM 1303 CA ALA A 87 -10.086 14.028 0.194 1.00 0.00 C ATOM 1304 C ALA A 87 -10.532 12.698 -0.404 1.00 0.00 C ATOM 1305 O ALA A 87 -11.416 12.030 0.132 1.00 0.00 O ATOM 1306 CB ALA A 87 -9.991 15.091 -0.890 1.00 0.00 C ATOM 0 H ALA A 87 -8.242 14.740 0.891 1.00 0.00 H new ATOM 0 HA ALA A 87 -10.833 14.337 0.925 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -10.953 15.183 -1.395 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -9.725 16.047 -0.440 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -9.227 14.806 -1.613 1.00 0.00 H new ATOM 1312 N VAL A 88 -9.915 12.319 -1.519 1.00 0.00 N ATOM 1313 CA VAL A 88 -10.248 11.068 -2.190 1.00 0.00 C ATOM 1314 C VAL A 88 -9.219 9.987 -1.880 1.00 0.00 C ATOM 1315 O VAL A 88 -8.017 10.190 -2.054 1.00 0.00 O ATOM 1316 CB VAL A 88 -10.335 11.256 -3.716 1.00 0.00 C ATOM 1317 CG1 VAL A 88 -11.097 12.528 -4.055 1.00 0.00 C ATOM 1318 CG2 VAL A 88 -8.944 11.278 -4.330 1.00 0.00 C ATOM 0 H VAL A 88 -9.182 12.861 -1.977 1.00 0.00 H new ATOM 0 HA VAL A 88 -11.222 10.756 -1.813 1.00 0.00 H new ATOM 0 HB VAL A 88 -10.880 10.412 -4.138 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -11.148 12.644 -5.138 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.107 12.467 -3.649 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.583 13.386 -3.622 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -9.025 11.412 -5.409 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -8.371 12.102 -3.904 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -8.438 10.336 -4.118 1.00 0.00 H new ATOM 1328 N LEU A 89 -9.699 8.836 -1.420 1.00 0.00 N ATOM 1329 CA LEU A 89 -8.820 7.720 -1.086 1.00 0.00 C ATOM 1330 C LEU A 89 -7.788 7.492 -2.185 1.00 0.00 C ATOM 1331 O LEU A 89 -7.969 7.894 -3.334 1.00 0.00 O ATOM 1332 CB LEU A 89 -9.641 6.448 -0.868 1.00 0.00 C ATOM 1333 CG LEU A 89 -10.366 6.338 0.474 1.00 0.00 C ATOM 1334 CD1 LEU A 89 -11.357 5.185 0.452 1.00 0.00 C ATOM 1335 CD2 LEU A 89 -9.366 6.163 1.607 1.00 0.00 C ATOM 0 H LEU A 89 -10.691 8.651 -1.270 1.00 0.00 H new ATOM 0 HA LEU A 89 -8.292 7.967 -0.165 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -10.381 6.376 -1.665 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -8.978 5.589 -0.971 1.00 0.00 H new ATOM 0 HG LEU A 89 -10.919 7.262 0.644 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -11.863 5.122 1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -12.093 5.353 -0.335 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.826 4.253 0.260 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -9.899 6.086 2.554 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.786 5.255 1.443 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -8.696 7.022 1.636 1.00 0.00 H new ATOM 1347 N PRO A 90 -6.678 6.829 -1.826 1.00 0.00 N ATOM 1348 CA PRO A 90 -5.596 6.529 -2.769 1.00 0.00 C ATOM 1349 C PRO A 90 -6.002 5.487 -3.805 1.00 0.00 C ATOM 1350 O PRO A 90 -7.177 5.139 -3.921 1.00 0.00 O ATOM 1351 CB PRO A 90 -4.484 5.984 -1.869 1.00 0.00 C ATOM 1352 CG PRO A 90 -5.193 5.441 -0.677 1.00 0.00 C ATOM 1353 CD PRO A 90 -6.395 6.320 -0.474 1.00 0.00 C ATOM 0 HA PRO A 90 -5.304 7.405 -3.348 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -3.910 5.208 -2.375 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -3.782 6.769 -1.588 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.490 4.405 -0.838 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -4.547 5.454 0.201 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.239 5.760 -0.071 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -6.187 7.130 0.225 1.00 0.00 H new ATOM 1361 N GLU A 91 -5.022 4.993 -4.556 1.00 0.00 N ATOM 1362 CA GLU A 91 -5.279 3.990 -5.583 1.00 0.00 C ATOM 1363 C GLU A 91 -4.283 2.839 -5.481 1.00 0.00 C ATOM 1364 O GLU A 91 -3.307 2.781 -6.231 1.00 0.00 O ATOM 1365 CB GLU A 91 -5.205 4.623 -6.974 1.00 0.00 C ATOM 1366 CG GLU A 91 -6.181 5.770 -7.174 1.00 0.00 C ATOM 1367 CD GLU A 91 -6.197 6.280 -8.602 1.00 0.00 C ATOM 1368 OE1 GLU A 91 -6.434 5.466 -9.519 1.00 0.00 O ATOM 1369 OE2 GLU A 91 -5.973 7.491 -8.803 1.00 0.00 O ATOM 0 H GLU A 91 -4.044 5.271 -4.472 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.282 3.593 -5.425 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.191 4.986 -7.145 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -5.400 3.856 -7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.183 5.442 -6.898 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.917 6.588 -6.503 1.00 0.00 H new ATOM 1376 N ILE A 92 -4.535 1.926 -4.550 1.00 0.00 N ATOM 1377 CA ILE A 92 -3.661 0.777 -4.350 1.00 0.00 C ATOM 1378 C ILE A 92 -4.099 -0.403 -5.211 1.00 0.00 C ATOM 1379 O ILE A 92 -5.293 -0.662 -5.368 1.00 0.00 O ATOM 1380 CB ILE A 92 -3.634 0.339 -2.874 1.00 0.00 C ATOM 1381 CG1 ILE A 92 -3.291 1.527 -1.973 1.00 0.00 C ATOM 1382 CG2 ILE A 92 -2.635 -0.790 -2.674 1.00 0.00 C ATOM 1383 CD1 ILE A 92 -3.574 1.277 -0.508 1.00 0.00 C ATOM 0 H ILE A 92 -5.338 1.960 -3.922 1.00 0.00 H new ATOM 0 HA ILE A 92 -2.659 1.088 -4.646 1.00 0.00 H new ATOM 0 HB ILE A 92 -4.624 -0.026 -2.601 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -2.236 1.771 -2.094 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -3.859 2.397 -2.301 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -2.628 -1.088 -1.626 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -2.920 -1.642 -3.292 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -1.640 -0.450 -2.961 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -3.307 2.161 0.070 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -4.634 1.062 -0.374 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -2.985 0.427 -0.164 1.00 0.00 H new ATOM 1395 N THR A 93 -3.126 -1.118 -5.766 1.00 0.00 N ATOM 1396 CA THR A 93 -3.410 -2.272 -6.610 1.00 0.00 C ATOM 1397 C THR A 93 -2.515 -3.452 -6.248 1.00 0.00 C ATOM 1398 O THR A 93 -1.349 -3.503 -6.640 1.00 0.00 O ATOM 1399 CB THR A 93 -3.220 -1.936 -8.101 1.00 0.00 C ATOM 1400 OG1 THR A 93 -4.059 -0.835 -8.466 1.00 0.00 O ATOM 1401 CG2 THR A 93 -3.548 -3.140 -8.972 1.00 0.00 C ATOM 0 H THR A 93 -2.133 -0.918 -5.646 1.00 0.00 H new ATOM 0 HA THR A 93 -4.451 -2.543 -6.436 1.00 0.00 H new ATOM 0 HB THR A 93 -2.176 -1.665 -8.260 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.931 -0.627 -9.415 1.00 0.00 H new ATOM 0 HG21 THR A 93 -3.407 -2.880 -10.021 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.888 -3.968 -8.712 1.00 0.00 H new ATOM 0 HG23 THR