USER MOD reduce.3.24.130724 H: found=0, std=0, add=990, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1004 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 123 ASN : amide:sc= -0.422 K(o=-0.44,f=-1.8) USER MOD Set 1.2: A 125 ASN : amide:sc= -0.0213 K(o=-0.44,f=-1.6) USER MOD Set 1.3: A 126 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 33 HIS : no HD1:sc= -6.78! C(o=-6.8!,f=-13!) USER MOD Set 2.2: A 35 SER OG : rot -76:sc= -0.0013 USER MOD Set 3.1: A 7 TYR OH : rot 30:sc= -1.9! USER MOD Set 3.2: A 38 LYS NZ :NH3+ 155:sc= -2.65! (180deg=-4.51!) USER MOD Single : A 5 ASN : amide:sc= -5.88! C(o=-5.9!,f=-5.8!) USER MOD Single : A 6 TYR OH : rot 165:sc= -0.2 USER MOD Single : A 9 SER OG : rot -140:sc= -1.55! USER MOD Single : A 11 SER OG : rot 180:sc=0.000364 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -40:sc= 1.23 USER MOD Single : A 17 SER OG : rot 69:sc= 0.0924 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -4.49! C(o=-4.5!,f=-8.2!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.0339 USER MOD Single : A 67 CYS SG : rot -50:sc= -9.08! USER MOD Single : A 70 TYR OH : rot -29:sc= 0.0582 USER MOD Single : A 72 ASN : amide:sc= -4.3! C(o=-4.3!,f=-8.2!) USER MOD Single : A 75 ASN : amide:sc= -0.221 X(o=-0.22,f=0) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -0.147 X(o=-0.15,f=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 CYS SG : rot -93:sc= -1.15! USER MOD Single : A 93 ASN : amide:sc= -3.41 K(o=-3.4,f=-6.6!) USER MOD Single : A 94 CYS SG : rot 180:sc= -0.29 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.17) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 HIS : no HE2:sc= -5.41! C(o=-5.4!,f=-6.4!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot 180:sc= -0.314 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 TYR OH : rot -93:sc= -2.52! USER MOD Single : A 143 ASN : amide:sc= -11.3! C(o=-11!,f=-12!) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 38 N GLU A 4 11.892 -1.096 -14.599 1.00 0.00 N ATOM 39 CA GLU A 4 12.828 0.004 -14.805 1.00 0.00 C ATOM 40 C GLU A 4 12.491 1.192 -13.908 1.00 0.00 C ATOM 41 O GLU A 4 13.382 1.855 -13.378 1.00 0.00 O ATOM 42 CB GLU A 4 12.817 0.441 -16.270 1.00 0.00 C ATOM 43 CG GLU A 4 13.434 -0.578 -17.214 1.00 0.00 C ATOM 44 CD GLU A 4 14.936 -0.697 -17.044 1.00 0.00 C ATOM 45 OE1 GLU A 4 15.502 -1.728 -17.463 1.00 0.00 O ATOM 46 OE2 GLU A 4 15.548 0.244 -16.494 1.00 0.00 O ATOM 0 HA GLU A 4 13.824 -0.351 -14.542 1.00 0.00 H new ATOM 0 HB2 GLU A 4 11.788 0.631 -16.576 1.00 0.00 H new ATOM 0 HB3 GLU A 4 13.356 1.384 -16.363 1.00 0.00 H new ATOM 0 HG2 GLU A 4 12.975 -1.551 -17.042 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.210 -0.297 -18.243 1.00 0.00 H new ATOM 54 N ASN A 5 11.199 1.463 -13.753 1.00 0.00 N ATOM 55 CA ASN A 5 10.741 2.579 -12.930 1.00 0.00 C ATOM 56 C ASN A 5 10.506 2.145 -11.485 1.00 0.00 C ATOM 57 O ASN A 5 9.905 2.877 -10.700 1.00 0.00 O ATOM 58 CB ASN A 5 9.454 3.168 -13.511 1.00 0.00 C ATOM 59 CG ASN A 5 9.694 3.900 -14.817 1.00 0.00 C ATOM 60 OD1 ASN A 5 10.817 4.301 -15.121 1.00 0.00 O ATOM 61 ND2 ASN A 5 8.635 4.080 -15.597 1.00 0.00 N ATOM 0 H ASN A 5 10.449 0.925 -14.187 1.00 0.00 H new ATOM 0 HA ASN A 5 11.522 3.339 -12.933 1.00 0.00 H new ATOM 0 HB2 ASN A 5 8.732 2.368 -13.673 1.00 0.00 H new ATOM 0 HB3 ASN A 5 9.013 3.854 -12.788 1.00 0.00 H new ATOM 0 HD21 ASN A 5 8.734 4.567 -16.488 1.00 0.00 H new ATOM 0 HD22 ASN A 5 7.722 3.731 -15.306 1.00 0.00 H new ATOM 68 N TYR A 6 10.973 0.949 -11.143 1.00 0.00 N ATOM 69 CA TYR A 6 10.797 0.422 -9.797 1.00 0.00 C ATOM 70 C TYR A 6 12.047 0.655 -8.953 1.00 0.00 C ATOM 71 O TYR A 6 13.155 0.297 -9.351 1.00 0.00 O ATOM 72 CB TYR A 6 10.485 -1.071 -9.859 1.00 0.00 C ATOM 73 CG TYR A 6 9.658 -1.567 -8.700 1.00 0.00 C ATOM 74 CD1 TYR A 6 8.272 -1.564 -8.769 1.00 0.00 C ATOM 75 CD2 TYR A 6 10.256 -2.036 -7.539 1.00 0.00 C ATOM 76 CE1 TYR A 6 7.503 -2.013 -7.714 1.00 0.00 C ATOM 77 CE2 TYR A 6 9.496 -2.489 -6.479 1.00 0.00 C ATOM 78 CZ TYR A 6 8.120 -2.475 -6.571 1.00 0.00 C ATOM 79 OH TYR A 6 7.358 -2.925 -5.517 1.00 0.00 O ATOM 0 H TYR A 6 11.475 0.329 -11.778 1.00 0.00 H new ATOM 0 HA TYR A 6 9.964 0.947 -9.330 1.00 0.00 H new ATOM 0 HB2 TYR A 6 9.957 -1.284 -10.788 1.00 0.00 H new ATOM 0 HB3 TYR A 6 11.422 -1.628 -9.890 1.00 0.00 H new ATOM 0 HD1 TYR A 6 7.786 -1.204 -9.664 1.00 0.00 H new ATOM 0 HD2 TYR A 6 11.333 -2.047 -7.463 1.00 0.00 H new ATOM 0 HE1 TYR A 6 6.425 -2.002 -7.784 1.00 0.00 H new ATOM 0 HE2 TYR A 6 9.976 -2.852 -5.583 1.00 0.00 H new ATOM 0 HH TYR A 6 7.924 -3.431 -4.897 1.00 0.00 H new ATOM 89 N TYR A 7 11.859 1.263 -7.784 1.00 0.00 N ATOM 90 CA TYR A 7 12.970 1.549 -6.882 1.00 0.00 C ATOM 91 C TYR A 7 12.579 1.268 -5.431 1.00 0.00 C ATOM 92 O TYR A 7 11.397 1.257 -5.088 1.00 0.00 O ATOM 93 CB TYR A 7 13.412 3.006 -7.031 1.00 0.00 C ATOM 94 CG TYR A 7 12.366 4.005 -6.590 1.00 0.00 C ATOM 95 CD1 TYR A 7 11.424 4.498 -7.484 1.00 0.00 C ATOM 96 CD2 TYR A 7 12.316 4.448 -5.275 1.00 0.00 C ATOM 97 CE1 TYR A 7 10.465 5.407 -7.081 1.00 0.00 C ATOM 98 CE2 TYR A 7 11.361 5.355 -4.863 1.00 0.00 C ATOM 99 CZ TYR A 7 10.436 5.830 -5.769 1.00 0.00 C ATOM 100 OH TYR A 7 9.482 6.734 -5.362 1.00 0.00 O ATOM 0 H TYR A 7 10.948 1.567 -7.440 1.00 0.00 H new ATOM 0 HA TYR A 7 13.801 0.896 -7.149 1.00 0.00 H new ATOM 0 HB2 TYR A 7 14.320 3.163 -6.449 1.00 0.00 H new ATOM 0 HB3 TYR A 7 13.666 3.195 -8.074 1.00 0.00 H new ATOM 0 HD1 TYR A 7 11.442 4.165 -8.511 1.00 0.00 H new ATOM 0 HD2 TYR A 7 13.037 4.076 -4.562 1.00 0.00 H new ATOM 0 HE1 TYR A 7 9.742 5.784 -7.789 1.00 0.00 H new ATOM 0 HE2 TYR A 7 11.338 5.691 -3.837 1.00 0.00 H new ATOM 0 HH TYR A 7 8.672 6.620 -5.902 1.00 0.00 H new ATOM 110 N ILE A 8 13.580 1.041 -4.584 1.00 0.00 N ATOM 111 CA ILE A 8 13.334 0.760 -3.173 1.00 0.00 C ATOM 112 C ILE A 8 14.209 1.641 -2.274 1.00 0.00 C ATOM 113 O ILE A 8 15.410 1.805 -2.522 1.00 0.00 O ATOM 114 CB ILE A 8 13.586 -0.723 -2.840 1.00 0.00 C ATOM 115 CG1 ILE A 8 12.864 -1.625 -3.840 1.00 0.00 C ATOM 116 CG2 ILE A 8 13.123 -1.034 -1.424 1.00 0.00 C ATOM 117 CD1 ILE A 8 11.365 -1.428 -3.858 1.00 0.00 C ATOM 0 H ILE A 8 14.565 1.046 -4.849 1.00 0.00 H new ATOM 0 HA ILE A 8 12.285 0.987 -2.982 1.00 0.00 H new ATOM 0 HB ILE A 8 14.657 -0.914 -2.908 1.00 0.00 H new ATOM 0 HG12 ILE A 8 13.259 -1.436 -4.838 1.00 0.00 H new ATOM 0 HG13 ILE A 8 13.083 -2.666 -3.602 1.00 0.00 H new ATOM 0 HG21 ILE A 8 13.308 -2.085 -1.204 1.00 0.00 H new ATOM 0 HG22 ILE A 8 13.673 -0.413 -0.717 1.00 0.00 H new ATOM 0 HG23 ILE A 8 12.057 -0.827 -1.336 1.00 0.00 H new ATOM 0 HD11 ILE A 8 10.918 -2.100 -4.590 1.00 0.00 H new ATOM 0 HD12 ILE A 8 10.958 -1.645 -2.871 1.00 0.00 H new ATOM 0 HD13 ILE A 8 11.137 -0.396 -4.126 1.00 0.00 H new ATOM 129 N SER A 9 13.588 2.208 -1.234 1.00 0.00 N ATOM 130 CA SER A 9 14.269 3.089 -0.253 1.00 0.00 C ATOM 131 C SER A 9 14.771 2.303 0.995 1.00 0.00 C ATOM 132 O SER A 9 14.187 2.462 2.074 1.00 0.00 O ATOM 133 CB SER A 9 13.338 4.219 0.186 1.00 0.00 C ATOM 134 OG SER A 9 13.351 5.286 -0.751 1.00 0.00 O ATOM 0 H SER A 9 12.596 2.074 -1.040 1.00 0.00 H new ATOM 0 HA SER A 9 15.142 3.509 -0.753 1.00 0.00 H new ATOM 0 HB2 SER A 9 12.323 3.837 0.293 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.645 4.587 1.165 1.00 0.00 H new ATOM 0 HG SER A 9 13.336 6.141 -0.273 1.00 0.00 H new ATOM 140 N PRO A 10 15.746 1.371 0.878 1.00 0.00 N ATOM 141 CA PRO A 10 16.517 1.077 -0.316 1.00 0.00 C ATOM 142 C PRO A 10 16.343 -0.356 -0.822 1.00 0.00 C ATOM 143 O PRO A 10 15.583 -1.141 -0.258 1.00 0.00 O ATOM 144 CB PRO A 10 17.915 1.218 0.267 1.00 0.00 C ATOM 145 CG PRO A 10 17.789 0.640 1.658 1.00 0.00 C ATOM 146 CD PRO A 10 16.305 0.597 1.985 1.00 0.00 C ATOM 0 HA PRO A 10 16.250 1.702 -1.168 1.00 0.00 H new ATOM 0 HB2 PRO A 10 18.652 0.676 -0.326 1.00 0.00 H new ATOM 0 HB3 PRO A 10 18.233 2.260 0.295 1.00 0.00 H new ATOM 0 HG2 PRO A 10 18.223 -0.359 1.702 1.00 0.00 H new ATOM 0 HG3 PRO A 10 18.326 1.253 2.381 1.00 0.00 H new ATOM 0 HD2 PRO A 10 15.919 -0.422 2.010 1.00 0.00 H new ATOM 0 HD3 PRO A 10 16.084 1.046 2.953 1.00 0.00 H new ATOM 154 N SER A 11 17.056 -0.679 -1.907 1.00 0.00 N ATOM 155 CA SER A 11 16.995 -2.006 -2.528 1.00 0.00 C ATOM 156 C SER A 11 17.031 -3.129 -1.491 1.00 0.00 C ATOM 157 O SER A 11 17.330 -2.902 -0.318 1.00 0.00 O ATOM 158 CB SER A 11 18.154 -2.178 -3.512 1.00 0.00 C ATOM 159 OG SER A 11 18.215 -1.095 -4.424 1.00 0.00 O ATOM 0 H SER A 11 17.688 -0.031 -2.377 1.00 0.00 H new ATOM 0 HA SER A 11 16.045 -2.073 -3.058 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.093 -2.249 -2.963 1.00 0.00 H new ATOM 0 HB3 SER A 11 18.034 -3.113 -4.060 1.00 0.00 H new ATOM 0 HG SER A 11 18.965 -1.228 -5.041 1.00 0.00 H new ATOM 165 N LEU A 12 16.702 -4.339 -1.931 1.00 0.00 N ATOM 166 CA LEU A 12 16.673 -5.492 -1.040 1.00 0.00 C ATOM 167 C LEU A 12 18.037 -5.741 -0.406 1.00 0.00 C ATOM 168 O LEU A 12 18.128 -6.060 0.780 1.00 0.00 O ATOM 169 CB LEU A 12 16.225 -6.733 -1.811 1.00 0.00 C ATOM 170 CG LEU A 12 14.762 -6.733 -2.264 1.00 0.00 C ATOM 171 CD1 LEU A 12 13.834 -6.399 -1.106 1.00 0.00 C ATOM 172 CD2 LEU A 12 14.561 -5.753 -3.409 1.00 0.00 C ATOM 0 H LEU A 12 16.452 -4.546 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 12 15.963 -5.281 -0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 12 16.860 -6.842 -2.690 1.00 0.00 H new ATOM 0 HB3 LEU A 12 16.394 -7.609 -1.185 1.00 0.00 H new ATOM 0 HG LEU A 12 14.515 -7.735 -2.616 1.00 0.00 H new ATOM 0 HD11 LEU A 12 12.801 -6.405 -1.454 1.00 0.00 H new ATOM 0 HD12 LEU A 12 13.956 -7.141 -0.317 1.00 0.00 H new ATOM 0 HD13 LEU A 12 14.079 -5.411 -0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 12 13.516 -5.765 -3.719 1.00 0.00 H new ATOM 0 HD22 LEU A 12 14.830 -4.749 -3.080 1.00 0.00 H new ATOM 0 HD23 LEU A 12 15.192 -6.041 -4.250 1.00 0.00 H new ATOM 184 N ASP A 13 19.098 -5.596 -1.194 1.00 0.00 N ATOM 185 CA ASP A 13 20.445 -5.807 -0.683 1.00 0.00 C ATOM 186 C ASP A 13 20.832 -4.707 0.299 1.00 0.00 C ATOM 187 O ASP A 13 21.417 -4.975 1.350 1.00 0.00 O ATOM 188 CB ASP A 13 21.450 -5.857 -1.837 1.00 0.00 C ATOM 189 CG ASP A 13 21.306 -7.110 -2.678 1.00 0.00 C ATOM 190 OD1 ASP A 13 20.725 -8.098 -2.180 1.00 0.00 O ATOM 191 OD2 ASP A 13 21.775 -7.106 -3.837 1.00 0.00 O ATOM 0 H ASP A 13 19.051 -5.336 -2.179 1.00 0.00 H new ATOM 0 HA ASP A 13 20.462 -6.761 -0.156 1.00 0.00 H new ATOM 0 HB2 ASP A 13 21.315 -4.980 -2.471 1.00 0.00 H new ATOM 0 HB3 ASP A 13 22.462 -5.807 -1.436 1.00 0.00 H new ATOM 197 N THR A 14 20.498 -3.468 -0.047 1.00 0.00 N ATOM 198 CA THR A 14 20.801 -2.325 0.808 1.00 0.00 C ATOM 199 C THR A 14 20.122 -2.472 2.169 1.00 0.00 C ATOM 200 O THR A 14 20.700 -2.146 3.206 1.00 0.00 O ATOM 201 CB THR A 14 20.371 -1.019 0.134 1.00 0.00 C ATOM 202 OG1 THR A 14 21.038 -0.855 -1.104 1.00 0.00 O ATOM 203 CG2 THR A 14 20.667 0.211 0.965 1.00 0.00 C ATOM 0 H THR A 14 20.017 -3.229 -0.914 1.00 0.00 H new ATOM 0 HA THR A 14 21.879 -2.294 0.965 1.00 0.00 H new ATOM 0 HB THR A 14 19.292 -1.105 0.003 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.750 -0.017 -1.522 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.337 1.101 0.428 1.00 0.00 H new ATOM 0 HG22 THR A 14 20.138 0.144 1.916 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.739 0.276 1.150 1.00 0.00 H new ATOM 211 N LEU A 15 18.879 -2.947 2.150 1.00 0.00 N ATOM 212 CA LEU A 15 18.100 -3.131 3.373 1.00 0.00 C ATOM 213 C LEU A 15 18.774 -4.113 4.327 1.00 0.00 C ATOM 214 O LEU A 15 18.779 -3.910 5.541 1.00 0.00 O ATOM 215 CB LEU A 15 16.695 -3.625 3.029 1.00 0.00 C ATOM 216 CG LEU A 15 15.778 -3.853 4.231 1.00 0.00 C ATOM 217 CD1 LEU A 15 15.505 -2.541 4.948 1.00 0.00 C ATOM 218 CD2 LEU A 15 14.475 -4.504 3.790 1.00 0.00 C ATOM 0 H LEU A 15 18.387 -3.213 1.297 1.00 0.00 H new ATOM 0 HA LEU A 15 18.036 -2.165 3.874 1.00 0.00 H new ATOM 0 HB2 LEU A 15 16.224 -2.901 2.364 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.780 -4.559 2.474 1.00 0.00 H new ATOM 0 HG LEU A 15 16.280 -4.526 4.926 1.00 0.00 H new ATOM 0 HD11 LEU A 15 14.851 -2.722 5.801 1.00 0.00 H new ATOM 0 HD12 LEU A 15 16.446 -2.114 5.296 1.00 0.00 H new ATOM 0 HD13 LEU A 15 15.023 -1.845 4.262 1.00 0.00 H new ATOM 0 HD21 LEU A 15 13.834 -4.659 4.658 1.00 0.00 H new ATOM 0 HD22 LEU A 15 13.968 -3.856 3.076 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.689 -5.464 3.320 1.00 0.00 H new ATOM 230 N SER A 16 19.330 -5.183 3.771 1.00 0.00 N ATOM 231 CA SER A 16 19.998 -6.202 4.574 1.00 0.00 C ATOM 232 C SER A 16 21.285 -5.663 5.193 1.00 0.00 C ATOM 233 O SER A 16 21.792 -6.216 6.169 1.00 0.00 O ATOM 234 CB SER A 16 20.303 -7.435 3.722 1.00 0.00 C ATOM 235 OG SER A 16 21.319 -7.161 2.772 1.00 0.00 O ATOM 0 H SER A 16 19.332 -5.368 2.768 1.00 0.00 H new ATOM 0 HA SER A 16 19.324 -6.485 5.383 1.00 0.00 H new ATOM 0 HB2 SER A 16 20.615 -8.257 4.366 1.00 0.00 H new ATOM 0 HB3 SER A 16 19.398 -7.758 3.208 1.00 0.00 H new ATOM 0 HG SER A 16 21.181 -6.267 2.394 1.00 0.00 H new ATOM 241 N SER A 17 21.807 -4.582 4.624 1.00 0.00 N ATOM 242 CA SER A 17 23.033 -3.971 5.128 1.00 0.00 C ATOM 243 C SER A 17 22.749 -3.107 6.359 1.00 0.00 C ATOM 244 O SER A 17 23.658 -2.510 6.935 1.00 0.00 O ATOM 245 CB SER A 17 23.691 -3.123 4.038 1.00 0.00 C ATOM 246 OG SER A 17 24.020 -3.911 2.907 1.00 0.00 O ATOM 0 H SER A 17 21.402 -4.111 3.815 1.00 0.00 H new ATOM 0 HA SER A 17 23.714 -4.772 5.418 1.00 0.00 H new ATOM 0 HB2 SER A 17 23.017 -2.320 3.741 1.00 0.00 H new ATOM 0 HB3 SER A 17 24.592 -2.654 4.433 1.00 0.00 H new ATOM 0 HG SER A 17 23.198 -4.199 2.459 1.00 0.00 H new ATOM 252 N TYR A 18 21.480 -3.053 6.755 1.00 0.00 N ATOM 253 CA TYR A 18 21.063 -2.272 7.914 1.00 0.00 C ATOM 254 C TYR A 18 21.476 -2.947 9.213 1.00 0.00 C ATOM 255 O TYR A 18 21.729 -4.151 9.253 1.00 0.00 O ATOM 256 CB TYR A 18 19.542 -2.080 7.915 1.00 0.00 C ATOM 257 CG TYR A 18 19.040 -0.893 7.113 1.00 0.00 C ATOM 258 CD1 TYR A 18 19.909 -0.046 6.432 1.00 0.00 C ATOM 259 CD2 TYR A 18 17.680 -0.624 7.046 1.00 0.00 C ATOM 260 CE1 TYR A 18 19.433 1.033 5.712 1.00 0.00 C ATOM 261 CE2 TYR A 18 17.198 0.451 6.329 1.00 0.00 C ATOM 262 CZ TYR A 18 18.078 1.278 5.663 1.00 0.00 C ATOM 263 OH TYR A 18 17.601 2.350 4.945 1.00 0.00 O ATOM 0 H TYR A 18 20.719 -3.545 6.286 1.00 0.00 H new ATOM 0 HA TYR A 18 21.556 -1.302 7.846 1.00 0.00 H new ATOM 0 HB2 TYR A 18 19.077 -2.985 7.524 1.00 0.00 H new ATOM 0 HB3 TYR A 18 19.206 -1.970 8.946 1.00 0.00 H new ATOM 0 HD1 TYR A 18 20.972 -0.235 6.467 1.00 0.00 H new ATOM 0 HD2 TYR A 18 16.986 -1.269 7.565 1.00 0.00 H new ATOM 0 HE1 TYR A 18 20.120 1.682 5.190 1.00 0.00 H new ATOM 0 HE2 TYR A 18 16.136 0.644 6.289 1.00 0.00 H new ATOM 0 HH TYR A 18 16.624 2.380 5.012 1.00 0.00 H new ATOM 273 N SER A 19 21.522 -2.159 10.279 1.00 0.00 N ATOM 274 CA SER A 19 21.881 -2.674 11.592 1.00 0.00 C ATOM 275 C SER A 19 20.763 -3.567 12.115 1.00 0.00 C ATOM 276 O SER A 19 19.729 -3.717 11.465 1.00 0.00 O ATOM 277 CB SER A 19 22.137 -1.524 12.568 1.00 0.00 C ATOM 278 OG SER A 19 23.195 -0.696 12.116 1.00 0.00 O ATOM 0 H SER A 19 21.315 -1.160 10.259 1.00 0.00 H new ATOM 0 HA SER A 19 22.797 -3.259 11.503 1.00 0.00 H new ATOM 0 HB2 SER A 19 21.230 -0.931 12.681 1.00 0.00 H new ATOM 0 HB3 SER A 19 22.380 -1.925 13.552 1.00 0.00 H new ATOM 0 HG SER A 19 23.337 0.032 12.757 1.00 0.00 H new ATOM 284 N LEU A 20 20.967 -4.169 13.282 1.00 0.00 N ATOM 285 CA LEU A 20 19.959 -5.054 13.856 1.00 0.00 C ATOM 286 C LEU A 20 18.649 -4.305 14.086 1.00 0.00 C ATOM 287 O LEU A 20 17.582 -4.764 13.677 1.00 0.00 O ATOM 288 CB LEU A 20 20.460 -5.644 15.175 1.00 0.00 C ATOM 289 CG LEU A 20 19.483 -6.588 15.876 1.00 0.00 C ATOM 290 CD1 LEU A 20 19.161 -7.778 14.986 1.00 0.00 C ATOM 291 CD2 LEU A 20 20.054 -7.054 17.207 1.00 0.00 C ATOM 0 H LEU A 20 21.811 -4.062 13.844 1.00 0.00 H new ATOM 0 HA LEU A 20 19.776 -5.864 13.150 1.00 0.00 H new ATOM 0 HB2 LEU A 20 21.388 -6.183 14.985 1.00 0.00 H new ATOM 0 HB3 LEU A 20 20.700 -4.825 15.853 1.00 0.00 H new ATOM 0 HG LEU A 20 18.558 -6.045 16.071 1.00 0.00 H new ATOM 0 HD11 LEU A 20 18.464 -8.439 15.501 1.00 0.00 H new ATOM 0 HD12 LEU A 20 18.710 -7.427 14.058 1.00 0.00 H new ATOM 0 HD13 LEU A 20 20.078 -8.322 14.760 1.00 0.00 H new ATOM 0 HD21 LEU A 20 19.345 -7.725 17.692 1.00 0.00 H new ATOM 0 HD22 LEU A 20 20.993 -7.580 17.036 1.00 0.00 H new ATOM 0 HD23 LEU A 20 20.233 -6.191 17.848 1.00 0.00 H new ATOM 303 N LEU A 21 18.736 -3.145 14.727 1.00 0.00 N ATOM 304 CA LEU A 21 17.554 -2.331 14.988 1.00 0.00 C ATOM 305 C LEU A 21 17.006 -1.716 13.704 1.00 0.00 C ATOM 306 O LEU A 21 15.795 -1.639 13.514 1.00 0.00 O ATOM 307 CB LEU A 21 17.870 -1.227 15.999 1.00 0.00 C ATOM 308 CG LEU A 21 17.561 -1.579 17.453 1.00 0.00 C ATOM 309 CD1 LEU A 21 18.162 -0.544 18.392 1.00 0.00 C ATOM 310 CD2 LEU A 21 16.056 -1.681 17.661 1.00 0.00 C ATOM 0 H LEU A 21 19.609 -2.748 15.074 1.00 0.00 H new ATOM 0 HA LEU A 21 16.791 -2.988 15.405 1.00 0.00 H new ATOM 0 HB2 LEU A 21 18.927 -0.973 15.919 1.00 0.00 H new ATOM 0 HB3 LEU A 21 17.306 -0.334 15.729 1.00 0.00 H new ATOM 0 HG LEU A 21 18.009 -2.546 17.680 1.00 0.00 H new ATOM 0 HD11 LEU A 21 17.932 -0.811 19.423 1.00 0.00 H new ATOM 0 HD12 LEU A 21 19.243 -0.515 18.257 1.00 0.00 H new ATOM 0 HD13 LEU A 21 17.742 0.437 18.169 1.00 0.00 H new ATOM 0 HD21 LEU A 21 15.849 -1.932 18.701 1.00 0.00 H new ATOM 0 HD22 LEU A 21 15.590 -0.726 17.419 1.00 0.00 H new ATOM 0 HD23 LEU A 21 15.651 -2.458 17.012 1.00 0.00 H new ATOM 322 N GLN A 22 17.903 -1.265 12.833 1.00 0.00 N ATOM 323 CA GLN A 22 17.499 -0.643 11.579 1.00 0.00 C ATOM 324 C GLN A 22 16.697 -1.610 10.709 1.00 0.00 C ATOM 325 O GLN A 22 15.674 -1.236 10.136 1.00 0.00 O ATOM 326 CB GLN A 22 18.728 -0.139 10.821 1.00 0.00 C ATOM 327 CG GLN A 22 18.389 0.731 9.624 1.00 0.00 C ATOM 328 CD GLN A 22 19.609 1.410 9.034 1.00 0.00 C ATOM 329 OE1 GLN A 22 20.679 0.810 8.933 1.00 0.00 O ATOM 330 NE2 GLN A 22 19.454 2.669 8.642 1.00 0.00 N ATOM 0 H GLN A 22 18.912 -1.319 12.973 1.00 0.00 H new ATOM 0 HA GLN A 22 16.854 0.203 11.816 1.00 0.00 H new ATOM 0 HB2 GLN A 22 19.359 0.429 11.505 1.00 0.00 H new ATOM 0 HB3 GLN A 22 19.313 -0.995 10.484 1.00 0.00 H new ATOM 0 HG2 GLN A 22 17.912 0.119 8.858 1.00 0.00 H new ATOM 0 HG3 GLN A 22 17.665 1.489 9.923 1.00 0.00 H new ATOM 0 HE21 GLN A 22 18.549 3.127 8.745 1.00 0.00 H new ATOM 0 HE22 GLN A 22 20.240 3.178 8.238 1.00 0.00 H new ATOM 339 N LEU A 23 17.160 -2.855 10.619 1.00 0.00 N ATOM 340 CA LEU A 23 16.482 -3.863 9.830 1.00 0.00 C ATOM 341 C LEU A 23 15.165 -4.250 10.491 1.00 0.00 C ATOM 342 O LEU A 23 14.148 -4.449 9.825 1.00 0.00 O ATOM 343 CB LEU A 23 17.381 -5.088 9.696 1.00 0.00 C ATOM 344 CG LEU A 23 17.028 -6.004 8.536 1.00 0.00 C ATOM 345 CD1 LEU A 23 18.209 -6.890 8.172 1.00 0.00 C ATOM 346 CD2 LEU A 23 15.803 -6.844 8.868 1.00 0.00 C ATOM 0 H LEU A 23 18.005 -3.184 11.087 1.00 0.00 H new ATOM 0 HA LEU A 23 16.267 -3.461 8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 23 18.412 -4.755 9.579 1.00 0.00 H new ATOM 0 HB3 LEU A 23 17.334 -5.661 10.622 1.00 0.00 H new ATOM 0 HG LEU A 23 16.790 -5.384 7.671 1.00 0.00 H new ATOM 0 HD11 LEU A 23 17.935 -7.538 7.339 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.056 -6.267 7.884 1.00 0.00 H new ATOM 0 HD13 LEU A 23 18.484 -7.501 9.032 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.567 -7.493 8.024 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.007 -7.453 9.748 1.00 0.00 H new ATOM 0 HD23 LEU A 23 14.956 -6.188 9.069 1.00 0.00 H new ATOM 358 N ARG A 24 15.203 -4.350 11.815 1.00 0.00 N ATOM 359 CA ARG A 24 14.035 -4.707 12.608 1.00 0.00 C ATOM 360 C ARG A 24 12.999 -3.589 12.594 1.00 0.00 C ATOM 361 O ARG A 24 11.797 -3.838 12.534 1.00 0.00 O ATOM 362 CB ARG A 24 14.460 -5.009 14.043 1.00 0.00 C ATOM 363 CG ARG A 24 15.254 -6.296 14.179 1.00 0.00 C ATOM 364 CD ARG A 24 15.653 -6.548 15.622 1.00 0.00 C ATOM 365 NE ARG A 24 16.418 -7.783 15.772 1.00 0.00 N ATOM 366 CZ ARG A 24 16.820 -8.274 16.945 1.00 0.00 C ATOM 367 NH1 ARG A 24 16.531 -7.640 18.073 1.00 0.00 N ATOM 368 NH2 ARG A 24 17.515 -9.403 16.987 1.00 0.00 N ATOM 0 H ARG A 24 16.044 -4.186 12.368 1.00 0.00 H new ATOM 0 HA ARG A 24 13.579 -5.595 12.169 1.00 0.00 H new ATOM 0 HB2 ARG A 24 15.059 -4.180 14.419 1.00 0.00 H new ATOM 0 HB3 ARG A 24 13.572 -5.071 14.672 1.00 0.00 H new ATOM 0 HG2 ARG A 24 14.660 -7.133 13.812 1.00 0.00 H new ATOM 0 HG3 ARG A 24 16.147 -6.242 13.557 1.00 0.00 H new ATOM 0 HD2 ARG A 24 16.245 -5.709 15.986 1.00 0.00 H new ATOM 0 HD3 ARG A 24 14.758 -6.599 16.242 1.00 0.00 H new ATOM 0 HE ARG A 24 16.660 -8.302 14.928 1.00 0.00 H new ATOM 0 HH11 ARG A 24 15.998 -6.771 18.047 1.00 0.00 H new ATOM 0 HH12 ARG A 24 16.842 -8.021 18.966 1.00 0.00 H new ATOM 0 HH21 ARG A 24 17.742 -9.895 16.123 1.00 0.00 H new ATOM 0 HH22 ARG A 24 17.823 -9.779 17.884 1.00 0.00 H new ATOM 382 N LYS A 25 13.473 -2.356 12.665 1.00 0.00 N ATOM 383 CA LYS A 25 12.593 -1.195 12.668 1.00 0.00 C ATOM 384 C LYS A 25 12.978 -0.223 11.559 1.00 0.00 C ATOM 385 O LYS A 25 13.666 0.760 11.806 1.00 0.00 O ATOM 386 CB LYS A 25 12.651 -0.496 14.029 1.00 0.00 C ATOM 387 CG LYS A 25 11.753 0.727 14.125 1.00 0.00 C ATOM 388 CD LYS A 25 11.850 1.382 15.493 1.00 0.00 C ATOM 389 CE LYS A 25 10.951 2.604 15.592 1.00 0.00 C ATOM 390 NZ LYS A 25 10.963 3.192 16.959 1.00 0.00 N ATOM 0 H LYS A 25 14.466 -2.131 12.722 1.00 0.00 H new ATOM 0 HA LYS A 25 11.573 -1.534 12.486 1.00 0.00 H new ATOM 0 HB2 LYS A 25 12.367 -1.207 14.805 1.00 0.00 H new ATOM 0 HB3 LYS A 25 13.680 -0.198 14.231 1.00 0.00 H new ATOM 0 HG2 LYS A 25 12.032 1.446 13.355 1.00 0.00 H new ATOM 0 HG3 LYS A 25 10.720 0.438 13.931 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.572 0.662 16.263 1.00 0.00 H new ATOM 0 HD3 LYS A 25 12.883 1.672 15.686 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.277 3.354 14.871 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.931 2.327 15.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 10.338 4.023 16.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 10.628 2.485 17.