A 93 -4.584 -3.436 -8.808 1.00 0.00 H new ATOM 1409 N VAL A 94 -3.069 -4.399 -5.498 1.00 0.00 N ATOM 1410 CA VAL A 94 -2.321 -5.581 -5.085 1.00 0.00 C ATOM 1411 C VAL A 94 -2.115 -6.538 -6.254 1.00 0.00 C ATOM 1412 O VAL A 94 -3.073 -6.956 -6.903 1.00 0.00 O ATOM 1413 CB VAL A 94 -3.038 -6.328 -3.944 1.00 0.00 C ATOM 1414 CG1 VAL A 94 -2.213 -7.522 -3.487 1.00 0.00 C ATOM 1415 CG2 VAL A 94 -3.316 -5.386 -2.783 1.00 0.00 C ATOM 0 H VAL A 94 -4.032 -4.371 -5.164 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.351 -5.234 -4.729 1.00 0.00 H new ATOM 0 HB VAL A 94 -3.993 -6.698 -4.318 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -2.735 -8.038 -2.681 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.070 -8.207 -4.323 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -1.242 -7.178 -3.129 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -3.823 -5.930 -1.986 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.375 -4.985 -2.407 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -3.950 -4.567 -3.123 1.00 0.00 H new ATOM 1425 N ARG A 95 -0.858 -6.880 -6.516 1.00 0.00 N ATOM 1426 CA ARG A 95 -0.525 -7.788 -7.608 1.00 0.00 C ATOM 1427 C ARG A 95 0.514 -8.814 -7.164 1.00 0.00 C ATOM 1428 O ARG A 95 1.544 -8.461 -6.591 1.00 0.00 O ATOM 1429 CB ARG A 95 0.000 -7.001 -8.810 1.00 0.00 C ATOM 1430 CG ARG A 95 -1.091 -6.303 -9.605 1.00 0.00 C ATOM 1431 CD ARG A 95 -1.704 -7.230 -10.643 1.00 0.00 C ATOM 1432 NE ARG A 95 -1.006 -7.155 -11.924 1.00 0.00 N ATOM 1433 CZ ARG A 95 -1.056 -8.111 -12.845 1.00 0.00 C ATOM 1434 NH1 ARG A 95 -1.767 -9.209 -12.628 1.00 0.00 N ATOM 1435 NH2 ARG A 95 -0.393 -7.970 -13.986 1.00 0.00 N ATOM 0 H ARG A 95 -0.053 -6.542 -5.988 1.00 0.00 H new ATOM 0 HA ARG A 95 -1.432 -8.318 -7.897 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.716 -6.257 -8.462 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.541 -7.680 -9.470 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -1.868 -5.950 -8.927 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -0.677 -5.424 -10.100 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.676 -8.255 -10.275 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -2.753 -6.971 -10.786 1.00 0.00 H new ATOM 0 HE ARG A 95 -0.450 -6.323 -12.122 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -2.277 -9.321 -11.752 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -1.804 -9.941 -13.337 1.00 0.00 H new ATOM 0 HH21 ARG A 95 0.156 -7.127 -14.156 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -0.432 -8.705 -14.693 1.00 0.00 H new ATOM 1449 N SER A 96 0.234 -10.085 -7.434 1.00 0.00 N ATOM 1450 CA SER A 96 1.142 -11.163 -7.059 1.00 0.00 C ATOM 1451 C SER A 96 1.055 -12.317 -8.053 1.00 0.00 C ATOM 1452 O SER A 96 -0.006 -12.913 -8.238 1.00 0.00 O ATOM 1453 CB SER A 96 0.818 -11.664 -5.650 1.00 0.00 C ATOM 1454 OG SER A 96 1.525 -12.857 -5.358 1.00 0.00 O ATOM 0 H SER A 96 -0.613 -10.393 -7.911 1.00 0.00 H new ATOM 0 HA SER A 96 2.159 -10.770 -7.073 1.00 0.00 H new ATOM 0 HB2 SER A 96 1.076 -10.897 -4.920 1.00 0.00 H new ATOM 0 HB3 SER A 96 -0.254 -11.842 -5.561 1.00 0.00 H new ATOM 0 HG SER A 96 1.605 -12.961 -4.387 1.00 0.00 H new ATOM 1460 N VAL A 97 2.179 -12.626 -8.691 1.00 0.00 N ATOM 1461 CA VAL A 97 2.232 -13.709 -9.666 1.00 0.00 C ATOM 1462 C VAL A 97 1.455 -14.927 -9.178 1.00 0.00 C ATOM 1463 O VAL A 97 0.921 -15.697 -9.977 1.00 0.00 O ATOM 1464 CB VAL A 97 3.684 -14.126 -9.964 1.00 0.00 C ATOM 1465 CG1 VAL A 97 4.439 -12.990 -10.638 1.00 0.00 C ATOM 1466 CG2 VAL A 97 4.386 -14.559 -8.686 1.00 0.00 C ATOM 0 H VAL A 97 3.066 -12.142 -8.550 1.00 0.00 H new ATOM 0 HA VAL A 97 1.775 -13.333 -10.581 1.00 0.00 H new ATOM 0 HB VAL A 97 3.667 -14.974 -10.648 1.00 0.00 H new ATOM 0 HG11 VAL A 97 5.463 -13.304 -10.841 1.00 0.00 H new ATOM 0 HG12 VAL A 97 3.946 -12.731 -11.575 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.449 -12.120 -9.981 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.411 -14.850 -8.915 1.00 0.00 H new ATOM 0 HG22 VAL A 97 4.394 -13.731 -7.977 1.00 0.00 H new ATOM 0 HG23 VAL A 97 3.857 -15.406 -8.249 1.00 0.00 H new ATOM 1476 N LEU A 98 1.395 -15.094 -7.861 1.00 0.00 N ATOM 1477 CA LEU A 98 0.682 -16.219 -7.265 1.00 0.00 C ATOM 1478 C LEU A 98 -0.797 -16.183 -7.633 1.00 0.00 C ATOM 1479 O LEU A 98 -1.331 -17.137 -8.200 1.00 0.00 O ATOM 1480 CB LEU A 98 0.842 -16.200 -5.744 1.00 0.00 C ATOM 1481 CG LEU A 98 2.259 -15.967 -5.220 1.00 0.00 C ATOM 1482 CD1 LEU A 98 2.295 -16.085 -3.704 1.00 0.00 C ATOM 1483 CD2 LEU A 98 3.231 -16.951 -5.856 1.00 0.00 C ATOM 0 H LEU A 98 1.831 -14.465 -7.186 1.00 0.00 H new ATOM 0 HA LEU A 98 1.112 -17.140 -7.658 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.195 -15.421 -5.341 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.482 -17.150 -5.349 1.00 0.00 H new ATOM 0 HG LEU A 98 2.564 -14.957 -5.492 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.312 -15.916 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.630 -15.341 -3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.969 -17.082 -3.409 1.00 0.00 H new ATOM 0 HD21 LEU A 98 4.235 -16.771 -5.472 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.928 -17.970 -5.615 1.00 0.00 H new ATOM 0 HD23 LEU A 98 3.228 -16.818 -6.938 1.00 0.00 H new ATOM 1495 N LEU A 99 -1.455 -15.075 -7.309 1.00 0.00 N ATOM 1496 CA LEU A 99 -2.874 -14.913 -7.608 1.00 0.00 C ATOM 1497 C LEU A 99 -3.103 -14.791 -9.111 1.00 0.00 C ATOM 1498 O LEU A 99 -2.195 -14.434 -9.861 1.00 0.00 O ATOM 1499 CB LEU A 99 -3.428 -13.678 -6.895 1.00 0.00 C ATOM 1500 CG LEU A 99 -3.200 -13.618 -5.384 1.00 0.00 C ATOM 1501 CD1 LEU A 99 -3.163 -12.174 -4.907 1.00 0.00 C ATOM 1502 CD2 LEU A 99 -4.283 -14.396 -4.650 1.00 0.00 C ATOM 0 H LEU A 99 -1.029 -14.276 -6.840 1.00 0.00 H new ATOM 0 HA LEU A 99 -3.399 -15.798 -7.249 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.981 -12.792 -7.345 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -4.500 -13.625 -7.083 1.00 0.00 H new ATOM 0 HG LEU A 99 -2.237 -14.077 -5.163 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.000 -12.151 -3.830 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -2.352 -11.646 -5.408 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.111 -11.689 -5.141 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.105 -14.343 -3.576 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.258 -13.966 -4.878 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -4.263 -15.438 -4.970 1.00 0.00 H new ATOM 1514 N SER A 100 -4.324 -15.089 -9.544 1.00 0.00 N ATOM 1515 CA SER A 100 -4.673 -15.015 -10.958 1.00 0.00 C ATOM 1516 C SER A 100 -5.449 -13.736 -11.260 1.00 0.00 C ATOM 1517 O SER A 100 -6.158 -13.210 -10.401 1.00 0.00 O ATOM 1518 CB SER A 100 -5.501 -16.236 -11.366 1.00 0.00 C ATOM 1519 OG SER A 100 -6.845 -16.107 -10.936 1.00 0.00 O ATOM 0 H SER A 100 -5.088 -15.384 -8.936 1.00 0.00 H new ATOM 0 HA SER A 100 -3.748 -15.003 -11.535 1.00 0.00 H new ATOM 0 HB2 SER A 100 -5.472 -16.354 -12.449 1.00 0.00 H new ATOM 0 HB3 SER A 100 -5.063 -17.137 -10.936 1.00 0.00 H new ATOM 0 HG SER A 100 -6.980 -16.636 -10.123 1.00 0.00 H new ATOM 1525 N ARG A 101 -5.310 -13.242 -12.486 1.00 0.00 N ATOM 1526 CA ARG A 101 -5.996 -12.025 -12.901 1.00 0.00 C ATOM 1527 C ARG A 101 -7.468 -12.067 -12.501 1.00 0.00 C ATOM 1528 O ARG A 101 -8.129 -11.032 -12.419 1.00 0.00 O ATOM 1529 CB ARG A 101 -5.874 -11.837 -14.414 1.00 0.00 C ATOM 1530 CG ARG A 101 -6.750 -12.782 -15.219 1.00 0.00 C ATOM 1531 CD ARG A 101 -6.020 -14.075 -15.548 1.00 0.00 C ATOM 1532 NE ARG A 101 -4.886 -13.852 -16.440 1.00 0.00 N ATOM 1533 CZ ARG A 101 -4.265 -14.825 -17.097 1.00 0.00 C ATOM 1534 NH1 ARG A 101 -4.667 -16.081 -16.963 1.00 0.00 N ATOM 1535 NH2 ARG A 101 -3.241 -14.542 -17.891 1.00 0.00 N ATOM 0 H ARG A 101 -4.729 -13.666 -13.209 1.00 0.00 H new ATOM 0 HA ARG A 101 -5.524 -11.182 -12.397 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -6.136 -10.809 -14.666 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -4.834 -11.982 -14.707 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -7.656 -13.008 -14.657 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -7.061 -12.294 -16.142 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -5.670 -14.538 -14.626 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -6.714 -14.775 -16.013 1.00 0.00 H new ATOM 0 HE ARG A 101 -4.552 -12.896 -16.566 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -5.455 -16.302 -16.354 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.188 -16.826 -17.469 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -2.930 -13.576 -17.997 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -2.765 -15.290 -18.395 1.00 0.00 H new ATOM 1549 N SER A 102 -7.975 -13.271 -12.253 1.00 0.00 N ATOM 1550 CA SER A 102 -9.369 -13.448 -11.866 1.00 0.00 C ATOM 1551 C SER A 102 -9.564 -13.147 -10.383 1.00 0.00 C ATOM 1552 O SER A 102 -10.203 -12.161 -10.019 1.00 0.00 O ATOM 1553 CB SER A 102 -9.828 -14.875 -12.173 1.00 0.00 C ATOM 1554 OG SER A 102 -10.048 -15.053 -13.561 1.00 0.00 O ATOM 0 H SER A 102 -7.441 -14.138 -12.313 1.00 0.00 H new ATOM 0 HA SER A 102 -9.972 -12.747 -12.443 1.00 0.00 H new ATOM 0 HB2 SER A 102 -9.076 -15.584 -11.827 1.00 0.00 H new ATOM 0 HB3 SER A 102 -10.746 -15.091 -11.626 1.00 0.00 H new ATOM 0 HG SER A 102 -10.339 -15.973 -13.731 1.00 0.00 H new ATOM 1560 N GLN A 103 -9.007 -14.004 -9.534 1.00 0.00 N ATOM 1561 CA GLN A 103 -9.119 -13.831 -8.090 1.00 0.00 C ATOM 1562 C GLN A 103 -8.542 -12.487 -7.657 1.00 0.00 C ATOM 1563 O GLN A 103 -9.147 -11.770 -6.860 1.00 0.00 O ATOM 1564 CB GLN A 103 -8.400 -14.967 -7.361 1.00 0.00 C ATOM 1565 CG GLN A 103 -6.928 -15.087 -7.723 1.00 0.00 C ATOM 1566 CD GLN A 103 -6.401 -16.499 -7.561 1.00 0.00 C ATOM 1567 OE1 GLN A 103 -6.883 -17.431 -8.204 1.00 0.00 O ATOM 1568 NE2 GLN A 103 -5.404 -16.663 -6.699 1.00 0.00 N ATOM 0 H GLN A 103 -8.474 -14.825 -9.820 1.00 0.00 H new ATOM 0 HA GLN A 103 -10.177 -13.854 -7.828 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -8.490 -14.812 -6.286 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -8.900 -15.908 -7.590 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -6.784 -14.766 -8.755 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -6.347 -14.412 -7.095 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -5.035 -15.861 -6.187 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -5.007 -17.591 -6.549 1.00 0.00 H new ATOM 1577 N GLN A 104 -7.370 -12.154 -8.186 1.00 0.00 N ATOM 1578 CA GLN A 104 -6.711 -10.897 -7.853 1.00 0.00 C ATOM 1579 C GLN A 104 -7.671 -9.722 -8.006 1.00 0.00 C ATOM 1580 O GLN A 104 -7.638 -8.772 -7.223 1.00 0.00 O ATOM 1581 CB GLN A 104 -5.484 -10.687 -8.743 1.00 0.00 C ATOM 1582 CG GLN A 104 -4.670 -9.457 -8.376 1.00 0.00 C ATOM 1583 CD GLN A 104 -3.876 -9.642 -7.098 1.00 0.00 C ATOM 1584 OE1 GLN A 104 -2.698 -9.996 -7.131 1.00 0.00 O ATOM 1585 NE2 GLN A 104 -4.520 -9.403 -5.961 1.00 0.00 N ATOM 0 H GLN A 104 -6.857 -12.737 -8.847 1.00 0.00 H new ATOM 0 HA GLN A 104 -6.391 -10.949 -6.812 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -4.845 -11.568 -8.680 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -5.808 -10.602 -9.780 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -3.987 -9.221 -9.192 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -5.339 -8.604 -8.263 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -5.497 -9.111 -5.980 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -4.037 -9.511 -5.069 1.00 0.00 H new ATOM 1594 N THR A 105 -8.528 -9.792 -9.020 1.00 0.00 N ATOM 1595 CA THR A 105 -9.497 -8.734 -9.277 1.00 0.00 C ATOM 1596 C THR A 105 -10.345 -8.454 -8.042 1.00 0.00 C ATOM 1597 O THR A 105 -10.339 -7.342 -7.514 1.00 0.00 O ATOM 1598 CB THR A 105 -10.424 -9.095 -10.453 1.00 0.00 C ATOM 1599 OG1 THR A 105 -9.660 -9.229 -11.656 1.00 0.00 O ATOM 1600 CG2 THR A 105 -11.496 -8.032 -10.642 1.00 0.00 C ATOM 0 H THR A 105 -8.571 -10.571 -9.677 1.00 0.00 H new ATOM 0 HA THR A 105 -8.929 -7.840 -9.534 1.00 0.00 H new ATOM 0 HB THR A 105 -10.911 -10.043 -10.226 1.00 0.00 H new ATOM 0 HG1 THR A 105 -9.326 -10.147 -11.731 1.00 0.00 H new ATOM 0 HG21 THR A 105 -12.139 -8.308 -11.478 1.00 0.00 H new ATOM 0 HG22 THR A 105 -12.095 -7.953 -9.734 1.00 0.00 H new ATOM 0 HG23 THR A 105 -11.024 -7.072 -10.849 1.00 0.00 H new ATOM 1608 N GLN A 106 -11.073 -9.469 -7.588 1.00 0.00 N ATOM 1609 CA GLN A 106 -11.927 -9.330 -6.414 1.00 0.00 C ATOM 1610 C GLN A 106 -11.132 -8.811 -5.220 1.00 0.00 C ATOM 1611 O GLN A 106 -11.585 -7.923 -4.498 1.00 0.00 O ATOM 1612 CB GLN A 106 -12.574 -10.672 -6.067 1.00 0.00 C ATOM 1613 CG GLN A 106 -13.579 -10.586 -4.929 1.00 0.00 C ATOM 1614 CD GLN A 106 -14.747 -9.674 -5.250 1.00 0.00 C ATOM 1615 OE1 GLN A 106 -15.530 -9.945 -6.160 1.00 0.00 O ATOM 1616 NE2 GLN A 106 -14.869 -8.584 -4.501 1.00 0.00 N ATOM 0 H GLN A 106 -11.089 -10.395 -8.014 1.00 0.00 H new ATOM 