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.932 3.480 17.205 1.00 0.00 H new ATOM 404 N VAL A 26 12.527 -0.535 10.342 1.00 0.00 N ATOM 405 CA VAL A 26 12.781 0.267 9.132 1.00 0.00 C ATOM 406 C VAL A 26 12.019 1.601 9.132 1.00 0.00 C ATOM 407 O VAL A 26 10.874 1.653 8.679 1.00 0.00 O ATOM 408 CB VAL A 26 12.427 -0.510 7.850 1.00 0.00 C ATOM 409 CG1 VAL A 26 12.960 0.223 6.629 1.00 0.00 C ATOM 410 CG2 VAL A 26 12.980 -1.928 7.910 1.00 0.00 C ATOM 0 H VAL A 26 11.964 -1.366 10.161 1.00 0.00 H new ATOM 0 HA VAL A 26 13.850 0.482 9.145 1.00 0.00 H new ATOM 0 HB VAL A 26 11.342 -0.574 7.771 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.704 -0.336 5.729 1.00 0.00 H new ATOM 0 HG12 VAL A 26 12.515 1.217 6.578 1.00 0.00 H new ATOM 0 HG13 VAL A 26 14.044 0.314 6.703 1.00 0.00 H new ATOM 0 HG21 VAL A 26 12.719 -2.459 6.995 1.00 0.00 H new ATOM 0 HG22 VAL A 26 14.065 -1.892 8.011 1.00 0.00 H new ATOM 0 HG23 VAL A 26 12.553 -2.449 8.767 1.00 0.00 H new ATOM 420 N PRO A 27 12.618 2.700 9.637 1.00 0.00 N ATOM 421 CA PRO A 27 11.959 4.012 9.682 1.00 0.00 C ATOM 422 C PRO A 27 11.226 4.370 8.382 1.00 0.00 C ATOM 423 O PRO A 27 10.013 4.187 8.281 1.00 0.00 O ATOM 424 CB PRO A 27 13.110 4.999 9.953 1.00 0.00 C ATOM 425 CG PRO A 27 14.367 4.194 9.848 1.00 0.00 C ATOM 426 CD PRO A 27 13.982 2.780 10.170 1.00 0.00 C ATOM 0 HA PRO A 27 11.179 4.033 10.444 1.00 0.00 H new ATOM 0 HB2 PRO A 27 13.105 5.814 9.229 1.00 0.00 H new ATOM 0 HB3 PRO A 27 13.015 5.450 10.941 1.00 0.00 H new ATOM 0 HG2 PRO A 27 14.792 4.264 8.847 1.00 0.00 H new ATOM 0 HG3 PRO A 27 15.124 4.560 10.542 1.00 0.00 H new ATOM 0 HD2 PRO A 27 14.647 2.059 9.695 1.00 0.00 H new ATOM 0 HD3 PRO A 27 14.012 2.584 11.242 1.00 0.00 H new ATOM 434 N HIS A 28 11.955 4.897 7.400 1.00 0.00 N ATOM 435 CA HIS A 28 11.353 5.289 6.127 1.00 0.00 C ATOM 436 C HIS A 28 11.505 4.204 5.063 1.00 0.00 C ATOM 437 O HIS A 28 12.620 3.833 4.694 1.00 0.00 O ATOM 438 CB HIS A 28 11.977 6.595 5.630 1.00 0.00 C ATOM 439 CG HIS A 28 11.627 7.782 6.472 1.00 0.00 C ATOM 440 ND1 HIS A 28 10.411 8.429 6.393 1.00 0.00 N ATOM 441 CD2 HIS A 28 12.341 8.442 7.415 1.00 0.00 C ATOM 442 CE1 HIS A 28 10.393 9.434 7.251 1.00 0.00 C ATOM 443 NE2 HIS A 28 11.551 9.463 7.884 1.00 0.00 N ATOM 0 H HIS A 28 12.960 5.062 7.461 1.00 0.00 H new ATOM 0 HA HIS A 28 10.287 5.434 6.302 1.00 0.00 H new ATOM 0 HB2 HIS A 28 13.061 6.484 5.605 1.00 0.00 H new ATOM 0 HB3 HIS A 28 11.652 6.777 4.606 1.00 0.00 H new ATOM 0 HD2 HIS A 28 13.345 8.209 7.738 1.00 0.00 H new ATOM 0 HE1 HIS A 28 9.570 10.116 7.408 1.00 0.00 H new ATOM 0 HE2 HIS A 28 11.816 10.135 8.604 1.00 0.00 H new ATOM 452 N LEU A 29 10.374 3.716 4.561 1.00 0.00 N ATOM 453 CA LEU A 29 10.368 2.689 3.524 1.00 0.00 C ATOM 454 C LEU A 29 9.674 3.191 2.262 1.00 0.00 C ATOM 455 O LEU A 29 8.538 3.658 2.315 1.00 0.00 O ATOM 456 CB LEU A 29 9.672 1.421 4.024 1.00 0.00 C ATOM 457 CG LEU A 29 10.541 0.497 4.872 1.00 0.00 C ATOM 458 CD1 LEU A 29 9.685 -0.544 5.576 1.00 0.00 C ATOM 459 CD2 LEU A 29 11.592 -0.179 4.001 1.00 0.00 C ATOM 0 H LEU A 29 9.446 4.017 4.858 1.00 0.00 H new ATOM 0 HA LEU A 29 11.405 2.455 3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 29 8.799 1.711 4.609 1.00 0.00 H new ATOM 0 HB3 LEU A 29 9.307 0.862 3.162 1.00 0.00 H new ATOM 0 HG LEU A 29 11.046 1.094 5.631 1.00 0.00 H new ATOM 0 HD11 LEU A 29 10.322 -1.194 6.176 1.00 0.00 H new ATOM 0 HD12 LEU A 29 8.964 -0.045 6.223 1.00 0.00 H new ATOM 0 HD13 LEU A 29 9.154 -1.141 4.834 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.207 -0.836 4.616 1.00 0.00 H new ATOM 0 HD22 LEU A 29 11.099 -0.765 3.225 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.223 0.579 3.538 1.00 0.00 H new ATOM 471 N VAL A 30 10.354 3.081 1.126 1.00 0.00 N ATOM 472 CA VAL A 30 9.782 3.513 -0.143 1.00 0.00 C ATOM 473 C VAL A 30 9.834 2.388 -1.172 1.00 0.00 C ATOM 474 O VAL A 30 10.906 2.000 -1.632 1.00 0.00 O ATOM 475 CB VAL A 30 10.516 4.746 -0.706 1.00 0.00 C ATOM 476 CG1 VAL A 30 9.805 5.282 -1.939 1.00 0.00 C ATOM 477 CG2 VAL A 30 10.639 5.825 0.359 1.00 0.00 C ATOM 0 H VAL A 30 11.297 2.698 1.058 1.00 0.00 H new ATOM 0 HA VAL A 30 8.744 3.782 0.051 1.00 0.00 H new ATOM 0 HB VAL A 30 11.520 4.441 -1.002 1.00 0.00 H new ATOM 0 HG11 VAL A 30 10.341 6.152 -2.319 1.00 0.00 H new ATOM 0 HG12 VAL A 30 9.777 4.509 -2.707 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.787 5.569 -1.676 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.160 6.688 -0.056 1.00 0.00 H new ATOM 0 HG22 VAL A 30 9.645 6.125 0.689 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.201 5.436 1.208 1.00 0.00 H new ATOM 487 N VAL A 31 8.666 1.868 -1.526 1.00 0.00 N ATOM 488 CA VAL A 31 8.568 0.791 -2.498 1.00 0.00 C ATOM 489 C VAL A 31 7.392 1.019 -3.443 1.00 0.00 C ATOM 490 O VAL A 31 6.319 1.447 -3.013 1.00 0.00 O ATOM 491 CB VAL A 31 8.405 -0.574 -1.798 1.00 0.00 C ATOM 492 CG1 VAL A 31 7.130 -0.612 -0.967 1.00 0.00 C ATOM 493 CG2 VAL A 31 8.426 -1.709 -2.812 1.00 0.00 C ATOM 0 H VAL A 31 7.769 2.178 -1.151 1.00 0.00 H new ATOM 0 HA VAL A 31 9.494 0.785 -3.073 1.00 0.00 H new ATOM 0 HB VAL A 31 9.250 -0.708 -1.123 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.039 -1.585 -0.484 1.00 0.00 H new ATOM 0 HG12 VAL A 31 7.168 0.168 -0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.269 -0.446 -1.614 1.00 0.00 H new ATOM 0 HG21 VAL A 31 8.309 -2.661 -2.295 1.00 0.00 H new ATOM 0 HG22 VAL A 31 7.608 -1.579 -3.521 1.00 0.00 H new ATOM 0 HG23 VAL A 31 9.375 -1.701 -3.348 1.00 0.00 H new ATOM 503 N GLY A 32 7.589 0.723 -4.723 1.00 0.00 N ATOM 504 CA GLY A 32 6.518 0.898 -5.684 1.00 0.00 C ATOM 505 C GLY A 32 7.010 1.092 -7.102 1.00 0.00 C ATOM 506 O GLY A 32 8.204 0.975 -7.382 1.00 0.00 O ATOM 0 H GLY A 32 8.464 0.368 -5.109 1.00 0.00 H new ATOM 0 HA2 GLY A 32 5.863 0.027 -5.650 1.00 0.00 H new ATOM 0 HA3 GLY A 32 5.917 1.760 -5.394 1.00 0.00 H new ATOM 510 N HIS A 33 6.075 1.391 -7.994 1.00 0.00 N ATOM 511 CA HIS A 33 6.383 1.609 -9.399 1.00 0.00 C ATOM 512 C HIS A 33 5.400 2.604 -10.002 1.00 0.00 C ATOM 513 O HIS A 33 4.325 2.838 -9.449 1.00 0.00 O ATOM 514 CB HIS A 33 6.328 0.289 -10.170 1.00 0.00 C ATOM 515 CG HIS A 33 6.864 0.387 -11.564 1.00 0.00 C ATOM 516 ND1 HIS A 33 6.079 0.703 -12.652 1.00 0.00 N ATOM 517 CD2 HIS A 33 8.117 0.211 -12.047 1.00 0.00 C ATOM 518 CE1 HIS A 33 6.823 0.715 -13.744 1.00 0.00 C ATOM 519 NE2 HIS A 33 8.064 0.420 -13.403 1.00 0.00 N ATOM 0 H HIS A 33 5.086 1.489 -7.764 1.00 0.00 H new ATOM 0 HA HIS A 33 7.392 2.015 -9.473 1.00 0.00 H new ATOM 0 HB2 HIS A 33 6.895 -0.465 -9.624 1.00 0.00 H new ATOM 0 HB3 HIS A 33 5.295 -0.056 -10.210 1.00 0.00 H new ATOM 0 HD2 HIS A 33 8.995 -0.046 -11.472 1.00 0.00 H new ATOM 0 HE1 HIS A 33 6.476 0.929 -14.744 1.00 0.00 H new ATOM 0 HE2 HIS A 33 8.855 0.357 -14.043 1.00 0.00 H new ATOM 528 N LYS A 34 5.772 3.200 -11.127 1.00 0.00 N ATOM 529 CA LYS A 34 4.915 4.175 -11.789 1.00 0.00 C ATOM 530 C LYS A 34 3.579 3.549 -12.180 1.00 0.00 C ATOM 531 O LYS A 34 2.528 4.176 -12.057 1.00 0.00 O ATOM 532 CB LYS A 34 5.610 4.744 -13.026 1.00 0.00 C ATOM 533 CG LYS A 34 6.800 5.632 -12.702 1.00 0.00 C ATOM 534 CD LYS A 34 7.456 6.168 -13.964 1.00 0.00 C ATOM 535 CE LYS A 34 8.647 7.055 -13.640 1.00 0.00 C ATOM 536 NZ LYS A 34 9.354 7.507 -14.870 1.00 0.00 N ATOM 0 H LYS A 34 6.659 3.026 -11.599 1.00 0.00 H new ATOM 0 HA LYS A 34 4.723 4.987 -11.087 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.944 3.920 -13.656 1.00 0.00 H new ATOM 0 HB3 LYS A 34 4.887 5.317 -13.607 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.475 6.465 -12.078 1.00 0.00 H new ATOM 0 HG3 LYS A 34 7.530 5.066 -12.123 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.780 5.335 -14.588 1.00 0.00 H new ATOM 0 HD3 LYS A 34 6.726 6.734 -14.542 1.00 0.00 H new ATOM 0 HE2 LYS A 34 8.309 7.924 -13.075 1.00 0.00 H new ATOM 0 HE3 LYS A 34 9.342 6.510 -13.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 10.160 8.109 -14.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 9.699 6.679 -15.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.698 8.049 -15.468 1.00 0.00 H new ATOM 550 N SER A 35 3.629 2.311 -12.661 1.00 0.00 N ATOM 551 CA SER A 35 2.421 1.603 -13.073 1.00 0.00 C ATOM 552 C SER A 35 1.515 1.296 -11.881 1.00 0.00 C ATOM 553 O SER A 35 0.292 1.403 -11.980 1.00 0.00 O ATOM 554 CB SER A 35 2.791 0.303 -13.791 1.00 0.00 C ATOM 555 OG SER A 35 3.341 -0.639 -12.886 1.00 0.00 O ATOM 0 H SER A 35 4.491 1.778 -12.775 1.00 0.00 H new ATOM 0 HA SER A 35 1.873 2.253 -13.755 1.00 0.00 H new ATOM 0 HB2 SER A 35 1.905 -0.119 -14.267 1.00 0.00 H new ATOM 0 HB3 SER A 35 3.509 0.513 -14.584 1.00 0.00 H new ATOM 0 HG SER A 35 4.262 -0.385 -12.669 1.00 0.00 H new ATOM 561 N TYR A 36 2.116 0.912 -10.756 1.00 0.00 N ATOM 562 CA TYR A 36 1.353 0.584 -9.559 1.00 0.00 C ATOM 563 C TYR A 36 1.144 1.813 -8.676 1.00 0.00 C ATOM 564 O TYR A 36 0.040 2.355 -8.602 1.00 0.00 O ATOM 565 CB TYR A 36 2.074 -0.510 -8.769 1.00 0.00 C ATOM 566 CG TYR A 36 2.253 -1.795 -9.546 1.00 0.00 C ATOM 567 CD1 TYR A 36 1.290 -2.796 -9.507 1.00 0.00 C ATOM 568 CD2 TYR A 36 3.388 -2.008 -10.320 1.00 0.00 C ATOM 569 CE1 TYR A 36 1.451 -3.971 -10.215 1.00 0.00 C ATOM 570 CE2 TYR A 36 3.556 -3.181 -11.031 1.00 0.00 C ATOM 571 CZ TYR A 36 2.586 -4.159 -10.975 1.00 0.00 C ATOM 572 OH TYR A 36 2.750 -5.328 -11.682 1.00 0.00 O ATOM 0 H TYR A 36 3.127 0.821 -10.651 1.00 0.00 H new ATOM 0 HA TYR A 36 0.372 0.225 -9.871 1.00 0.00 H new ATOM 0 HB2 TYR A 36 3.053 -0.141 -8.462 1.00 0.00 H new ATOM 0 HB3 TYR A 36 1.513 -0.720 -7.859 1.00 0.00 H new ATOM 0 HD1 TYR A 36 0.400 -2.653 -8.913 1.00 0.00 H new ATOM 0 HD2 TYR A 36 4.151 -1.245 -10.366 1.00 0.00 H new ATOM 0 HE1 TYR A 36 0.692 -4.738 -10.174 1.00 0.00 H new ATOM 0 HE2 TYR A 36 4.443 -3.331 -11.628 1.00 0.00 H new ATOM 0 HH TYR A 36 3.602 -5.301 -12.166 1.00 0.00 H new ATOM 582 N GLY A 37 2.209 2.245 -8.009 1.00 0.00 N ATOM 583 CA GLY A 37 2.126 3.404 -7.137 1.00 0.00 C ATOM 584 C GLY A 37 3.258 3.448 -6.125 1.00 0.00 C ATOM 585 O GLY A 37 4.115 2.565 -6.105 1.00 0.00 O ATOM 0 H GLY A 37 3.131 1.812 -8.057 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.146 4.312 -7.740 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.172 3.392 -6.611 1.00 0.00 H new ATOM 589 N LYS A 38 3.260 4.478 -5.285 1.00 0.00 N ATOM 590 CA LYS A 38 4.295 4.637 -4.266 1.00 0.00 C ATOM 591 C LYS A 38 3.815 4.124 -2.911 1.00 0.00 C ATOM 592 O LYS A 38 2.737 4.493 -2.445 1.00 0.00 O ATOM 593 CB LYS A 38 4.704 6.106 -4.153 1.00 0.00 C ATOM 594 CG LYS A 38 5.813 6.355 -3.144 1.00 0.00 C ATOM 595 CD LYS A 38 6.180 7.827 -3.074 1.00 0.00 C ATOM 596 CE LYS A 38 7.097 8.229 -4.218 1.00 0.00 C ATOM 597 NZ LYS A 38 6.447 8.039 -5.544 1.00 0.00 N ATOM 0 H LYS A 38 2.556 5.216 -5.289 1.00 0.00 H new ATOM 0 HA LYS A 38 5.160 4.046 -4.569 1.00 0.00 H new ATOM 0 HB2 LYS A 38 5.029 6.460 -5.131 1.00 0.00 H new ATOM 0 HB3 LYS A 38 3.831 6.697 -3.874 1.00 0.00 H new ATOM 0 HG2 LYS A 38 5.495 6.011 -2.160 1.00 0.00 H new ATOM 0 HG3 LYS A 38 6.693 5.772 -3.417 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.273 8.431 -3.104 1.00 0.00 H new ATOM 0 HD3 LYS A 38 6.670 8.036 -2.123 1.00 0.00 H new ATOM 0 HE2 LYS A 38 7.386 9.274 -4.102 1.00 0.00 H new ATOM 0 HE3 LYS A 38 8.012 7.638 -4.