0 HA GLN A 106 -12.709 -8.607 -6.648 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -13.073 -11.065 -6.953 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -11.793 -11.384 -5.798 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -13.954 -11.585 -4.704 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -13.076 -10.224 -4.032 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -14.197 -8.399 -3.757 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -15.635 -7.932 -4.670 1.00 0.00 H new ATOM 1625 N LEU A 107 -9.945 -9.372 -5.018 1.00 0.00 N ATOM 1626 CA LEU A 107 -9.086 -8.966 -3.911 1.00 0.00 C ATOM 1627 C LEU A 107 -8.914 -7.451 -3.882 1.00 0.00 C ATOM 1628 O LEU A 107 -9.109 -6.815 -2.847 1.00 0.00 O ATOM 1629 CB LEU A 107 -7.719 -9.644 -4.026 1.00 0.00 C ATOM 1630 CG LEU A 107 -6.715 -9.321 -2.919 1.00 0.00 C ATOM 1631 CD1 LEU A 107 -5.761 -10.486 -2.707 1.00 0.00 C ATOM 1632 CD2 LEU A 107 -5.944 -8.051 -3.252 1.00 0.00 C ATOM 0 H LEU A 107 -9.555 -10.109 -5.606 1.00 0.00 H new ATOM 0 HA LEU A 107 -9.562 -9.276 -2.981 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.871 -10.723 -4.047 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -7.277 -9.366 -4.983 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.265 -9.156 -1.993 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.054 -10.238 -1.916 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.327 -11.373 -2.423 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -5.217 -10.684 -3.631 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -5.234 -7.836 -2.453 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -5.405 -8.188 -4.189 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -6.640 -7.218 -3.352 1.00 0.00 H new ATOM 1644 N ASN A 108 -8.551 -6.879 -5.026 1.00 0.00 N ATOM 1645 CA ASN A 108 -8.356 -5.438 -5.131 1.00 0.00 C ATOM 1646 C ASN A 108 -9.563 -4.683 -4.582 1.00 0.00 C ATOM 1647 O ASN A 108 -9.436 -3.868 -3.668 1.00 0.00 O ATOM 1648 CB ASN A 108 -8.112 -5.041 -6.589 1.00 0.00 C ATOM 1649 CG ASN A 108 -6.643 -5.086 -6.962 1.00 0.00 C ATOM 1650 OD1 ASN A 108 -6.026 -4.053 -7.225 1.00 0.00 O ATOM 1651 ND2 ASN A 108 -6.075 -6.286 -6.987 1.00 0.00 N ATOM 0 H ASN A 108 -8.386 -7.391 -5.892 1.00 0.00 H new ATOM 0 HA ASN A 108 -7.482 -5.171 -4.537 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -8.671 -5.710 -7.243 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -8.496 -4.035 -6.758 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -5.089 -6.379 -7.231 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -6.625 -7.115 -6.762 1.00 0.00 H new ATOM 1658 N THR A 109 -10.734 -4.962 -5.146 1.00 0.00 N ATOM 1659 CA THR A 109 -11.964 -4.310 -4.714 1.00 0.00 C ATOM 1660 C THR A 109 -12.097 -4.336 -3.195 1.00 0.00 C ATOM 1661 O THR A 109 -12.256 -3.295 -2.558 1.00 0.00 O ATOM 1662 CB THR A 109 -13.204 -4.978 -5.338 1.00 0.00 C ATOM 1663 OG1 THR A 109 -13.088 -4.989 -6.765 1.00 0.00 O ATOM 1664 CG2 THR A 109 -14.475 -4.248 -4.932 1.00 0.00 C ATOM 0 H THR A 109 -10.856 -5.635 -5.903 1.00 0.00 H new ATOM 0 HA THR A 109 -11.908 -3.276 -5.053 1.00 0.00 H new ATOM 0 HB THR A 109 -13.261 -6.003 -4.971 1.00 0.00 H new ATOM 0 HG1 THR A 109 -13.879 -5.417 -7.154 1.00 0.00 H new ATOM 0 HG21 THR A 109 -15.337 -4.738 -5.385 1.00 0.00 H new ATOM 0 HG22 THR A 109 -14.575 -4.268 -3.847 1.00 0.00 H new ATOM 0 HG23 THR A 109 -14.425 -3.214 -5.273 1.00 0.00 H new ATOM 1672 N ASP A 110 -12.029 -5.532 -2.621 1.00 0.00 N ATOM 1673 CA ASP A 110 -12.140 -5.694 -1.176 1.00 0.00 C ATOM 1674 C ASP A 110 -11.184 -4.754 -0.449 1.00 0.00 C ATOM 1675 O ASP A 110 -11.609 -3.903 0.333 1.00 0.00 O ATOM 1676 CB ASP A 110 -11.850 -7.143 -0.780 1.00 0.00 C ATOM 1677 CG ASP A 110 -13.031 -8.060 -1.030 1.00 0.00 C ATOM 1678 OD1 ASP A 110 -13.568 -8.043 -2.157 1.00 0.00 O ATOM 1679 OD2 ASP A 110 -13.419 -8.794 -0.098 1.00 0.00 O ATOM 0 H ASP A 110 -11.898 -6.404 -3.134 1.00 0.00 H new ATOM 0 HA ASP A 110 -13.160 -5.443 -0.884 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -10.988 -7.504 -1.341 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -11.581 -7.181 0.276 1.00 0.00 H new ATOM 1684 N LEU A 111 -9.892 -4.913 -0.712 1.00 0.00 N ATOM 1685 CA LEU A 111 -8.875 -4.079 -0.081 1.00 0.00 C ATOM 1686 C LEU A 111 -9.350 -2.634 0.033 1.00 0.00 C ATOM 1687 O LEU A 111 -9.180 -1.993 1.071 1.00 0.00 O ATOM 1688 CB LEU A 111 -7.572 -4.137 -0.881 1.00 0.00 C ATOM 1689 CG LEU A 111 -6.513 -3.097 -0.515 1.00 0.00 C ATOM 1690 CD1 LEU A 111 -6.205 -3.149 0.973 1.00 0.00 C ATOM 1691 CD2 LEU A 111 -5.247 -3.315 -1.331 1.00 0.00 C ATOM 0 H LEU A 111 -9.524 -5.611 -1.358 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.696 -4.464 0.923 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -7.137 -5.129 -0.757 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -7.813 -4.025 -1.938 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.907 -2.108 -0.749 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.449 -2.402 1.214 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -7.113 -2.943 1.540 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.832 -4.140 1.233 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -4.504 -2.566 -1.057 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -4.850 -4.310 -1.129 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.478 -3.226 -2.392 1.00 0.00 H new ATOM 1703 N THR A 112 -9.948 -2.126 -1.040 1.00 0.00 N ATOM 1704 CA THR A 112 -10.449 -0.758 -1.061 1.00 0.00 C ATOM 1705 C THR A 112 -11.609 -0.583 -0.087 1.00 0.00 C ATOM 1706 O THR A 112 -11.589 0.307 0.763 1.00 0.00 O ATOM 1707 CB THR A 112 -10.912 -0.350 -2.472 1.00 0.00 C ATOM 1708 OG1 THR A 112 -9.895 -0.660 -3.430 1.00 0.00 O ATOM 1709 CG2 THR A 112 -11.233 1.136 -2.528 1.00 0.00 C ATOM 0 H THR A 112 -10.097 -2.643 -1.907 1.00 0.00 H new ATOM 0 HA THR A 112 -9.623 -0.114 -0.758 1.00 0.00 H new ATOM 0 HB THR A 112 -11.817 -0.910 -2.709 1.00 0.00 H new ATOM 0 HG1 THR A 112 -10.198 -0.399 -4.325 1.00 0.00 H new ATOM 0 HG21 THR A 112 -11.558 1.400 -3.534 1.00 0.00 H new ATOM 0 HG22 THR A 112 -12.029 1.363 -1.818 1.00 0.00 H new ATOM 0 HG23 THR A 112 -10.343 1.710 -2.271 1.00 0.00 H new ATOM 1717 N ALA A 113 -12.618 -1.437 -0.216 1.00 0.00 N ATOM 1718 CA ALA A 113 -13.786 -1.378 0.654 1.00 0.00 C ATOM 1719 C ALA A 113 -13.381 -1.101 2.098 1.00 0.00 C ATOM 1720 O ALA A 113 -13.813 -0.116 2.697 1.00 0.00 O ATOM 1721 CB ALA A 113 -14.577 -2.675 0.566 1.00 0.00 C ATOM 0 H ALA A 113 -12.650 -2.179 -0.915 1.00 0.00 H new ATOM 0 HA ALA A 113 -14.418 -0.556 0.317 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -15.446 -2.616 1.221 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -14.907 -2.831 -0.461 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -13.946 -3.508 0.875 1.00 0.00 H new ATOM 1727 N PHE A 114 -12.548 -1.976 2.652 1.00 0.00 N ATOM 1728 CA PHE A 114 -12.086 -1.827 4.027 1.00 0.00 C ATOM 1729 C PHE A 114 -11.903 -0.354 4.382 1.00 0.00 C ATOM 1730 O PHE A 114 -12.579 0.172 5.268 1.00 0.00 O ATOM 1731 CB PHE A 114 -10.769 -2.579 4.230 1.00 0.00 C ATOM 1732 CG PHE A 114 -10.408 -2.777 5.674 1.00 0.00 C ATOM 1733 CD1 PHE A 114 -11.250 -3.477 6.523 1.00 0.00 C ATOM 1734 CD2 PHE A 114 -9.226 -2.263 6.183 1.00 0.00 C ATOM 1735 CE1 PHE A 114 -10.920 -3.661 7.853 1.00 0.00 C ATOM 1736 CE2 PHE A 114 -8.891 -2.445 7.512 1.00 0.00 C ATOM 1737 CZ PHE A 114 -9.740 -3.143 8.348 1.00 0.00 C ATOM 0 H PHE A 114 -12.179 -2.796 2.170 1.00 0.00 H new ATOM 0 HA PHE A 114 -12.843 -2.251 4.686 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -10.837 -3.552 3.744 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -9.967 -2.031 3.735 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -12.175 -3.884 6.141 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -8.559 -1.714 5.534 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -11.585 -4.209 8.504 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -7.966 -2.041 7.896 1.00 0.00 H new ATOM 0 HZ PHE A 114 -9.481 -3.283 9.387 1.00 0.00 H new ATOM 1747 N LEU A 115 -10.985 0.307 3.686 1.00 0.00 N ATOM 1748 CA LEU A 115 -10.711 1.719 3.927 1.00 0.00 C ATOM 1749 C LEU A 115 -11.973 2.557 3.743 1.00 0.00 C ATOM 1750 O LEU A 115 -12.394 3.268 4.654 1.00 0.00 O ATOM 1751 CB LEU A 115 -9.614 2.215 2.983 1.00 0.00 C ATOM 1752 CG LEU A 115 -8.320 1.401 2.973 1.00 0.00 C ATOM 1753 CD1 LEU A 115 -7.623 1.523 1.627 1.00 0.00 C ATOM 1754 CD2 LEU A 115 -7.397 1.853 4.096 1.00 0.00 C ATOM 0 H LEU A 115 -10.417 -0.113 2.950 1.00 0.00 H new ATOM 0 HA LEU A 115 -10.371 1.827 4.957 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.016 2.234 1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -9.371 3.244 3.249 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.571 0.353 3.135 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -6.704 0.937 1.639 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -8.281 1.151 0.842 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -7.384 2.569 1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -6.481 1.263 4.074 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -7.153 2.907 3.964 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -7.895 1.713 5.055 1.00 0.00 H new ATOM 1766 N GLN A 116 -12.571 2.465 2.560 1.00 0.00 N ATOM 1767 CA GLN A 116 -13.785 3.214 2.258 1.00 0.00 C ATOM 1768 C GLN A 116 -14.673 3.331 3.492 1.00 0.00 C ATOM 1769 O GLN A 116 -15.330 4.351 3.703 1.00 0.00 O ATOM 1770 CB GLN A 116 -14.556 2.539 1.122 1.00 0.00 C ATOM 1771 CG GLN A 116 -13.786 2.484 -0.187 1.00 0.00 C ATOM 1772 CD GLN A 116 -14.696 2.479 -1.400 1.00 0.00 C ATOM 1773 OE1 GLN A 116 -15.835 2.015 -1.334 1.00 0.00 O ATOM 1774 NE2 GLN A 116 -14.198 2.996 -2.517 1.00 0.00 N ATOM 0 H GLN A 116 -12.235 1.880 1.795 1.00 0.00 H new ATOM 0 HA GLN A 116 -13.495 4.217 1.945 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -14.817 1.524 1.424 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -15.492 3.074 0.961 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -13.114 3.340 -0.245 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -13.164 1.589 -0.201 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.249 3.370 -2.527 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -14.764 3.020 -3.365 1.00 0.00 H new ATOM 1783 N LYS A 117 -14.689 2.281 4.305 1.00 0.00 N ATOM 1784 CA LYS A 117 -15.496 2.265 5.520 1.00 0.00 C ATOM 1785 C LYS A 117 -14.659 2.655 6.734 1.00 0.00 C ATOM 1786 O LYS A 117 -14.894 3.692 7.355 1.00 0.00 O ATOM 1787 CB LYS A 117 -16.107 0.878 5.733 1.00 0.00 C ATOM 1788 CG LYS A 117 -17.235 0.861 6.750 1.00 0.00 C ATOM 1789 CD LYS A 117 -17.574 -0.556 7.181 1.00 0.00 C ATOM 1790 CE LYS A 117 -18.098 -0.594 8.609 1.00 0.00 C ATOM 1791 NZ LYS A 117 -18.859 -1.843 8.888 1.00 0.00 N ATOM 0 H LYS A 117 -14.152 1.429 4.145 1.00 0.00 H new ATOM 0 HA LYS A 117 -16.298 2.994 5.404 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -16.482 0.505 4.780 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -15.325 0.192 6.058 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -16.949 1.449 7.622 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -18.119 1.334 6.322 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -18.322 -0.973 6.507 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -16.687 -1.184 7.101 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -17.262 -0.515 9.305 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -18.740 0.269 8.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -19.199 -1.830 9.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -19.671 -1.906 8.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -18.239 -2.666 8.747 1.00 0.00 H new ATOM 1805 N HIS A 118 -13.680 1.819 7.066 1.00 0.00 N ATOM 1806 CA HIS A 118 -12.806 2.079 8.205 1.00 0.00 C ATOM 1807 C HIS A 118 -12.210 3.481 8.124 1.00 0.00 C ATOM 1808 O HIS A 118 -12.455 4.320 8.992 1.00 0.00 O ATOM 1809 CB HIS A 118 -11.687 1.038 8.264 1.00 0.00 C ATOM 1810 CG HIS A 118 -12.078 -0.223 8.970 1.00 0.00 C ATOM 1811 ND1 HIS A 118 -11.447 -0.674 10.110 1.00 0.00 N ATOM 1812 CD2 HIS A 118 -13.045 -1.130 8.693 1.00 0.00 C ATOM 1813 CE1 HIS A 118 -12.006 -1.805 10.502 1.00 0.00 C ATOM 1814 NE2 HIS A 118 -12.979 -2.103 9.660 1.00 0.00 N ATOM 0 H HIS A 118 -13.472 0.956 6.563 1.00 0.00 H new ATOM 0 HA HIS A 118 -13.404 2.010 9.114 1.00 0.00 H new ATOM 0 HB2 HIS A 118 -11.375 0.794 7.248 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -10.823 1.473 8.767 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -13.739 -1.095 7.866 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -11.717 -2.387 11.364 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -13.583 -2.923 9.718 1.00 0.00 H new ATOM 1823 N CYS A 119 -11.428 3.726 7.079 1.00 0.00 N ATOM 1824 CA CYS A 119 -10.795 5.026 6.886 1.00 0.00 C ATOM 1825 C CYS A 119 -11.452 5.785 5.738 1.00 0.00 C ATOM 1826 O CYS A 119 -11.210 5.491 4.567 1.00 