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 6.881 8.680 -6.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 6.574 7.055 -5.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 5.431 8.249 -5.466 1.00 0.00 H new ATOM 611 N ILE A 39 4.620 3.271 -2.282 1.00 0.00 N ATOM 612 CA ILE A 39 4.273 2.708 -0.981 1.00 0.00 C ATOM 613 C ILE A 39 5.325 3.076 0.063 1.00 0.00 C ATOM 614 O ILE A 39 6.522 2.928 -0.176 1.00 0.00 O ATOM 615 CB ILE A 39 4.145 1.171 -1.059 1.00 0.00 C ATOM 616 CG1 ILE A 39 3.150 0.778 -2.152 1.00 0.00 C ATOM 617 CG2 ILE A 39 3.705 0.598 0.283 1.00 0.00 C ATOM 618 CD1 ILE A 39 3.286 -0.660 -2.602 1.00 0.00 C ATOM 0 H ILE A 39 5.516 2.955 -2.652 1.00 0.00 H new ATOM 0 HA ILE A 39 3.311 3.128 -0.687 1.00 0.00 H new ATOM 0 HB ILE A 39 5.123 0.757 -1.306 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.136 0.942 -1.786 1.00 0.00 H new ATOM 0 HG13 ILE A 39 3.288 1.434 -3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 39 3.621 -0.486 0.206 1.00 0.00 H new ATOM 0 HG22 ILE A 39 4.441 0.852 1.046 1.00 0.00 H new ATOM 0 HG23 ILE A 39 2.738 1.018 0.558 1.00 0.00 H new ATOM 0 HD11 ILE A 39 2.550 -0.870 -3.378 1.00 0.00 H new ATOM 0 HD12 ILE A 39 4.288 -0.824 -2.999 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.118 -1.324 -1.754 1.00 0.00 H new ATOM 630 N GLU A 40 4.882 3.559 1.219 1.00 0.00 N ATOM 631 CA GLU A 40 5.809 3.940 2.279 1.00 0.00 C ATOM 632 C GLU A 40 5.392 3.341 3.619 1.00 0.00 C ATOM 633 O GLU A 40 4.236 3.444 4.025 1.00 0.00 O ATOM 634 CB GLU A 40 5.883 5.465 2.393 1.00 0.00 C ATOM 635 CG GLU A 40 4.565 6.109 2.790 1.00 0.00 C ATOM 636 CD GLU A 40 4.662 7.617 2.897 1.00 0.00 C ATOM 637 OE1 GLU A 40 4.244 8.308 1.943 1.00 0.00 O ATOM 638 OE2 GLU A 40 5.154 8.110 3.934 1.00 0.00 O ATOM 0 H GLU A 40 3.897 3.695 1.445 1.00 0.00 H new ATOM 0 HA GLU A 40 6.793 3.549 2.021 1.00 0.00 H new ATOM 0 HB2 GLU A 40 6.643 5.730 3.128 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.206 5.877 1.437 1.00 0.00 H new ATOM 0 HG2 GLU A 40 3.802 5.849 2.056 1.00 0.00 H new ATOM 0 HG3 GLU A 40 4.239 5.701 3.747 1.00 0.00 H new ATOM 646 N PHE A 41 6.350 2.716 4.300 1.00 0.00 N ATOM 647 CA PHE A 41 6.095 2.099 5.596 1.00 0.00 C ATOM 648 C PHE A 41 6.931 2.749 6.694 1.00 0.00 C ATOM 649 O PHE A 41 8.157 2.783 6.610 1.00 0.00 O ATOM 650 CB PHE A 41 6.399 0.602 5.539 1.00 0.00 C ATOM 651 CG PHE A 41 5.571 -0.145 4.534 1.00 0.00 C ATOM 652 CD1 PHE A 41 4.353 -0.698 4.891 1.00 0.00 C ATOM 653 CD2 PHE A 41 6.016 -0.298 3.229 1.00 0.00 C ATOM 654 CE1 PHE A 41 3.592 -1.387 3.967 1.00 0.00 C ATOM 655 CE2 PHE A 41 5.259 -0.988 2.303 1.00 0.00 C ATOM 656 CZ PHE A 41 4.046 -1.532 2.672 1.00 0.00 C ATOM 0 H PHE A 41 7.312 2.624 3.973 1.00 0.00 H new ATOM 0 HA PHE A 41 5.041 2.248 5.832 1.00 0.00 H new ATOM 0 HB2 PHE A 41 7.454 0.463 5.302 1.00 0.00 H new ATOM 0 HB3 PHE A 41 6.234 0.169 6.526 1.00 0.00 H new ATOM 0 HD1 PHE A 41 3.994 -0.589 5.904 1.00 0.00 H new ATOM 0 HD2 PHE A 41 6.964 0.127 2.934 1.00 0.00 H new ATOM 0 HE1 PHE A 41 2.643 -1.812 4.258 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.616 -1.102 1.290 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.452 -2.071 1.948 1.00 0.00 H new ATOM 666 N LEU A 42 6.266 3.247 7.733 1.00 0.00 N ATOM 667 CA LEU A 42 6.967 3.873 8.851 1.00 0.00 C ATOM 668 C LEU A 42 6.917 2.989 10.094 1.00 0.00 C ATOM 669 O LEU A 42 7.238 3.423 11.201 1.00 0.00 O ATOM 670 CB LEU A 42 6.376 5.250 9.157 1.00 0.00 C ATOM 671 CG LEU A 42 6.850 6.374 8.234 1.00 0.00 C ATOM 672 CD1 LEU A 42 6.274 6.195 6.837 1.00 0.00 C ATOM 673 CD2 LEU A 42 6.462 7.730 8.804 1.00 0.00 C ATOM 0 H LEU A 42 5.250 3.230 7.824 1.00 0.00 H new ATOM 0 HA LEU A 42 8.011 3.998 8.562 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.290 5.184 9.097 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.623 5.515 10.185 1.00 0.00 H new ATOM 0 HG LEU A 42 7.937 6.329 8.165 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.622 7.003 6.194 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.602 5.239 6.428 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.185 6.214 6.887 1.00 0.00 H new ATOM 0 HD21 LEU A 42 6.807 8.518 8.135 1.00 0.00 H new ATOM 0 HD22 LEU A 42 5.378 7.786 8.903 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.923 7.858 9.783 1.00 0.00 H new ATOM 685 N GLU A 43 6.516 1.746 9.887 1.00 0.00 N ATOM 686 CA GLU A 43 6.417 0.767 10.964 1.00 0.00 C ATOM 687 C GLU A 43 7.762 0.083 11.203 1.00 0.00 C ATOM 688 O GLU A 43 8.753 0.405 10.549 1.00 0.00 O ATOM 689 CB GLU A 43 5.353 -0.279 10.626 1.00 0.00 C ATOM 690 CG GLU A 43 3.929 0.227 10.786 1.00 0.00 C ATOM 691 CD GLU A 43 3.657 0.761 12.177 1.00 0.00 C ATOM 692 OE1 GLU A 43 3.527 1.995 12.325 1.00 0.00 O ATOM 693 OE2 GLU A 43 3.568 -0.053 13.120 1.00 0.00 O ATOM 0 H GLU A 43 6.250 1.385 8.971 1.00 0.00 H new ATOM 0 HA GLU A 43 6.130 1.290 11.876 1.00 0.00 H new ATOM 0 HB2 GLU A 43 5.498 -0.613 9.599 1.00 0.00 H new ATOM 0 HB3 GLU A 43 5.495 -1.149 11.267 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.742 1.014 10.055 1.00 0.00 H new ATOM 0 HG3 GLU A 43 3.232 -0.583 10.568 1.00 0.00 H new ATOM 701 N PRO A 44 7.827 -0.850 12.176 1.00 0.00 N ATOM 702 CA PRO A 44 9.042 -1.549 12.541 1.00 0.00 C ATOM 703 C PRO A 44 8.957 -3.039 12.205 1.00 0.00 C ATOM 704 O PRO A 44 8.635 -3.871 13.054 1.00 0.00 O ATOM 705 CB PRO A 44 8.988 -1.366 14.053 1.00 0.00 C ATOM 706 CG PRO A 44 7.517 -1.480 14.384 1.00 0.00 C ATOM 707 CD PRO A 44 6.754 -1.254 13.086 1.00 0.00 C ATOM 0 HA PRO A 44 9.940 -1.190 12.038 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.573 -2.128 14.568 1.00 0.00 H new ATOM 0 HB3 PRO A 44 9.391 -0.398 14.352 1.00 0.00 H new ATOM 0 HG2 PRO A 44 7.290 -2.461 14.800 1.00 0.00 H new ATOM 0 HG3 PRO A 44 7.231 -0.742 15.134 1.00 0.00 H new ATOM 0 HD2 PRO A 44 6.248 -2.158 12.746 1.00 0.00 H new ATOM 0 HD3 PRO A 44 5.992 -0.481 13.189 1.00 0.00 H new ATOM 715 N VAL A 45 9.241 -3.362 10.946 1.00 0.00 N ATOM 716 CA VAL A 45 9.186 -4.740 10.481 1.00 0.00 C ATOM 717 C VAL A 45 10.335 -5.552 11.060 1.00 0.00 C ATOM 718 O VAL A 45 11.359 -5.754 10.407 1.00 0.00 O ATOM 719 CB VAL A 45 9.239 -4.813 8.944 1.00 0.00 C ATOM 720 CG1 VAL A 45 7.966 -4.244 8.337 1.00 0.00 C ATOM 721 CG2 VAL A 45 10.462 -4.078 8.417 1.00 0.00 C ATOM 0 H VAL A 45 9.511 -2.686 10.231 1.00 0.00 H new ATOM 0 HA VAL A 45 8.239 -5.158 10.822 1.00 0.00 H new ATOM 0 HB VAL A 45 9.317 -5.860 8.652 1.00 0.00 H new ATOM 0 HG11 VAL A 45 8.023 -4.304 7.250 1.00 0.00 H new ATOM 0 HG12 VAL A 45 7.108 -4.817 8.688 1.00 0.00 H new ATOM 0 HG13 VAL A 45 7.854 -3.202 8.637 1.00 0.00 H new ATOM 0 HG21 VAL A 45 10.483 -4.140 7.329 1.00 0.00 H new ATOM 0 HG22 VAL A 45 10.416 -3.032 8.720 1.00 0.00 H new ATOM 0 HG23 VAL A 45 11.364 -4.535 8.824 1.00 0.00 H new ATOM 731 N ASP A 46 10.161 -6.011 12.294 1.00 0.00 N ATOM 732 CA ASP A 46 11.192 -6.792 12.961 1.00 0.00 C ATOM 733 C ASP A 46 11.410 -8.111 12.236 1.00 0.00 C ATOM 734 O ASP A 46 10.654 -9.065 12.417 1.00 0.00 O ATOM 735 CB ASP A 46 10.804 -7.051 14.418 1.00 0.00 C ATOM 736 CG ASP A 46 10.861 -5.794 15.265 1.00 0.00 C ATOM 737 OD1 ASP A 46 11.544 -4.832 14.854 1.00 0.00 O ATOM 738 OD2 ASP A 46 10.222 -5.770 16.337 1.00 0.00 O ATOM 0 H ASP A 46 9.320 -5.856 12.849 1.00 0.00 H new ATOM 0 HA ASP A 46 12.122 -6.224 12.941 1.00 0.00 H new ATOM 0 HB2 ASP A 46 9.796 -7.465 14.454 1.00 0.00 H new ATOM 0 HB3 ASP A 46 11.472 -7.801 14.841 1.00 0.00 H new ATOM 744 N LEU A 47 12.447 -8.156 11.407 1.00 0.00 N ATOM 745 CA LEU A 47 12.758 -9.359 10.649 1.00 0.00 C ATOM 746 C LEU A 47 14.024 -10.026 11.177 1.00 0.00 C ATOM 747 O LEU A 47 14.117 -11.253 11.224 1.00 0.00 O ATOM 748 CB LEU A 47 12.922 -9.015 9.168 1.00 0.00 C ATOM 749 CG LEU A 47 11.649 -8.524 8.475 1.00 0.00 C ATOM 750 CD1 LEU A 47 11.968 -7.988 7.088 1.00 0.00 C ATOM 751 CD2 LEU A 47 10.620 -9.643 8.393 1.00 0.00 C ATOM 0 H LEU A 47 13.083 -7.376 11.244 1.00 0.00 H new ATOM 0 HA LEU A 47 11.932 -10.060 10.765 1.00 0.00 H new ATOM 0 HB2 LEU A 47 13.690 -8.247 9.071 1.00 0.00 H new ATOM 0 HB3 LEU A 47 13.286 -9.898 8.643 1.00 0.00 H new ATOM 0 HG LEU A 47 11.227 -7.712 9.067 1.00 0.00 H new ATOM 0 HD11 LEU A 47 11.050 -7.644 6.611 1.00 0.00 H new ATOM 0 HD12 LEU A 47 12.668 -7.156 7.171 1.00 0.00 H new ATOM 0 HD13 LEU A 47 12.415 -8.779 6.486 1.00 0.00 H new ATOM 0 HD21 LEU A 47 9.722 -9.275 7.897 1.00 0.00 H new ATOM 0 HD22 LEU A 47 11.033 -10.476 7.824 1.00 0.00 H new ATOM 0 HD23 LEU A 47 10.368 -9.980 9.399 1.00 0.00 H new ATOM 763 N ALA A 48 14.995 -9.216 11.582 1.00 0.00 N ATOM 764 CA ALA A 48 16.250 -9.735 12.114 1.00 0.00 C ATOM 765 C ALA A 48 16.930 -10.688 11.130 1.00 0.00 C ATOM 766 O ALA A 48 17.497 -11.706 11.530 1.00 0.00 O ATOM 767 CB ALA A 48 16.003 -10.434 13.444 1.00 0.00 C ATOM 0 H ALA A 48 14.938 -8.198 11.552 1.00 0.00 H new ATOM 0 HA ALA A 48 16.922 -8.891 12.271 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.946 -10.818 13.834 1.00 0.00 H new ATOM 0 HB2 ALA A 48 15.579 -9.725 14.155 1.00 0.00 H new ATOM 0 HB3 ALA A 48 15.307 -11.260 13.297 1.00 0.00 H new ATOM 773 N GLY A 49 16.882 -10.347 9.845 1.00 0.00 N ATOM 774 CA GLY A 49 17.512 -11.182 8.835 1.00 0.00 C ATOM 775 C GLY A 49 16.543 -11.715 7.795 1.00 0.00 C ATOM 776 O GLY A 49 16.959 -12.414 6.880 1.00 0.00 O ATOM 0 H GLY A 49 16.420 -9.511 9.486 1.00 0.00 H new ATOM 0 HA2 GLY A 49 18.290 -10.606 8.333 1.00 0.00 H new ATOM 0 HA3 GLY A 49 18.004 -12.022 9.325 1.00 0.00 H new ATOM 780 N ILE A 50 15.260 -11.380 7.943 1.00 0.00 N ATOM 781 CA ILE A 50 14.198 -11.812 7.013 1.00 0.00 C ATOM 782 C ILE A 50 14.300 -11.130 5.645 1.00 0.00 C ATOM 783 O ILE A 50 13.797 -10.017 5.476 1.00 0.00 O ATOM 784 CB ILE A 50 12.774 -11.566 7.561 1.00 0.00 C ATOM 785 CG1 ILE A 50 12.669 -11.998 9.025 1.00 0.00 C ATOM 786 CG2 ILE A 50 11.748 -12.310 6.720 1.00 0.00 C ATOM 787 CD1 ILE A 50 13.069 -13.437 9.263 1.00 0.00 C ATOM 0 H ILE A 50 14.920 -10.800 8.711 1.00 0.00 H new ATOM 0 HA ILE A 50 14.360 -12.884 6.904 1.00 0.00 H new ATOM 0 HB ILE A 50 12.569 -10.497 7.504 1.00 0.00 H new ATOM 0 HG12 ILE A 50 13.300 -11.349 9.632 1.00 0.00 H new ATOM 0 HG13 ILE A 50 11.643 -11.854 9.365 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.750 -12.127 7.118 1.00 0.00 H new ATOM 0 HG22 ILE A 50 11.798 -11.958 5.690 1.00 0.00 H new ATOM 0 HG23 ILE A 50 11.960 -13.379 6.749 1.00 0.00 H new ATOM 0 HD11 ILE A 50 12.969 -13.672 10.323 1.00 0.00 H new ATOM 0 HD12 ILE A 50 12.422 -14.095 8.683 1.00 0.00 H new ATOM 0 HD13 ILE A 50 14.104 -13.583 8.955 1.00 0.00 H new ATOM 799 N PRO A 51 14.973 -11.747 4.651 1.00 0.00 N ATOM 800 CA PRO A 51 15.136 -11.163 3.335 1.00 0.00 C ATOM 801 C PRO A 51 14.198 -11.782 2.308 1.00 0.00 C ATOM 802 O PRO A 51 14.533 -11.900 1.130 1.00 0.00 O ATOM 803 CB PRO A 51 16.577 -11.554 3.027 1.00 0.00 C ATOM 804 CG PRO A 51 16.753 -12.897 3.682 1.00 0.00 C ATOM 805 CD PRO A 51 15.642 -13.050 4.706 1.00 0.00 C ATOM 0 HA PRO A 51 14.919 -10.095 3.303 1.00 0.00 H new