0.00 O ATOM 1827 CB CYS A 119 -9.301 4.854 6.611 1.00 0.00 C ATOM 1828 SG CYS A 119 -8.289 4.692 8.101 1.00 0.00 S ATOM 0 H CYS A 119 -11.217 3.042 6.352 1.00 0.00 H new ATOM 0 HA CYS A 119 -10.924 5.604 7.801 1.00 0.00 H new ATOM 0 HB2 CYS A 119 -9.156 3.971 5.989 1.00 0.00 H new ATOM 0 HB3 CYS A 119 -8.948 5.710 6.036 1.00 0.00 H new ATOM 0 HG CYS A 119 -7.250 3.955 7.842 1.00 0.00 H new ATOM 1834 N HIS A 120 -12.285 6.762 6.082 1.00 0.00 N ATOM 1835 CA HIS A 120 -12.979 7.563 5.079 1.00 0.00 C ATOM 1836 C HIS A 120 -12.744 9.052 5.316 1.00 0.00 C ATOM 1837 O HIS A 120 -13.527 9.714 5.996 1.00 0.00 O ATOM 1838 CB HIS A 120 -14.477 7.262 5.102 1.00 0.00 C ATOM 1839 CG HIS A 120 -15.262 8.047 4.096 1.00 0.00 C ATOM 1840 ND1 HIS A 120 -16.543 8.501 4.329 1.00 0.00 N ATOM 1841 CD2 HIS A 120 -14.938 8.460 2.848 1.00 0.00 C ATOM 1842 CE1 HIS A 120 -16.974 9.158 3.267 1.00 0.00 C ATOM 1843 NE2 HIS A 120 -16.019 9.148 2.354 1.00 0.00 N ATOM 0 H HIS A 120 -12.496 7.018 7.047 1.00 0.00 H new ATOM 0 HA HIS A 120 -12.579 7.301 4.100 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -14.628 6.198 4.919 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -14.866 7.472 6.098 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -14.004 8.282 2.336 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -17.943 9.624 3.163 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -16.075 9.581 1.432 1.00 0.00 H new ATOM 1852 N GLY A 121 -11.658 9.573 4.750 1.00 0.00 N ATOM 1853 CA GLY A 121 -11.339 10.979 4.912 1.00 0.00 C ATOM 1854 C GLY A 121 -10.126 11.201 5.794 1.00 0.00 C ATOM 1855 O GLY A 121 -10.098 12.129 6.601 1.00 0.00 O ATOM 0 H GLY A 121 -10.994 9.046 4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -11.158 11.422 3.933 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -12.197 11.496 5.343 1.00 0.00 H new ATOM 1859 N ASP A 122 -9.122 10.345 5.640 1.00 0.00 N ATOM 1860 CA ASP A 122 -7.900 10.451 6.429 1.00 0.00 C ATOM 1861 C ASP A 122 -6.714 9.857 5.676 1.00 0.00 C ATOM 1862 O ASP A 122 -6.882 9.205 4.646 1.00 0.00 O ATOM 1863 CB ASP A 122 -8.073 9.744 7.774 1.00 0.00 C ATOM 1864 CG ASP A 122 -9.462 9.930 8.352 1.00 0.00 C ATOM 1865 OD1 ASP A 122 -9.734 11.017 8.903 1.00 0.00 O ATOM 1866 OD2 ASP A 122 -10.277 8.989 8.253 1.00 0.00 O ATOM 0 H ASP A 122 -9.130 9.570 4.976 1.00 0.00 H new ATOM 0 HA ASP A 122 -7.702 11.508 6.606 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -7.874 8.680 7.650 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -7.335 10.126 8.479 1.00 0.00 H new ATOM 1871 N VAL A 123 -5.513 10.087 6.198 1.00 0.00 N ATOM 1872 CA VAL A 123 -4.298 9.574 5.575 1.00 0.00 C ATOM 1873 C VAL A 123 -3.784 8.339 6.308 1.00 0.00 C ATOM 1874 O VAL A 123 -3.000 8.446 7.251 1.00 0.00 O ATOM 1875 CB VAL A 123 -3.187 10.641 5.549 1.00 0.00 C ATOM 1876 CG1 VAL A 123 -3.584 11.803 4.652 1.00 0.00 C ATOM 1877 CG2 VAL A 123 -2.881 11.126 6.959 1.00 0.00 C ATOM 0 H VAL A 123 -5.355 10.625 7.050 1.00 0.00 H new ATOM 0 HA VAL A 123 -4.557 9.304 4.551 1.00 0.00 H new ATOM 0 HB VAL A 123 -2.283 10.190 5.140 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -2.787 12.547 4.646 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -3.749 11.440 3.638 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -4.501 12.257 5.029 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -2.094 11.879 6.922 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.779 11.561 7.397 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -2.550 10.285 7.569 1.00 0.00 H new ATOM 1887 N CYS A 124 -4.231 7.169 5.867 1.00 0.00 N ATOM 1888 CA CYS A 124 -3.817 5.912 6.480 1.00 0.00 C ATOM 1889 C CYS A 124 -3.461 4.879 5.416 1.00 0.00 C ATOM 1890 O CYS A 124 -4.342 4.292 4.788 1.00 0.00 O ATOM 1891 CB CYS A 124 -4.926 5.371 7.383 1.00 0.00 C ATOM 1892 SG CYS A 124 -4.893 6.026 9.068 1.00 0.00 S ATOM 0 H CYS A 124 -4.880 7.064 5.087 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.930 6.106 7.083 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -5.891 5.603 6.933 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -4.847 4.285 7.426 1.00 0.00 H new ATOM 0 HG CYS A 124 -5.870 5.511 9.753 1.00 0.00 H new ATOM 1898 N ILE A 125 -2.165 4.663 5.219 1.00 0.00 N ATOM 1899 CA ILE A 125 -1.693 3.701 4.230 1.00 0.00 C ATOM 1900 C ILE A 125 -1.396 2.351 4.875 1.00 0.00 C ATOM 1901 O ILE A 125 -1.677 1.300 4.297 1.00 0.00 O ATOM 1902 CB ILE A 125 -0.426 4.205 3.515 1.00 0.00 C ATOM 1903 CG1 ILE A 125 -0.702 5.541 2.821 1.00 0.00 C ATOM 1904 CG2 ILE A 125 0.062 3.172 2.510 1.00 0.00 C ATOM 1905 CD1 ILE A 125 -1.670 5.432 1.664 1.00 0.00 C ATOM 0 H ILE A 125 -1.423 5.141 5.731 1.00 0.00 H new ATOM 0 HA ILE A 125 -2.491 3.584 3.497 1.00 0.00 H new ATOM 0 HB ILE A 125 0.356 4.358 4.259 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -1.100 6.245 3.552 1.00 0.00 H new ATOM 0 HG13 ILE A 125 0.239 5.954 2.459 1.00 0.00 H new ATOM 0 HG21 ILE A 125 0.958 3.543 2.013 1.00 0.00 H new ATOM 0 HG22 ILE A 125 0.293 2.241 3.028 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.716 2.991 1.768 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -1.819 6.416 1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -1.265 4.753 0.914 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -2.625 5.048 2.023 1.00 0.00 H new ATOM 1917 N LEU A 126 -0.830 2.387 6.076 1.00 0.00 N ATOM 1918 CA LEU A 126 -0.496 1.166 6.801 1.00 0.00 C ATOM 1919 C LEU A 126 -1.734 0.299 7.005 1.00 0.00 C ATOM 1920 O LEU A 126 -1.665 -0.927 6.929 1.00 0.00 O ATOM 1921 CB LEU A 126 0.129 1.508 8.154 1.00 0.00 C ATOM 1922 CG LEU A 126 1.589 1.962 8.123 1.00 0.00 C ATOM 1923 CD1 LEU A 126 1.913 2.802 9.350 1.00 0.00 C ATOM 1924 CD2 LEU A 126 2.520 0.762 8.036 1.00 0.00 C ATOM 0 H LEU A 126 -0.593 3.248 6.568 1.00 0.00 H new ATOM 0 HA LEU A 126 0.225 0.605 6.206 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.466 2.295 8.618 1.00 0.00 H new ATOM 0 HB3 LEU A 126 0.055 0.631 8.798 1.00 0.00 H new ATOM 0 HG LEU A 126 1.739 2.577 7.236 1.00 0.00 H new ATOM 0 HD11 LEU A 126 2.956 3.116 9.311 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.270 3.682 9.369 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.746 2.211 10.250 1.00 0.00 H new ATOM 0 HD21 LEU A 126 3.554 1.105 8.015 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.368 0.120 8.904 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.305 0.200 7.127 1.00 0.00 H new ATOM 1936 N ASN A 127 -2.867 0.945 7.262 1.00 0.00 N ATOM 1937 CA ASN A 127 -4.122 0.232 7.475 1.00 0.00 C ATOM 1938 C ASN A 127 -4.391 -0.748 6.337 1.00 0.00 C ATOM 1939 O ASN A 127 -4.864 -1.862 6.562 1.00 0.00 O ATOM 1940 CB ASN A 127 -5.281 1.223 7.594 1.00 0.00 C ATOM 1941 CG ASN A 127 -6.595 0.539 7.920 1.00 0.00 C ATOM 1942 OD1 ASN A 127 -7.410 0.283 7.034 1.00 0.00 O ATOM 1943 ND2 ASN A 127 -6.806 0.241 9.196 1.00 0.00 N ATOM 0 H ASN A 127 -2.942 1.960 7.328 1.00 0.00 H new ATOM 0 HA ASN A 127 -4.038 -0.332 8.404 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -5.053 1.954 8.370 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.383 1.773 6.658 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -7.672 -0.219 9.476 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -6.102 0.472 9.897 1.00 0.00 H new ATOM 1950 N ALA A 128 -4.086 -0.325 5.114 1.00 0.00 N ATOM 1951 CA ALA A 128 -4.292 -1.165 3.941 1.00 0.00 C ATOM 1952 C ALA A 128 -3.404 -2.404 3.991 1.00 0.00 C ATOM 1953 O ALA A 128 -3.895 -3.533 4.005 1.00 0.00 O ATOM 1954 CB ALA A 128 -4.026 -0.372 2.671 1.00 0.00 C ATOM 0 H ALA A 128 -3.695 0.595 4.910 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.331 -1.495 3.938 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.184 -1.012 1.803 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.707 0.478 2.624 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -2.997 -0.013 2.675 1.00 0.00 H new ATOM 1960 N THR A 129 -2.093 -2.185 4.016 1.00 0.00 N ATOM 1961 CA THR A 129 -1.136 -3.284 4.061 1.00 0.00 C ATOM 1962 C THR A 129 -1.529 -4.312 5.116 1.00 0.00 C ATOM 1963 O THR A 129 -1.513 -5.515 4.858 1.00 0.00 O ATOM 1964 CB THR A 129 0.287 -2.777 4.360 1.00 0.00 C ATOM 1965 OG1 THR A 129 0.324 -2.150 5.647 1.00 0.00 O ATOM 1966 CG2 THR A 129 0.745 -1.790 3.296 1.00 0.00 C ATOM 0 H THR A 129 -1.670 -1.257 4.006 1.00 0.00 H new ATOM 0 HA THR A 129 -1.147 -3.754 3.078 1.00 0.00 H new ATOM 0 HB THR A 129 0.962 -3.633 4.354 1.00 0.00 H new ATOM 0 HG1 THR A 129 -0.484 -1.609 5.771 1.00 0.00 H new ATOM 0 HG21 THR A 129 1.753 -1.446 3.529 1.00 0.00 H new ATOM 0 HG22 THR A 129 0.744 -2.279 2.322 1.00 0.00 H new ATOM 0 HG23 THR A 129 0.066 -0.937 3.274 1.00 0.00 H new ATOM 1974 N GLU A 130 -1.882 -3.830 6.303 1.00 0.00 N ATOM 1975 CA GLU A 130 -2.279 -4.709 7.397 1.00 0.00 C ATOM 1976 C GLU A 130 -3.510 -5.527 7.018 1.00 0.00 C ATOM 1977 O GLU A 130 -3.699 -6.643 7.501 1.00 0.00 O ATOM 1978 CB GLU A 130 -2.564 -3.892 8.659 1.00 0.00 C ATOM 1979 CG GLU A 130 -1.342 -3.178 9.211 1.00 0.00 C ATOM 1980 CD GLU A 130 -1.539 -2.701 10.637 1.00 0.00 C ATOM 1981 OE1 GLU A 130 -2.701 -2.463 11.027 1.00 0.00 O ATOM 1982 OE2 GLU A 130 -0.532 -2.566 11.363 1.00 0.00 O ATOM 0 H GLU A 130 -1.901 -2.836 6.532 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.456 -5.395 7.595 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -3.336 -3.155 8.438 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -2.966 -4.553 9.427 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -0.485 -3.850 9.172 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -1.107 -2.324 8.576 1.00 0.00 H new ATOM 1989 N TRP A 131 -4.344 -4.962 6.152 1.00 0.00 N ATOM 1990 CA TRP A 131 -5.558 -5.638 5.708 1.00 0.00 C ATOM 1991 C TRP A 131 -5.266 -6.566 4.535 1.00 0.00 C ATOM 1992 O TRP A 131 -6.042 -7.476 4.242 1.00 0.00 O ATOM 1993 CB TRP A 131 -6.621 -4.613 5.311 1.00 0.00 C ATOM 1994 CG TRP A 131 -7.899 -5.236 4.836 1.00 0.00 C ATOM 1995 CD1 TRP A 131 -9.082 -5.299 5.515 1.00 0.00 C ATOM 1996 CD2 TRP A 131 -8.120 -5.885 3.579 1.00 0.00 C ATOM 1997 NE1 TRP A 131 -10.025 -5.948 4.756 1.00 0.00 N ATOM 1998 CE2 TRP A 131 -9.460 -6.317 3.564 1.00 0.00 C ATOM 1999 CE3 TRP A 131 -7.317 -6.141 2.465 1.00 0.00 C ATOM 2000 CZ2 TRP A 131 -10.012 -6.991 2.478 1.00 0.00 C ATOM 2001 CZ3 TRP A 131 -7.866 -6.811 1.388 1.00 0.00 C ATOM 2002 CH2 TRP A 131 -9.203 -7.229 1.400 1.00 0.00 C ATOM 0 H TRP A 131 -4.202 -4.038 5.744 1.00 0.00 H new ATOM 0 HA TRP A 131 -5.934 -6.238 6.537 1.00 0.00 H new ATOM 0 HB2 TRP A 131 -6.834 -3.971 6.166 1.00 0.00 H new ATOM 0 HB3 TRP A 131 -6.222 -3.973 4.524 1.00 0.00 H new ATOM 0 HD1 TRP A 131 -9.251 -4.898 6.503 1.00 0.00 H new ATOM 0 HE1 TRP A 131 -10.990 -6.126 5.035 1.00 0.00 H new ATOM 0 HE3 TRP A 131 -6.286 -5.821 2.446 1.00 0.00 H new ATOM 0 HZ2 TRP A 131 -11.042 -7.315 2.486 1.00 0.00 H new ATOM 0 HZ3 TRP A 131 -7.254 -7.016 0.522 1.00 0.00 H new ATOM 0 HH2 TRP A 131 -9.603 -7.749 0.542 1.00 0.00 H new ATOM 2013 N VAL A 132 -4.142 -6.331 3.865 1.00 0.00 N ATOM 2014 CA VAL A 132 -3.747 -7.148 2.723 1.00 0.00 C ATOM 2015 C VAL A 132 -2.952 -8.370 3.170 1.00 0.00 C ATOM 2016 O VAL A 132 -3.327 -9.506 2.883 1.00 0.00 O ATOM 2017 CB VAL A 132 -2.904 -6.339 1.720 1.00 0.00 C ATOM 2018 CG1 VAL A 132 -2.272 -7.261 0.688 1.00 0.00 C ATOM 2019 CG2 VAL A 132 -3.756 -5.275 1.045 1.00 0.00 C ATOM 0 H VAL A 132 -3.489 -5.582 4.093 1.00 0.00 H new ATOM 0 HA VAL A 132 -4.665 -7.475 2.234 1.00 0.00 H new ATOM 0 HB VAL A 132 -2.103 -5.839 2.265 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -1.680 -6.672 -0.012 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.628 -7.982 1.191 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -3.055 -7.791 0.145 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -3.144 -4.713 0.339 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -4.579 -5.752 0.512 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -4.156 -4.597 1.799 1.00 0.00 H new ATOM 2029 N ARG A 133 -1.852 -8.127 3.875 1.00 0.00 N ATOM 2030 CA ARG A 133 -1.002 -9.207 4.362 1.00 0.00 C ATOM 2031 C ARG A 133 -1.844 -10.353 4.916 1.00 0.00 C ATOM 2032 O ARG A 133 -1.437 -11.514 4.869 1.00 0.00 O ATOM 2033 CB ARG A 133 -0.051 -8.690 5.443 1.00 0.00 C ATOM 2034 CG ARG A 133 -0.728 -8.438 6.780 1.00 0.00 C ATOM 2035 CD ARG A 133 0.250 -8.580 7.935 1.00 0.00 C ATOM 2036 NE ARG A 133 -0.432 -8.818 9.204 1.00 0.00 N ATOM 2037 CZ ARG A 133 -0.904 -7.848 9.978 1.00 0.00 C ATOM 2038 NH1 ARG A 133 -0.770 -6.580 9.614 1.00 0.00 N ATOM 2039 NH2 ARG A 133 -1.514 -8.144 11.119 1.00 0.00 N ATOM 0 H ARG A 133 -1.528 -7.192 4.122 1.00 0.00 H new ATOM 0 HA ARG A 133 -0.416 -9.581 3.522 1.00 0.00 H new ATOM 0 HB2 ARG A 133 0.753 -9.412 5.583 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.409 -7.764 5.098 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -1.159 -7.437 6.788 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -1.551 -9.140 6.910 