ATOM 0 HB2 PRO A 51 16.752 -11.611 1.953 1.00 0.00 H new ATOM 0 HB3 PRO A 51 17.280 -10.823 3.426 1.00 0.00 H new ATOM 0 HG2 PRO A 51 16.705 -13.695 2.941 1.00 0.00 H new ATOM 0 HG3 PRO A 51 17.729 -12.966 4.161 1.00 0.00 H new ATOM 0 HD2 PRO A 51 14.964 -13.864 4.450 1.00 0.00 H new ATOM 0 HD3 PRO A 51 16.034 -13.262 5.701 1.00 0.00 H new ATOM 813 N LEU A 52 13.015 -12.169 2.772 1.00 0.00 N ATOM 814 CA LEU A 52 12.000 -12.767 1.912 1.00 0.00 C ATOM 815 C LEU A 52 11.574 -11.784 0.826 1.00 0.00 C ATOM 816 O LEU A 52 11.357 -12.163 -0.322 1.00 0.00 O ATOM 817 CB LEU A 52 10.784 -13.191 2.739 1.00 0.00 C ATOM 818 CG LEU A 52 9.647 -13.829 1.940 1.00 0.00 C ATOM 819 CD1 LEU A 52 10.131 -15.090 1.241 1.00 0.00 C ATOM 820 CD2 LEU A 52 8.465 -14.139 2.847 1.00 0.00 C ATOM 0 H LEU A 52 12.734 -12.078 3.748 1.00 0.00 H new ATOM 0 HA LEU A 52 12.429 -13.649 1.437 1.00 0.00 H new ATOM 0 HB2 LEU A 52 11.111 -13.897 3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.395 -12.316 3.260 1.00 0.00 H new ATOM 0 HG LEU A 52 9.318 -13.119 1.181 1.00 0.00 H new ATOM 0 HD11 LEU A 52 9.309 -15.531 0.677 1.00 0.00 H new ATOM 0 HD12 LEU A 52 10.945 -14.839 0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 52 10.486 -15.804 1.984 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.666 -14.592 2.261 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.778 -14.830 3.629 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.103 -13.217 3.301 1.00 0.00 H new ATOM 906 N ILE A 59 5.214 -10.989 1.915 1.00 0.00 N ATOM 907 CA ILE A 59 5.404 -9.782 2.713 1.00 0.00 C ATOM 908 C ILE A 59 5.248 -8.524 1.854 1.00 0.00 C ATOM 909 O ILE A 59 4.598 -7.562 2.266 1.00 0.00 O ATOM 910 CB ILE A 59 6.797 -9.777 3.400 1.00 0.00 C ATOM 911 CG1 ILE A 59 6.935 -10.987 4.329 1.00 0.00 C ATOM 912 CG2 ILE A 59 7.020 -8.490 4.187 1.00 0.00 C ATOM 913 CD1 ILE A 59 8.340 -11.192 4.856 1.00 0.00 C ATOM 0 HA ILE A 59 4.634 -9.779 3.484 1.00 0.00 H new ATOM 0 HB ILE A 59 7.555 -9.835 2.619 1.00 0.00 H new ATOM 0 HG12 ILE A 59 6.254 -10.867 5.172 1.00 0.00 H new ATOM 0 HG13 ILE A 59 6.623 -11.883 3.793 1.00 0.00 H new ATOM 0 HG21 ILE A 59 8.003 -8.516 4.656 1.00 0.00 H new ATOM 0 HG22 ILE A 59 6.963 -7.636 3.512 1.00 0.00 H new ATOM 0 HG23 ILE A 59 6.253 -8.396 4.956 1.00 0.00 H new ATOM 0 HD11 ILE A 59 8.361 -12.067 5.506 1.00 0.00 H new ATOM 0 HD12 ILE A 59 9.023 -11.345 4.021 1.00 0.00 H new ATOM 0 HD13 ILE A 59 8.649 -10.312 5.421 1.00 0.00 H new ATOM 925 N ILE A 60 5.836 -8.533 0.660 1.00 0.00 N ATOM 926 CA ILE A 60 5.738 -7.384 -0.237 1.00 0.00 C ATOM 927 C ILE A 60 5.073 -7.775 -1.560 1.00 0.00 C ATOM 928 O ILE A 60 5.573 -8.631 -2.291 1.00 0.00 O ATOM 929 CB ILE A 60 7.131 -6.764 -0.512 1.00 0.00 C ATOM 930 CG1 ILE A 60 7.763 -6.294 0.799 1.00 0.00 C ATOM 931 CG2 ILE A 60 7.032 -5.596 -1.489 1.00 0.00 C ATOM 932 CD1 ILE A 60 9.213 -5.890 0.660 1.00 0.00 C ATOM 0 H ILE A 60 6.380 -9.314 0.294 1.00 0.00 H new ATOM 0 HA ILE A 60 5.119 -6.637 0.260 1.00 0.00 H new ATOM 0 HB ILE A 60 7.760 -7.532 -0.962 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.194 -5.448 1.184 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.686 -7.093 1.537 1.00 0.00 H new ATOM 0 HG21 ILE A 60 8.025 -5.182 -1.662 1.00 0.00 H new ATOM 0 HG22 ILE A 60 6.615 -5.946 -2.433 1.00 0.00 H new ATOM 0 HG23 ILE A 60 6.385 -4.825 -1.070 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.595 -5.568 1.629 1.00 0.00 H new ATOM 0 HD12 ILE A 60 9.795 -6.740 0.304 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.295 -5.070 -0.053 1.00 0.00 H new ATOM 944 N THR A 61 3.950 -7.131 -1.860 1.00 0.00 N ATOM 945 CA THR A 61 3.216 -7.394 -3.093 1.00 0.00 C ATOM 946 C THR A 61 2.400 -6.170 -3.500 1.00 0.00 C ATOM 947 O THR A 61 1.964 -5.397 -2.648 1.00 0.00 O ATOM 948 CB THR A 61 2.292 -8.602 -2.916 1.00 0.00 C ATOM 949 OG1 THR A 61 1.624 -8.904 -4.127 1.00 0.00 O ATOM 950 CG2 THR A 61 1.240 -8.400 -1.848 1.00 0.00 C ATOM 0 H THR A 61 3.527 -6.420 -1.263 1.00 0.00 H new ATOM 0 HA THR A 61 3.937 -7.613 -3.881 1.00 0.00 H new ATOM 0 HB THR A 61 2.943 -9.421 -2.610 1.00 0.00 H new ATOM 0 HG1 THR A 61 1.040 -9.680 -3.994 1.00 0.00 H new ATOM 0 HG21 THR A 61 0.620 -9.293 -1.775 1.00 0.00 H new ATOM 0 HG22 THR A 61 1.725 -8.215 -0.890 1.00 0.00 H new ATOM 0 HG23 THR A 61 0.616 -7.545 -2.109 1.00 0.00 H new ATOM 958 N PHE A 62 2.193 -5.995 -4.803 1.00 0.00 N ATOM 959 CA PHE A 62 1.425 -4.858 -5.297 1.00 0.00 C ATOM 960 C PHE A 62 0.452 -5.281 -6.392 1.00 0.00 C ATOM 961 O PHE A 62 0.860 -5.618 -7.504 1.00 0.00 O ATOM 962 CB PHE A 62 2.364 -3.774 -5.839 1.00 0.00 C ATOM 963 CG PHE A 62 1.709 -2.428 -5.995 1.00 0.00 C ATOM 964 CD1 PHE A 62 0.497 -2.301 -6.656 1.00 0.00 C ATOM 965 CD2 PHE A 62 2.307 -1.289 -5.478 1.00 0.00 C ATOM 966 CE1 PHE A 62 -0.107 -1.065 -6.796 1.00 0.00 C ATOM 967 CE2 PHE A 62 1.709 -0.050 -5.617 1.00 0.00 C ATOM 968 CZ PHE A 62 0.500 0.062 -6.276 1.00 0.00 C ATOM 0 H PHE A 62 2.543 -6.620 -5.529 1.00 0.00 H new ATOM 0 HA PHE A 62 0.853 -4.458 -4.460 1.00 0.00 H new ATOM 0 HB2 PHE A 62 3.218 -3.677 -5.168 1.00 0.00 H new ATOM 0 HB3 PHE A 62 2.753 -4.093 -6.806 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.019 -3.178 -7.067 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.251 -1.370 -4.960 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -1.052 -0.981 -7.311 1.00 0.00 H new ATOM 0 HE2 PHE A 62 2.187 0.829 -5.211 1.00 0.00 H new ATOM 0 HZ PHE A 62 0.030 1.028 -6.384 1.00 0.00 H new ATOM 978 N GLU A 63 -0.840 -5.228 -6.081 1.00 0.00 N ATOM 979 CA GLU A 63 -1.874 -5.571 -7.047 1.00 0.00 C ATOM 980 C GLU A 63 -2.004 -4.448 -8.069 1.00 0.00 C ATOM 981 O GLU A 63 -1.879 -3.276 -7.713 1.00 0.00 O ATOM 982 CB GLU A 63 -3.213 -5.811 -6.345 1.00 0.00 C ATOM 983 CG GLU A 63 -3.245 -7.082 -5.514 1.00 0.00 C ATOM 984 CD GLU A 63 -3.404 -8.330 -6.360 1.00 0.00 C ATOM 985 OE1 GLU A 63 -2.377 -8.964 -6.681 1.00 0.00 O ATOM 986 OE2 GLU A 63 -4.556 -8.673 -6.702 1.00 0.00 O ATOM 0 H GLU A 63 -1.194 -4.950 -5.166 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.592 -6.492 -7.557 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -3.433 -4.960 -5.701 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -4.003 -5.857 -7.094 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -2.325 -7.156 -4.934 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.067 -7.024 -4.801 1.00 0.00 H new ATOM 994 N PRO A 64 -2.236 -4.771 -9.355 1.00 0.00 N ATOM 995 CA PRO A 64 -2.357 -3.754 -10.401 1.00 0.00 C ATOM 996 C PRO A 64 -3.638 -2.934 -10.273 1.00 0.00 C ATOM 997 O PRO A 64 -4.415 -2.817 -11.219 1.00 0.00 O ATOM 998 CB PRO A 64 -2.351 -4.557 -11.711 1.00 0.00 C ATOM 999 CG PRO A 64 -1.961 -5.950 -11.332 1.00 0.00 C ATOM 1000 CD PRO A 64 -2.378 -6.127 -9.900 1.00 0.00 C ATOM 0 HA PRO A 64 -1.549 -3.024 -10.343 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -3.333 -4.541 -12.184 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -1.645 -4.134 -12.426 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -2.453 -6.680 -11.974 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -0.887 -6.098 -11.446 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -3.402 -6.492 -9.818 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -1.742 -6.842 -9.378 1.00 0.00 H new ATOM 1008 N LYS A 65 -3.830 -2.366 -9.088 1.00 0.00 N ATOM 1009 CA LYS A 65 -4.996 -1.536 -8.771 1.00 0.00 C ATOM 1010 C LYS A 65 -5.129 -1.380 -7.258 1.00 0.00 C ATOM 1011 O LYS A 65 -5.750 -0.434 -6.770 1.00 0.00 O ATOM 1012 CB LYS A 65 -6.291 -2.130 -9.342 1.00 0.00 C ATOM 1013 CG LYS A 65 -6.659 -3.482 -8.754 1.00 0.00 C ATOM 1014 CD LYS A 65 -7.947 -4.018 -9.357 1.00 0.00 C ATOM 1015 CE LYS A 65 -8.421 -5.268 -8.637 1.00 0.00 C ATOM 1016 NZ LYS A 65 -9.732 -5.746 -9.157 1.00 0.00 N ATOM 0 H LYS A 65 -3.177 -2.467 -8.311 1.00 0.00 H new ATOM 0 HA LYS A 65 -4.841 -0.561 -9.232 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -7.109 -1.432 -9.163 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.188 -2.230 -10.422 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -5.850 -4.190 -8.932 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.771 -3.392 -7.674 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -8.721 -3.252 -9.305 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -7.790 -4.242 -10.412 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.677 -6.056 -8.750 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.507 -5.062 -7.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -10.020 -6.601 -8.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -10.449 -5.004 -9.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -9.644 -5.968 -10.169 1.00 0.00 H new ATOM 1030 N THR A 66 -4.545 -2.324 -6.521 1.00 0.00 N ATOM 1031 CA THR A 66 -4.597 -2.307 -5.063 1.00 0.00 C ATOM 1032 C THR A 66 -3.258 -2.723 -4.460 1.00 0.00 C ATOM 1033 O THR A 66 -2.517 -3.506 -5.049 1.00 0.00 O ATOM 1034 CB THR A 66 -5.704 -3.235 -4.561 1.00 0.00 C ATOM 1035 OG1 THR A 66 -6.932 -2.948 -5.207 1.00 0.00 O ATOM 1036 CG2 THR A 66 -5.937 -3.139 -3.068 1.00 0.00 C ATOM 0 H THR A 66 -4.029 -3.112 -6.913 1.00 0.00 H new ATOM 0 HA THR A 66 -4.814 -1.287 -4.747 1.00 0.00 H new ATOM 0 HB THR A 66 -5.361 -4.243 -4.794 1.00 0.00 H new ATOM 0 HG1 THR A 66 -7.627 -3.553 -4.873 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.735 -3.823 -2.780 1.00 0.00 H new ATOM 0 HG22 THR A 66 -5.022 -3.405 -2.539 1.00 0.00 H new ATOM 0 HG23 THR A 66 -6.222 -2.119 -2.809 1.00 0.00 H new ATOM 1044 N CYS A 67 -2.955 -2.194 -3.280 1.00 0.00 N ATOM 1045 CA CYS A 67 -1.707 -2.516 -2.597 1.00 0.00 C ATOM 1046 C CYS A 67 -1.953 -3.501 -1.457 1.00 0.00 C ATOM 1047 O CYS A 67 -2.795 -3.264 -0.591 1.00 0.00 O ATOM 1048 CB CYS A 67 -1.047 -1.247 -2.058 1.00 0.00 C ATOM 1049 SG CYS A 67 0.543 -1.537 -1.247 1.00 0.00 S ATOM 0 H CYS A 67 -3.555 -1.541 -2.777 1.00 0.00 H new ATOM 0 HA CYS A 67 -1.037 -2.981 -3.320 1.00 0.00 H new ATOM 0 HB2 CYS A 67 -0.902 -0.547 -2.881 1.00 0.00 H new ATOM 0 HB3 CYS A 67 -1.724 -0.770 -1.349 1.00 0.00 H new ATOM 0 HG CYS A 67 0.418 -2.496 -0.378 1.00 0.00 H new ATOM 1055 N ILE A 68 -1.217 -4.606 -1.466 1.00 0.00 N ATOM 1056 CA ILE A 68 -1.356 -5.629 -0.437 1.00 0.00 C ATOM 1057 C ILE A 68 -0.039 -5.821 0.312 1.00 0.00 C ATOM 1058 O ILE A 68 0.988 -6.145 -0.284 1.00 0.00 O ATOM 1059 CB ILE A 68 -1.815 -6.970 -1.058 1.00 0.00 C ATOM 1060 CG1 ILE A 68 -3.162 -6.783 -1.757 1.00 0.00 C ATOM 1061 CG2 ILE A 68 -1.921 -8.061 0.003 1.00 0.00 C ATOM 1062 CD1 ILE A 68 -3.581 -7.969 -2.596 1.00 0.00 C ATOM 0 H ILE A 68 -0.516 -4.817 -2.177 1.00 0.00 H new ATOM 0 HA ILE A 68 -2.115 -5.296 0.271 1.00 0.00 H new ATOM 0 HB ILE A 68 -1.069 -7.282 -1.788 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -3.928 -6.592 -1.005 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.112 -5.899 -2.393 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.245 -8.991 -0.463 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -0.948 -8.210 0.471 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.646 -7.763 0.761 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -4.545 -7.763 -3.061 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -2.836 -8.148 -3.371 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.664 -8.852 -1.962 1.00 0.00 H new ATOM 1074 N ILE A 69 -0.075 -5.601 1.623 1.00 0.00 N ATOM 1075 CA ILE A 69 1.114 -5.736 2.457 1.00 0.00 C ATOM 1076 C ILE A 69 1.249 -7.163 2.997 1.00 0.00 C ATOM 1077 O ILE A 69 2.030 -7.961 2.477 1.00 0.00 O ATOM 1078 CB ILE A 69 1.080 -4.728 3.633 1.00 0.00 C ATOM 1079 CG1 ILE A 69 1.006 -3.299 3.097 1.00 0.00 C ATOM 1080 CG2 ILE A 69 2.305 -4.888 4.528 1.00 0.00 C ATOM 1081 CD1 ILE A 69 0.728 -2.267 4.169 1.00 0.00 C ATOM 0 H ILE A 69 -0.916 -5.328 2.131 1.00 0.00 H new ATOM 0 HA ILE A 69 1.980 -5.518 1.833 1.00 0.00 H new ATOM 0 HB ILE A 69 0.192 -4.933 4.231 1.00 0.00 H new ATOM 0 HG12 ILE A 69 1.947 -3.055 2.604 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.225 -3.244 2.339 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.255 -4.168 5.345 1.00 0.00 H new ATOM 0 HG22 ILE A 69 2.328 -5.899 4.936 1.00 0.00 H new ATOM 0 HG23 ILE A 69 3.208 -4.712 3.944 1.00 0.00 H new ATOM 0 HD11 ILE A 69 0.689 -1.275 3.718 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.227 -2.486 4.646 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.522 -2.295 4.916 1.00 0.00 H new ATOM 1093 N TYR A 70 0.492 -7.473 4.047 1.00 0.00 N ATOM 1094 CA TYR A 70 0.539 -8.797 4.663 1.00 0.00 C ATOM 1095 C TYR A 70 0.020 -9.876 3.716 1.00 0.00 C ATOM 1096 O TYR A 70 0.736 -10.820 3.388 1.00 0.00 O ATOM 1097 CB TYR A 70 -0.276 -8.795 5.962 1.00 0.00 C ATOM 1098 CG TYR A 70 -0.297 -10.129 6.680 1.00 0.00 C ATOM 1099 CD1 TYR A 70 0.705 -10.469 7.579 1.00 0.00 C ATOM 1100 CD2 TYR A 70 -1.315 -11.051 6.453 1.00 0.00 C ATOM 1101 CE1 TYR A 70 0.697 -11.685 8.235 1.00 0.00 C ATOM 1102 CE2 TYR A 70 -1.329 -12.271 7.105 1.00 0.00 C ATOM 1103 CZ TYR A 70 -0.323 -12.582 7.993 1.00 0.00 C ATOM 1104 OH TYR A 70 -0.334 -13.795 8.642 1.00 0.00 O ATOM 0 H TYR A 70 -0.161 -6.826 4.489 1.00 0.00 H new ATOM 0 HA TYR A 70 1.580 -9.028 4.888 1.00 0.00 H new ATOM 0 HB2 TYR A 70 0.132 -8.039 6.633 1.00 0.00 H new ATOM 0 HB3 TYR A 70 -1.301 -8.500 5.735 1.00 0.00 H new ATOM 0 HD1 TYR A 70 1.506 -9.770 7.769 1.00 0.00 H new ATOM 0 HD2 TYR A 70 -2.106 -10.810 5.758 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.484 -11.932 8.932 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -2.125 -12.976 6.919 1.00 0.00 H new ATOM 0 HH TYR A 70 0.586 -14.067 8.843 1.00 0.00 H new ATOM 1114 N ALA A 71 -1.230 -9.732 3.283 1.00 0.00 N ATOM 1115 CA ALA A 71 -1.851 -10.697 2.375 1.00 0.00 C ATOM 1116 C ALA A 71 -3.307 -10.347 2.125 1.00 0.00 C ATOM 1117 O ALA A 71 -3.860 -9.451 2.761 1.00 0.00 O ATOM 1118 CB ALA A 71 -1.749 -12.110 2.937 1.00 0.00 C ATOM 0 H ALA A 71 -1.836 -8.955 3.546 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.314 -10.654 1.428 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.217 -12.811 2.246 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -0.700 -12.375 3.067 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -2.257 -12.156 3.900 1.00 0.00 H new ATOM 1124 N ASN A 72 -3.932 -11.079 1.210 1.00 0.00 N ATOM 1125 CA ASN A 72 -5.339 -10.869 0.898 1.00 0.00 C ATOM 1126 C ASN A 72 -6.173 -11.101 2.148 1.00 0.00 C ATOM 1127 O ASN A 72 -7.165 -10.422 2.371 1.00 0.00 O ATOM 1128 CB ASN A 72 -5.790 -11.811 -0.221 1.00 0.00 C ATOM 1129 CG ASN A 72 -5.184 -11.447 -1.562 1.00 0.00 C ATOM 1130 OD1 ASN A 72 -4.742 -10.318 -1.770 1.00 0.00 O ATOM 1131 ND2 ASN A 72 -5.163 -12.406 -2.481 1.00 0.00 N ATOM 0 H ASN A 72 -3.486 -11.822 0.672 1.00 0.00 H new ATOM 0 HA ASN A 72 -5.477 -9.844 0.555 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -5.512 -12.834 0.035 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -6.877 -11.786 -0.298 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -4.769 -12.220 -3.403 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -5.541 -13.328 -2.264 1.00 0.00 H new ATOM 1138 N LEU A 73 -5.735 -12.095 2.930 1.00 0.00 N ATOM 1139 CA LEU A 73 -6.354 -12.517 4.205 1.00 0.00 C ATOM 1140 C LEU A 73 -5.972 -11.609 5.399 1.00 0.00 C ATOM 1141 O LEU A 73 -5.099 -11.985 6.184 1.00 0.00 O ATOM 1142 CB LEU A 73 -5.954 -13.968 4.511 1.00 0.00 C ATOM 1143 CG LEU A 73 -6.836 -14.696 5.531 1.00 0.00 C ATOM 1144 CD1 LEU A 73 -6.598 -14.153 6.931 1.00 0.00 C ATOM 1145 CD2 LEU A 73 -8.305 -14.576 5.154 1.00 0.00 C ATOM 0 H LEU A 73 -4.913 -12.650 2.690 1.00 0.00 H new ATOM 0 HA LEU A 73 -7.433 -12.432 4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -5.965 -14.533 3.579 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -4.927 -13.974 4.876 1.00 0.00 H new ATOM 0 HG LEU A 73 -6.565 -15.752 5.522 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.234 -14.683 7.640 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -5.552 -14.296 7.204 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -6.837 -13.090 6.954 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -8.914 -15.100 5.891 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -8.590 -13.524 5.130 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -8.466 -15.018 4.171 1.00 0.00 H new ATOM 1157 N PRO A 74 -6.578 -10.416 5.581 1.00 0.00 N ATOM 1158 CA PRO A 74 -6.239 -9.535 6.689 1.00 0.00 C ATOM 1159 C PRO A 74 -7.153 -9.738 7.892 1.00 0.00 C ATOM 1160 O PRO A 74 -7.434 -8.800 8.637 1.00 0.00 O ATOM 1161 CB PRO A 74 -6.454 -8.158 6.073 1.00 0.00 C ATOM 1162 CG PRO A 74 -7.575 -8.347 5.098 1.00 0.00 C ATOM 1163 CD PRO A 74 -7.641 -9.823 4.765 1.00 0.00 C ATOM 0 HA PRO A 74 -5.235 -9.705 7.077 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -6.711 -7.420 6.833 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -5.552 -7.802 5.575 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -8.518 -8.008 5.527 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -7.404 -7.758 4.197 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -8.616 -10.245 5.011 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -7.475 -10.001 3.702 1.00 0.00 H new ATOM 1171 N ASN A 75 -7.618 -10.969 8.069 1.00 0.00 N ATOM 1172 CA ASN A 75 -8.506 -11.297 9.181 1.00 0.00 C ATOM 1173 C ASN A 75 -7.799 -12.165 10.217 1.00 0.00 C ATOM 1174 O ASN A 75 -8.030 -12.029 11.418 1.00 0.00 O ATOM 1175 CB ASN A 75 -9.754 -12.018 8.667 1.00 0.00 C ATOM 1176 CG ASN A 75 -10.605 -11.132 7.779 1.00 0.00 C ATOM 1177 OD1 ASN A 75 -10.959 -11.510 6.661 1.00 0.00 O ATOM 1178 ND2 ASN A 75 -10.938 -9.945 8.273 1.00 0.00 N ATOM 0 H ASN A 75 -7.396 -11.756 7.459 1.00 0.00 H new ATOM 0 HA ASN A 75 -8.799 -10.363 9.660 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -9.455 -12.906 8.110 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -10.349 -12.358 9.514 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.509 -9.305 7.721 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.622 -9.673 9.204 1.00 0.00 H new ATOM 1185 N ARG A 76 -6.939 -13.060 9.742 1.00 0.00 N ATOM 1186 CA ARG A 76 -6.198 -13.954 10.624 1.00 0.00 C ATOM 1187 C ARG A 76 -4.706 -13.938 10.294 1.00 0.00 C ATOM 1188 O ARG A 76 -4.200 -14.842 9.627 1.00 0.00 O ATOM 1189 CB ARG A 76 -6.743 -15.382 10.509 1.00 0.00 C ATOM 1190 CG ARG A 76 -8.208 -15.506 10.893 1.00 0.00 C ATOM 1191 CD ARG A 76 -8.910 -16.577 10.075 1.00 0.00 C ATOM 1192 NE ARG A 76 -9.411 -17.665 10.913 1.00 0.00 N ATOM 1193 CZ ARG A 76 -8.720 -18.769 11.195 1.00 0.00 C ATOM 1194 NH1 ARG A 76 -7.496 -18.938 10.708 1.00 0.00 N ATOM 1195 NH2 ARG A 76 -9.253 -19.706 11.966 1.00 0.00 N ATOM 0 H ARG A 76 -6.738 -13.185 8.750 1.00 0.00 H new ATOM 0 HA ARG A 76 -6.327 -13.602 11.648 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -6.614 -15.730 9.484 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.152 -16.040 11.146 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -8.288 -15.746 11.953 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -8.706 -14.548 10.744 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -9.740 -16.130 9.527 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -8.219 -16.979 9.334 1.00 0.00 H new ATOM 0 HE ARG A 76 -10.348 -17.573 11.306 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.080 -18.220 10.114 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -6.972 -19.785 10.928 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.192 -19.582 12.344 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -8.724 -20.551 12.182 1.00 0.00 H new ATOM 1209 N PRO A 77 -3.972 -12.898 10.743 1.00 0.00 N ATOM 1210 CA PRO A 77 -2.552 -12.760 10.484 1.00 0.00 C ATOM 1211 C PRO A 77 -1.699 -13.171 11.679 1.00 0.00 C ATOM 1212 O PRO A 77 -0.632 -12.608 11.919 1.00 0.00 O ATOM 1213 CB PRO A 77 -2.445 -11.257 10.249 1.00 0.00 C ATOM 1214 CG PRO A 77 -3.476 -10.652 11.163 1.00 0.00 C ATOM 1215 CD PRO A 77 -4.457 -11.752 11.524 1.00 0.00 C ATOM 0 HA PRO A 77 -2.198 -13.388 9.666 1.00 0.00 H new ATOM 0 HB2 PRO A 77 -1.445 -10.890 10.482 1.00 0.00 H new ATOM 0 HB3 PRO A 77 -2.642 -11.004 9.207 1.00 0.00 H new ATOM 0 HG2 PRO A 77 -3.005 -10.247 12.059 1.00 0.00 H new ATOM 0 HG3 PRO A 77 -3.989 -9.826 10.671 1.00 0.00 H new ATOM 0 HD2 PRO A 77 -4.452 -11.962 12.594 1.00 0.00 H new ATOM 0 HD3 PRO A 77 -5.479 -11.485 11.256 1.00 0.00 H new ATOM 1223 N LYS A 78 -2.178 -14.160 12.425 1.00 0.00 N ATOM 1224 CA LYS A 78 -1.462 -14.648 13.598 1.00 0.00 C ATOM 1225 C LYS A 78 -0.085 -15.184 13.216 1.00 0.00 C ATOM 1226 O LYS A 78 0.895 -14.966 13.930 1.00 0.00 O ATOM 1227 CB LYS A 78 -2.275 -15.746 14.286 1.00 0.00 C ATOM 1228 CG LYS A 78 -3.537 -15.233 14.961 1.00 0.00 C ATOM 1229 CD LYS A 78 -4.306 -16.360 15.632 1.00 0.00 C ATOM 1230 CE LYS A 78 -5.570 -15.849 16.305 1.00 0.00 C ATOM 1231 NZ LYS A 78 -5.282 -15.228 17.626 1.00 0.00 N ATOM 0 H LYS A 78 -3.059 -14.640 12.239 1.00 0.00 H new ATOM 0 HA LYS A 78 -1.325 -13.813 14.286 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -2.548 -16.501 13.549 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -1.649 -16.239 15.030 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -3.274 -14.479 15.702 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -4.174 -14.746 14.223 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -4.567 -17.115 14.891 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -3.670 -16.846 16.372 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -6.056 -15.118 15.658 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -6.270 -16.674 16.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -6.169 -14.892 18.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -4.842 -15.932 18.