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.934 -9.404 7.731 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.854 -7.676 8.012 1.00 0.00 H new ATOM 0 HE ARG A 133 -0.552 -9.783 9.513 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -0.303 -6.348 8.737 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -1.134 -5.837 10.211 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -1.621 -9.118 11.402 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -1.876 -7.397 11.712 1.00 0.00 H new ATOM 2053 N GLU A 134 -3.018 -10.018 5.441 1.00 0.00 N ATOM 2054 CA GLU A 134 -3.916 -11.019 6.005 1.00 0.00 C ATOM 2055 C GLU A 134 -4.845 -11.583 4.933 1.00 0.00 C ATOM 2056 O GLU A 134 -4.748 -12.754 4.565 1.00 0.00 O ATOM 2057 CB GLU A 134 -4.740 -10.414 7.143 1.00 0.00 C ATOM 2058 CG GLU A 134 -5.136 -11.420 8.210 1.00 0.00 C ATOM 2059 CD GLU A 134 -6.389 -12.194 7.846 1.00 0.00 C ATOM 2060 OE1 GLU A 134 -7.416 -11.551 7.545 1.00 0.00 O ATOM 2061 OE2 GLU A 134 -6.342 -13.442 7.863 1.00 0.00 O ATOM 0 H GLU A 134 -3.370 -9.062 5.488 1.00 0.00 H new ATOM 0 HA GLU A 134 -3.308 -11.833 6.399 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -4.168 -9.611 7.607 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -5.642 -9.964 6.728 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -4.315 -12.119 8.368 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -5.297 -10.899 9.154 1.00 0.00 H new ATOM 2068 N HIS A 135 -5.746 -10.741 4.437 1.00 0.00 N ATOM 2069 CA HIS A 135 -6.693 -11.154 3.407 1.00 0.00 C ATOM 2070 C HIS A 135 -5.982 -11.905 2.286 1.00 0.00 C ATOM 2071 O HIS A 135 -6.373 -13.015 1.925 1.00 0.00 O ATOM 2072 CB HIS A 135 -7.423 -9.937 2.839 1.00 0.00 C ATOM 2073 CG HIS A 135 -8.672 -9.585 3.586 1.00 0.00 C ATOM 2074 ND1 HIS A 135 -9.920 -10.052 3.230 1.00 0.00 N ATOM 2075 CD2 HIS A 135 -8.861 -8.807 4.678 1.00 0.00 C ATOM 2076 CE1 HIS A 135 -10.822 -9.575 4.070 1.00 0.00 C ATOM 2077 NE2 HIS A 135 -10.205 -8.818 4.958 1.00 0.00 N ATOM 0 H HIS A 135 -5.840 -9.769 4.731 1.00 0.00 H new ATOM 0 HA HIS A 135 -7.421 -11.824 3.864 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -6.749 -9.081 2.851 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -7.675 -10.129 1.796 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -8.097 -8.277 5.227 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -11.883 -9.771 4.036 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -10.654 -8.322 5.728 1.00 0.00 H new ATOM 2086 N ALA A 136 -4.937 -11.293 1.738 1.00 0.00 N ATOM 2087 CA ALA A 136 -4.172 -11.904 0.659 1.00 0.00 C ATOM 2088 C ALA A 136 -4.116 -13.420 0.816 1.00 0.00 C ATOM 2089 O ALA A 136 -4.720 -14.157 0.038 1.00 0.00 O ATOM 2090 CB ALA A 136 -2.766 -11.324 0.614 1.00 0.00 C ATOM 0 H ALA A 136 -4.601 -10.373 2.024 1.00 0.00 H new ATOM 0 HA ALA A 136 -4.675 -11.680 -0.282 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -2.206 -11.790 -0.197 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -2.821 -10.248 0.446 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -2.262 -11.518 1.561 1.00 0.00 H new ATOM 2096 N SER A 137 -3.386 -13.879 1.828 1.00 0.00 N ATOM 2097 CA SER A 137 -3.248 -15.308 2.085 1.00 0.00 C ATOM 2098 C SER A 137 -4.570 -16.032 1.851 1.00 0.00 C ATOM 2099 O SER A 137 -4.596 -17.153 1.344 1.00 0.00 O ATOM 2100 CB SER A 137 -2.769 -15.546 3.518 1.00 0.00 C ATOM 2101 OG SER A 137 -3.819 -15.341 4.447 1.00 0.00 O ATOM 0 H SER A 137 -2.881 -13.282 2.483 1.00 0.00 H new ATOM 0 HA SER A 137 -2.508 -15.707 1.392 1.00 0.00 H new ATOM 0 HB2 SER A 137 -2.388 -16.563 3.613 1.00 0.00 H new ATOM 0 HB3 SER A 137 -1.942 -14.873 3.745 1.00 0.00 H new ATOM 0 HG SER A 137 -4.156 -14.425 4.363 1.00 0.00 H new ATOM 2107 N GLY A 138 -5.668 -15.382 2.225 1.00 0.00 N ATOM 2108 CA GLY A 138 -6.979 -15.979 2.049 1.00 0.00 C ATOM 2109 C GLY A 138 -7.302 -16.251 0.593 1.00 0.00 C ATOM 2110 O GLY A 138 -7.552 -17.393 0.208 1.00 0.00 O ATOM 0 H GLY A 138 -5.673 -14.453 2.646 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.028 -16.913 2.609 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -7.736 -15.316 2.468 1.00 0.00 H new ATOM 2114 N TYR A 139 -7.297 -15.199 -0.219 1.00 0.00 N ATOM 2115 CA TYR A 139 -7.595 -15.330 -1.640 1.00 0.00 C ATOM 2116 C TYR A 139 -6.710 -16.391 -2.287 1.00 0.00 C ATOM 2117 O TYR A 139 -7.181 -17.214 -3.072 1.00 0.00 O ATOM 2118 CB TYR A 139 -7.403 -13.987 -2.348 1.00 0.00 C ATOM 2119 CG TYR A 139 -8.418 -12.941 -1.948 1.00 0.00 C ATOM 2120 CD1 TYR A 139 -9.697 -12.942 -2.491 1.00 0.00 C ATOM 2121 CD2 TYR A 139 -8.098 -11.950 -1.028 1.00 0.00 C ATOM 2122 CE1 TYR A 139 -10.627 -11.987 -2.130 1.00 0.00 C ATOM 2123 CE2 TYR A 139 -9.022 -10.992 -0.660 1.00 0.00 C ATOM 2124 CZ TYR A 139 -10.286 -11.015 -1.213 1.00 0.00 C ATOM 2125 OH TYR A 139 -11.209 -10.061 -0.850 1.00 0.00 O ATOM 0 H TYR A 139 -7.090 -14.247 0.083 1.00 0.00 H new ATOM 0 HA TYR A 139 -8.635 -15.641 -1.741 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -6.403 -13.612 -2.132 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -7.459 -14.143 -3.425 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -9.969 -13.703 -3.208 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -7.110 -11.929 -0.593 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -11.616 -12.001 -2.564 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -8.757 -10.229 0.057 1.00 0.00 H new ATOM 0 HH TYR A 139 -12.060 -10.495 -0.634 1.00 0.00 H new ATOM 2135 N VAL A 140 -5.424 -16.364 -1.952 1.00 0.00 N ATOM 2136 CA VAL A 140 -4.472 -17.324 -2.498 1.00 0.00 C ATOM 2137 C VAL A 140 -4.942 -18.756 -2.268 1.00 0.00 C ATOM 2138 O VAL A 140 -5.104 -19.192 -1.128 1.00 0.00 O ATOM 2139 CB VAL A 140 -3.076 -17.147 -1.872 1.00 0.00 C ATOM 2140 CG1 VAL A 140 -2.101 -18.164 -2.445 1.00 0.00 C ATOM 2141 CG2 VAL A 140 -2.570 -15.729 -2.093 1.00 0.00 C ATOM 0 H VAL A 140 -5.018 -15.688 -1.305 1.00 0.00 H new ATOM 0 HA VAL A 140 -4.409 -17.133 -3.569 1.00 0.00 H new ATOM 0 HB VAL A 140 -3.154 -17.318 -0.798 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -1.120 -18.024 -1.991 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -2.459 -19.171 -2.232 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -2.024 -18.027 -3.524 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -1.582 -15.621 -1.644 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -2.507 -15.528 -3.162 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -3.258 -15.021 -1.631 1.00 0.00 H new