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.634 -14.425 17.498 1.00 0.00 H new ATOM 1245 N ARG A 79 -0.020 -15.882 12.088 1.00 0.00 N ATOM 1246 CA ARG A 79 1.235 -16.449 11.610 1.00 0.00 C ATOM 1247 C ARG A 79 2.088 -15.385 10.928 1.00 0.00 C ATOM 1248 O ARG A 79 1.608 -14.657 10.058 1.00 0.00 O ATOM 1249 CB ARG A 79 0.964 -17.599 10.639 1.00 0.00 C ATOM 1250 CG ARG A 79 0.383 -18.834 11.307 1.00 0.00 C ATOM 1251 CD ARG A 79 0.130 -19.945 10.301 1.00 0.00 C ATOM 1252 NE ARG A 79 -0.811 -19.540 9.260 1.00 0.00 N ATOM 1253 CZ ARG A 79 -2.134 -19.668 9.361 1.00 0.00 C ATOM 1254 NH1 ARG A 79 -2.677 -20.190 10.454 1.00 0.00 N ATOM 1255 NH2 ARG A 79 -2.916 -19.271 8.367 1.00 0.00 N ATOM 0 H ARG A 79 -0.823 -16.069 11.487 1.00 0.00 H new ATOM 0 HA ARG A 79 1.782 -16.832 12.472 1.00 0.00 H new ATOM 0 HB2 ARG A 79 0.276 -17.256 9.866 1.00 0.00 H new ATOM 0 HB3 ARG A 79 1.895 -17.870 10.140 1.00 0.00 H new ATOM 0 HG2 ARG A 79 1.068 -19.188 12.077 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -0.551 -18.574 11.806 1.00 0.00 H new ATOM 0 HD2 ARG A 79 1.074 -20.239 9.842 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -0.259 -20.821 10.820 1.00 0.00 H new ATOM 0 HE ARG A 79 -0.433 -19.135 8.404 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -2.081 -20.496 11.223 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -3.690 -20.285 10.525 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -2.505 -18.868 7.525 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -3.928 -19.369 8.444 1.00 0.00 H new ATOM 1269 N GLY A 80 3.352 -15.298 11.327 1.00 0.00 N ATOM 1270 CA GLY A 80 4.247 -14.319 10.740 1.00 0.00 C ATOM 1271 C GLY A 80 4.985 -13.503 11.783 1.00 0.00 C ATOM 1272 O GLY A 80 5.284 -13.995 12.870 1.00 0.00 O ATOM 0 H GLY A 80 3.772 -15.887 12.046 1.00 0.00 H new ATOM 0 HA2 GLY A 80 4.971 -14.829 10.105 1.00 0.00 H new ATOM 0 HA3 GLY A 80 3.675 -13.649 10.098 1.00 0.00 H new ATOM 1276 N GLU A 81 5.279 -12.252 11.447 1.00 0.00 N ATOM 1277 CA GLU A 81 5.987 -11.361 12.356 1.00 0.00 C ATOM 1278 C GLU A 81 5.050 -10.306 12.929 1.00 0.00 C ATOM 1279 O GLU A 81 3.988 -10.032 12.372 1.00 0.00 O ATOM 1280 CB GLU A 81 7.155 -10.683 11.640 1.00 0.00 C ATOM 1281 CG GLU A 81 8.294 -11.630 11.306 1.00 0.00 C ATOM 1282 CD GLU A 81 9.046 -12.096 12.536 1.00 0.00 C ATOM 1283 OE1 GLU A 81 8.953 -11.420 13.583 1.00 0.00 O ATOM 1284 OE2 GLU A 81 9.731 -13.138 12.455 1.00 0.00 O ATOM 0 H GLU A 81 5.037 -11.832 10.550 1.00 0.00 H new ATOM 0 HA GLU A 81 6.374 -11.963 13.178 1.00 0.00 H new ATOM 0 HB2 GLU A 81 6.791 -10.227 10.719 1.00 0.00 H new ATOM 0 HB3 GLU A 81 7.536 -9.876 12.267 1.00 0.00 H new ATOM 0 HG2 GLU A 81 7.897 -12.497 10.777 1.00 0.00 H new ATOM 0 HG3 GLU A 81 8.987 -11.133 10.628 1.00 0.00 H new ATOM 1292 N GLY A 82 5.455 -9.717 14.046 1.00 0.00 N ATOM 1293 CA GLY A 82 4.647 -8.692 14.681 1.00 0.00 C ATOM 1294 C GLY A 82 4.790 -7.344 14.002 1.00 0.00 C ATOM 1295 O GLY A 82 4.937 -6.319 14.668 1.00 0.00 O ATOM 0 H GLY A 82 6.330 -9.930 14.525 1.00 0.00 H new ATOM 0 HA2 GLY A 82 3.600 -8.995 14.664 1.00 0.00 H new ATOM 0 HA3 GLY A 82 4.936 -8.601 15.728 1.00 0.00 H new ATOM 1299 N ILE A 83 4.756 -7.345 12.673 1.00 0.00 N ATOM 1300 CA ILE A 83 4.893 -6.114 11.905 1.00 0.00 C ATOM 1301 C ILE A 83 3.535 -5.462 11.643 1.00 0.00 C ATOM 1302 O ILE A 83 2.642 -6.072 11.056 1.00 0.00 O ATOM 1303 CB ILE A 83 5.624 -6.364 10.561 1.00 0.00 C ATOM 1304 CG1 ILE A 83 4.753 -7.169 9.587 1.00 0.00 C ATOM 1305 CG2 ILE A 83 6.938 -7.089 10.808 1.00 0.00 C ATOM 1306 CD1 ILE A 83 4.358 -8.533 10.109 1.00 0.00 C ATOM 0 H ILE A 83 4.635 -8.185 12.106 1.00 0.00 H new ATOM 0 HA ILE A 83 5.494 -5.432 12.507 1.00 0.00 H new ATOM 0 HB ILE A 83 5.826 -5.395 10.105 1.00 0.00 H new ATOM 0 HG12 ILE A 83 3.851 -6.600 9.365 1.00 0.00 H new ATOM 0 HG13 ILE A 83 5.292 -7.291 8.648 1.00 0.00 H new ATOM 0 HG21 ILE A 83 7.444 -7.260 9.858 1.00 0.00 H new ATOM 0 HG22 ILE A 83 7.573 -6.482 11.453 1.00 0.00 H new ATOM 0 HG23 ILE A 83 6.740 -8.046 11.291 1.00 0.00 H new ATOM 0 HD11 ILE A 83 3.744 -9.043 9.367 1.00 0.00 H new ATOM 0 HD12 ILE A 83 5.254 -9.121 10.304 1.00 0.00 H new ATOM 0 HD13 ILE A 83 3.791 -8.419 11.033 1.00 0.00 H new ATOM 1318 N ASN A 84 3.390 -4.215 12.084 1.00 0.00 N ATOM 1319 CA ASN A 84 2.148 -3.475 11.897 1.00 0.00 C ATOM 1320 C ASN A 84 2.066 -2.913 10.482 1.00 0.00 C ATOM 1321 O ASN A 84 3.086 -2.713 9.825 1.00 0.00 O ATOM 1322 CB ASN A 84 2.047 -2.338 12.916 1.00 0.00 C ATOM 1323 CG ASN A 84 1.826 -2.846 14.328 1.00 0.00 C ATOM 1324 OD1 ASN A 84 2.580 -2.515 15.243 1.00 0.00 O ATOM 1325 ND2 ASN A 84 0.788 -3.653 14.511 1.00 0.00 N ATOM 0 H ASN A 84 4.119 -3.696 12.574 1.00 0.00 H new ATOM 0 HA ASN A 84 1.315 -4.162 12.049 1.00 0.00 H new ATOM 0 HB2 ASN A 84 2.960 -1.744 12.885 1.00 0.00 H new ATOM 0 HB3 ASN A 84 1.227 -1.676 12.638 1.00 0.00 H new ATOM 0 HD21 ASN A 84 0.589 -4.025 15.440 1.00 0.00 H new ATOM 0 HD22 ASN A 84 0.189 -3.901 13.723 1.00 0.00 H new ATOM 1332 N VAL A 85 0.847 -2.663 10.015 1.00 0.00 N ATOM 1333 CA VAL A 85 0.642 -2.127 8.675 1.00 0.00 C ATOM 1334 C VAL A 85 0.314 -0.638 8.722 1.00 0.00 C ATOM 1335 O VAL A 85 -0.440 -0.129 7.891 1.00 0.00 O ATOM 1336 CB VAL A 85 -0.487 -2.871 7.938 1.00 0.00 C ATOM 1337 CG1 VAL A 85 -0.021 -4.253 7.505 1.00 0.00 C ATOM 1338 CG2 VAL A 85 -1.724 -2.968 8.817 1.00 0.00 C ATOM 0 H VAL A 85 -0.011 -2.822 10.543 1.00 0.00 H new ATOM 0 HA VAL A 85 1.575 -2.272 8.130 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.749 -2.305 7.044 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.832 -4.764 6.986 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.834 -4.156 6.836 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.269 -4.831 8.383 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -2.511 -3.497 8.280 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.480 -3.511 9.730 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.069 -1.966 9.072 1.00 0.00 H new ATOM 1348 N ARG A 86 0.889 0.057 9.698 1.00 0.00 N ATOM 1349 CA ARG A 86 0.672 1.489 9.853 1.00 0.00 C ATOM 1350 C ARG A 86 1.537 2.271 8.866 1.00 0.00 C ATOM 1351 O ARG A 86 2.439 3.012 9.262 1.00 0.00 O ATOM 1352 CB ARG A 86 0.979 1.918 11.290 1.00 0.00 C ATOM 1353 CG ARG A 86 -0.028 1.401 12.306 1.00 0.00 C ATOM 1354 CD ARG A 86 0.319 1.852 13.717 1.00 0.00 C ATOM 1355 NE ARG A 86 1.635 1.374 14.136 1.00 0.00 N ATOM 1356 CZ ARG A 86 2.142 1.563 15.354 1.00 0.00 C ATOM 1357 NH1 ARG A 86 1.449 2.220 16.276 1.00 0.00 N ATOM 1358 NH2 ARG A 86 3.346 1.092 15.650 1.00 0.00 N ATOM 0 H ARG A 86 1.511 -0.351 10.396 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.374 1.707 9.640 1.00 0.00 H new ATOM 0 HB2 ARG A 86 1.973 1.563 11.562 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.005 3.007 11.338 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.025 1.756 12.045 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.058 0.312 12.268 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.296 2.941 13.766 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.438 1.486 14.411 1.00 0.00 H new ATOM 0 HE ARG A 86 2.199 0.865 13.455 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.522 2.584 16.054 1.00 0.00 H new ATOM 0 HH12 ARG A 86 1.843 2.361 17.206 1.00 0.00 H new ATOM 0 HH21 ARG A 86 3.883 0.586 14.946 1.00 0.00 H new ATOM 0 HH22 ARG A 86 3.735 1.236 16.582 1.00 0.00 H new ATOM 1372 N ALA A 87 1.264 2.093 7.578 1.00 0.00 N ATOM 1373 CA ALA A 87 2.024 2.772 6.535 1.00 0.00 C ATOM 1374 C ALA A 87 1.101 3.455 5.534 1.00 0.00 C ATOM 1375 O ALA A 87 -0.077 3.113 5.426 1.00 0.00 O ATOM 1376 CB ALA A 87 2.937 1.785 5.825 1.00 0.00 C ATOM 0 H ALA A 87 0.522 1.485 7.231 1.00 0.00 H new ATOM 0 HA ALA A 87 2.633 3.543 7.008 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.499 2.303 5.048 1.00 0.00 H new ATOM 0 HB2 ALA A 87 3.630 1.348 6.544 1.00 0.00 H new ATOM 0 HB3 ALA A 87 2.337 0.995 5.373 1.00 0.00 H new ATOM 1382 N ARG A 88 1.644 4.421 4.801 1.00 0.00 N ATOM 1383 CA ARG A 88 0.866 5.151 3.807 1.00 0.00 C ATOM 1384 C ARG A 88 1.145 4.608 2.411 1.00 0.00 C ATOM 1385 O ARG A 88 2.282 4.629 1.941 1.00 0.00 O ATOM 1386 CB ARG A 88 1.205 6.642 3.862 1.00 0.00 C ATOM 1387 CG ARG A 88 0.717 7.333 5.125 1.00 0.00 C ATOM 1388 CD ARG A 88 1.079 8.809 5.128 1.00 0.00 C ATOM 1389 NE ARG A 88 0.617 9.485 6.340 1.00 0.00 N ATOM 1390 CZ ARG A 88 0.742 10.793 6.557 1.00 0.00 C ATOM 1391 NH1 ARG A 88 1.315 11.574 5.649 1.00 0.00 N ATOM 1392 NH2 ARG A 88 0.294 11.322 7.688 1.00 0.00 N ATOM 0 H ARG A 88 2.617 4.716 4.876 1.00 0.00 H new ATOM 0 HA ARG A 88 -0.192 5.018 4.031 1.00 0.00 H new ATOM 0 HB2 ARG A 88 2.286 6.763 3.787 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.768 7.137 2.995 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -0.364 7.222 5.207 1.00 0.00 H new ATOM 0 HG3 ARG A 88 1.154 6.848 5.998 1.00 0.00 H new ATOM 0 HD2 ARG A 88 2.160 8.917 5.043 1.00 0.00 H new ATOM 0 HD3 ARG A 88 0.640 9.291 4.254 1.00 0.00 H new ATOM 0 HE ARG A 88 0.172 8.920 7.063 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.663 11.173 4.778 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.407 12.575 5.822 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.146 10.727 8.390 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.389 12.324 7.855 1.00 0.00 H new ATOM 1406 N ILE A 89 0.099 4.118 1.754 1.00 0.00 N ATOM 1407 CA ILE A 89 0.232 3.563 0.414 1.00 0.00 C ATOM 1408 C ILE A 89 -0.499 4.435 -0.606 1.00 0.00 C ATOM 1409 O ILE A 89 -1.668 4.776 -0.421 1.00 0.00 O ATOM 1410 CB ILE A 89 -0.322 2.119 0.358 1.00 0.00 C ATOM 1411 CG1 ILE A 89 0.448 1.226 1.332 1.00 0.00 C ATOM 1412 CG2 ILE A 89 -0.234 1.549 -1.055 1.00 0.00 C ATOM 1413 CD1 ILE A 89 -0.176 -0.140 1.524 1.00 0.00 C ATOM 0 H ILE A 89 -0.849 4.094 2.128 1.00 0.00 H new ATOM 0 HA ILE A 89 1.293 3.542 0.166 1.00 0.00 H new ATOM 0 HB ILE A 89 -1.373 2.147 0.647 1.00 0.00 H new ATOM 0 HG12 ILE A 89 1.468 1.102 0.969 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.511 1.726 2.298 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.630 0.534 -1.063 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.816 2.171 -1.735 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.807 1.535 -1.377 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.423 -0.718 2.227 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.187 -0.026 1.916 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.215 -0.660 0.567 1.00 0.00 H new ATOM 1425 N THR A 90 0.192 4.788 -1.685 1.00 0.00 N ATOM 1426 CA THR A 90 -0.401 5.610 -2.732 1.00 0.00 C ATOM 1427 C THR A 90 -0.544 4.815 -4.026 1.00 0.00 C ATOM 1428 O THR A 90 0.449 4.426 -4.640 1.00 0.00 O ATOM 1429 CB THR A 90 0.450 6.856 -2.976 1.00 0.00 C ATOM 1430 OG1 THR A 90 0.616 7.593 -1.778 1.00 0.00 O ATOM 1431 CG2 THR A 90 -0.139 7.791 -4.012 1.00 0.00 C ATOM 0 H THR A 90 1.161 4.518 -1.856 1.00 0.00 H new ATOM 0 HA THR A 90 -1.393 5.918 -2.402 1.00 0.00 H new ATOM 0 HB THR A 90 1.405 6.484 -3.347 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.165 8.385 -1.955 1.00 0.00 H new ATOM 0 HG21 THR A 90 0.515 8.654 -4.136 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.233 7.267 -4.963 1.00 0.00 H new ATOM 0 HG23 THR A 90 -1.123 8.125 -3.683 1.00 0.00 H new ATOM 1439 N CYS A 91 -1.786 4.579 -4.436 1.00 0.00 N ATOM 1440 CA CYS A 91 -2.061 3.834 -5.658 1.00 0.00 C ATOM 1441 C CYS A 91 -3.016 4.613 -6.554 1.00 0.00 C ATOM 1442 O CYS A 91 -4.064 5.073 -6.101 1.00 0.00 O ATOM 1443 CB CYS A 91 -2.662 2.468 -5.322 1.00 0.00 C ATOM 1444 SG CYS A 91 -1.594 1.422 -4.307 1.00 0.00 S ATOM 0 H CYS A 91 -2.619 4.894 -3.938 1.00 0.00 H new ATOM 0 HA CYS A 91 -1.121 3.688 -6.190 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -3.608 2.617 -4.801 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -2.889 1.944 -6.251 1.00 0.00 H new ATOM 0 HG CYS A 91 -0.887 0.648 -5.076 1.00 0.00 H new ATOM 1450 N PHE A 92 -2.661 4.760 -7.826 1.00 0.00 N ATOM 1451 CA PHE A 92 -3.510 5.490 -8.763 1.00 0.00 C ATOM 1452 C PHE A 92 -4.120 4.564 -9.811 1.00 0.00 C ATOM 1453 O PHE A 92 -4.647 5.017 -10.827 1.00 0.00 O ATOM 1454 CB PHE A 92 -2.721 6.624 -9.433 1.00 0.00 C ATOM 1455 CG PHE A 92 -1.737 6.171 -10.485 1.00 0.00 C ATOM 1456 CD1 PHE A 92 -1.044 4.977 -10.347 1.00 0.00 C ATOM 1457 CD2 PHE A 92 -1.511 6.945 -11.612 1.00 0.00 C ATOM 1458 CE1 PHE A 92 -0.145 4.566 -11.312 1.00 0.00 C ATOM 1459 CE2 PHE A 92 -0.612 6.537 -12.580 1.00 0.00 C ATOM 1460 CZ PHE A 92 0.071 5.346 -12.430 1.00 0.00 C ATOM 0 H PHE A 92 -1.801 4.388 -8.230 1.00 0.00 H new ATOM 0 HA PHE A 92 -4.332 5.925 -8.194 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -3.426 7.319 -9.889 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -2.181 7.177 -8.664 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.209 4.362 -9.475 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -2.043 7.877 -11.736 1.00 0.00 H new ATOM 0 HE1 PHE A 92 0.389 3.635 -11.192 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -0.444 7.150 -13.453 1.00 0.00 H new ATOM 0 HZ PHE A 92 0.773 5.026 -13.186 1.00 0.00 H new ATOM 1470 N ASN A 93 -4.050 3.270 -9.551 1.00 0.00 N ATOM 1471 CA ASN A 93 -4.598 2.276 -10.465 1.00 0.00 C ATOM 1472 C ASN A 93 -5.963 1.787 -9.990 1.00 0.00 C ATOM 1473 O ASN A 93 -6.053 0.983 -9.062 1.00 0.00 O ATOM 1474 CB ASN A 93 -3.637 1.093 -10.600 1.00 0.00 C ATOM 1475 CG ASN A 93 -4.096 0.092 -11.643 1.00 0.00 C ATOM 1476 OD1 ASN A 93 -5.271 0.055 -12.011 1.00 0.00 O ATOM 1477 ND2 ASN A 93 -3.169 -0.726 -12.125 1.00 0.00 N ATOM 0 H ASN A 93 -3.619 2.880 -8.713 1.00 0.00 H new ATOM 0 HA ASN A 93 -4.723 2.748 -11.440 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -2.646 1.462 -10.865 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -3.543 0.592 -9.636 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -3.418 -1.421 -12.829 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -2.207 -0.660 -11.791 1.00 0.00 H new ATOM 1484 N CYS A 94 -7.025 2.265 -10.632 1.00 0.00 N ATOM 1485 CA CYS A 94 -8.383 1.861 -10.274 1.00 0.00 C ATOM 1486 C CYS A 94 -9.404 2.563 -11.161 1.00 0.00 C ATOM 1487 O CYS A 94 -10.393 1.965 -11.585 1.00 0.00 O ATOM 1488 CB CYS A 94 -8.669 2.182 -8.804 1.00 0.00 C ATOM 1489 SG CYS A 94 -8.423 3.920 -8.367 1.00 0.00 S ATOM 0 H CYS A 94 -6.973 2.932 -11.402 1.00 0.00 H new ATOM 0 HA CYS A 94 -8.465 0.785 -10.425 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -9.698 1.903 -8.576 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -8.025 1.566 -8.177 1.00 0.00 H new ATOM 0 HG CYS A 94 -8.691 4.093 -7.107 1.00 0.00 H new ATOM 1495 N TYR A 95 -9.152 3.840 -11.431 1.00 0.00 N ATOM 1496 CA TYR A 95 -10.039 4.653 -12.262 1.00 0.00 C ATOM 1497 C TYR A 95 -10.401 3.959 -13.578 1.00 0.00 C ATOM 1498 O TYR A 95 -11.571 3.925 -13.960 1.00 0.00 O ATOM 1499 CB TYR A 95 -9.392 6.006 -12.555 1.00 0.00 C ATOM 1500 CG TYR A 95 -10.382 7.062 -12.985 1.00 0.00 C ATOM 1501 CD1 TYR A 95 -11.380 6.767 -13.904 1.00 0.00 C ATOM 1502 CD2 TYR A 95 -10.318 8.348 -12.473 1.00 0.00 C ATOM 1503 CE1 TYR A 95 -12.289 7.727 -14.301 1.00 0.00 C ATOM 1504 CE2 TYR A 95 -11.224 9.317 -12.864 1.00 0.00 C ATOM 1505 CZ TYR A 95 -12.208 9.001 -13.778 1.00 0.00 C ATOM 1506 OH TYR A 95 -13.111 9.961 -14.172 1.00 0.00 O ATOM 0 H TYR A 95 -8.333 4.340 -11.084 1.00 0.00 H new ATOM 0 HA TYR A 95 -10.962 4.797 -11.700 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -8.868 6.351 -11.664 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -8.643 5.881 -13.337 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -11.446 5.770 -14.315 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -9.549 8.598 -11.757 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -13.059 7.482 -15.017 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -11.162 10.315 -12.456 1.00 0.00 H new ATOM 0 HH TYR A 95 -12.916 10.803 -13.710 1.00 0.00 H new ATOM 1766 N GLN A 111 -17.164 8.014 -15.033 1.00 0.00 N ATOM 1767 CA GLN A 111 -18.287 7.089 -15.111 1.00 0.00 C ATOM 1768 C GLN A 111 -18.434 6.293 -13.817 1.00 0.00 C ATOM 1769 O GLN A 111 -19.546 6.055 -13.346 1.00 0.00 O ATOM 1770 CB GLN A 111 -18.104 6.133 -16.291 1.00 0.00 C ATOM 1771 CG GLN A 111 -18.254 6.803 -17.647 1.00 0.00 C ATOM 1772 CD GLN A 111 -19.622 7.427 -17.843 1.00 0.00 C ATOM 1773 OE1 GLN A 111 -20.647 6.783 -17.617 1.00 0.00 O ATOM 1774 NE2 GLN A 111 -19.645 8.686 -18.263 1.00 0.00 N ATOM 0 HA GLN A 111 -19.195 7.674 -15.259 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -17.116 5.677 -16.228 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -18.833 5.327 -16.211 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -17.489 7.572 -17.754 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -18.079 6.068 -18.432 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -18.771 9.181 -18.438 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -20.537 9.158 -18.411 1.00 0.00 H new ATOM 1783 N LEU A 112 -17.306 5.880 -13.249 1.00 0.00 N ATOM 1784 CA LEU A 112 -17.314 5.105 -12.013 1.00 0.00 C ATOM 1785 C LEU A 112 -16.360 5.696 -10.975 1.00 0.00 C ATOM 1786 O LEU A 112 -15.952 5.012 -10.036 1.00 0.00 O ATOM 1787 CB LEU A 112 -16.935 3.652 -12.304 1.00 0.00 C ATOM 1788 CG LEU A 112 -15.478 3.431 -12.713 1.00 0.00 C ATOM 1789 CD1 LEU A 112 -15.150 1.947 -12.739 1.00 0.00 C ATOM 1790 CD2 LEU A 112 -15.203 4.064 -14.070 1.00 0.00 C ATOM 0 H LEU A 112 -16.376 6.068 -13.624 1.00 0.00 H new ATOM 0 HA LEU A 112 -18.322 5.142 -11.601 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -17.142 3.054 -11.416 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -17.580 3.277 -13.098 1.00 0.00 H new ATOM 0 HG LEU A 112 -14.837 3.911 -11.974 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -14.109 1.809 -13.032 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -15.307 1.522 -11.747 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -15.798 1.444 -13.456 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -14.162 3.897 -14.345 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -15.853 3.614 -14.820 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.397 5.135 -14.018 1.00 0.00 H new ATOM 1802 N VAL A 113 -16.004 6.964 -11.148 1.00 0.00 N ATOM 1803 CA VAL A 113 -15.096 7.630 -10.221 1.00 0.00 C ATOM 1804 C VAL A 113 -15.670 7.657 -8.810 1.00 0.00 C ATOM 1805 O VAL A 113 -15.006 7.274 -7.847 1.00 0.00 O ATOM 1806 CB VAL A 113 -14.793 9.068 -10.684 1.00 0.00 C ATOM 1807 CG1 VAL A 113 -16.052 9.922 -10.698 1.00 0.00 C ATOM 1808 CG2 VAL A 113 -13.716 9.698 -9.813 1.00 0.00 C ATOM 0 H VAL A 113 -16.328 7.549 -11.918 1.00 0.00 H new ATOM 0 HA VAL A 113 -14.168 7.058 -10.210 1.00 0.00 H new ATOM 0 HB VAL A 113 -14.418 9.018 -11.706 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -15.804 10.930 -11.029 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -16.781 9.485 -11.381 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -16.475 9.963 -9.694 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -13.517 10.713 -10.157 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -14.056 9.726 -8.778 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -12.803 9.107 -9.879 1.00 0.00 H new ATOM 1818 N LYS A 114 -16.917 8.094 -8.704 1.00 0.00 N ATOM 1819 CA LYS A 114 -17.601 8.153 -7.425 1.00 0.00 C ATOM 1820 C LYS A 114 -17.754 6.751 -6.854 1.00 0.00 C ATOM 1821 O LYS A 114 -17.679 6.543 -5.643 1.00 0.00 O ATOM 1822 CB LYS A 114 -18.973 8.815 -7.578 1.00 0.00 C ATOM 1823 CG LYS A 114 -18.899 10.304 -7.876 1.00 0.00 C ATOM 1824 CD LYS A 114 -20.285 10.912 -8.017 1.00 0.00 C ATOM 1825 CE LYS A 114 -20.215 12.401 -8.315 1.00 0.00 C ATOM 1826 NZ LYS A 114 -21.563 12.985 -8.551 1.00 0.00 N ATOM 0 H LYS A 114 -17.476 8.414 -9.495 1.00 0.00 H new ATOM 0 HA LYS A 114 -17.005 8.754 -6.738 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -19.519 8.319 -8.380 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -19.544 8.664 -6.662 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -18.358 10.810 -7.076 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -18.334 10.465 -8.794 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -20.826 10.405 -8.816 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -20.849 10.750 -7.098 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -19.738 12.916 -7.481 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -19.589 12.566 -9.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -21.471 14.001 -8.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -22.009 12.512 -9.363 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -22.153 12.850 -7.705 1.00 0.00 H new ATOM 1840 N ARG A 115 -17.987 5.796 -7.747 1.00 0.00 N ATOM 1841 CA ARG A 115 -18.175 4.404 -7.350 1.00 0.00 C ATOM 1842 C ARG A 115 -16.943 3.856 -6.634 1.00 0.00 C ATOM 1843 O ARG A 115 -17.060 3.121 -5.654 1.00 0.00 O ATOM 1844 CB ARG A 115 -18.480 3.546 -8.578 1.00 0.00 C ATOM 1845 CG ARG A 115 -19.848 3.813 -9.182 1.00 0.00 C ATOM 1846 CD ARG A 115 -20.100 2.933 -10.396 1.00 0.00 C ATOM 1847 NE ARG A 115 -21.411 3.182 -10.992 1.00 0.00 N ATOM 1848 CZ ARG A 115 -21.784 2.724 -12.187 1.00 0.00 C ATOM 1849 NH1 ARG A 115 -20.950 1.995 -12.918 1.00 0.00 N ATOM 1850 NH2 ARG A 115 -22.995 2.999 -12.651 1.00 0.00 N ATOM 0 H ARG A 115 -18.050 5.960 -8.752 1.00 0.00 H new ATOM 0 HA ARG A 115 -19.016 4.366 -6.658 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -17.717 3.726 -9.335 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -18.413 2.494 -8.301 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -20.619 3.632 -8.433 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -19.922 4.862 -9.469 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -19.324 3.112 -11.140 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -20.027 1.885 -10.105 1.00 0.00 H new ATOM 0 HE ARG A 115 -22.081 3.740 -10.462 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -20.017 1.782 -12.566 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -21.242 1.648 -13.831 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -23.639 3.560 -12.094 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -23.282 2.650 -13.565 1.00 0.00 H new ATOM 1864 N HIS A 116 -15.761 4.211 -7.130 1.00 0.00 N ATOM 1865 CA HIS A 116 -14.516 3.742 -6.532 1.00 0.00 C ATOM 1866 C HIS A 116 -14.379 4.223 -5.091 1.00 0.00 C ATOM 1867 O HIS A 116 -13.936 3.477 -4.218 1.00 0.00 O ATOM 1868 CB HIS A 116 -13.317 4.218 -7.356 1.00 0.00 C ATOM 1869 CG HIS A 116 -13.196 3.540 -8.686 1.00 0.00 C ATOM 1870 ND1 HIS A 116 -12.839 2.215 -8.824 1.00 0.00 N ATOM 1871 CD2 HIS A 116 -13.386 4.010 -9.942 1.00 0.00 C ATOM 1872 CE1 HIS A 116 -12.813 1.899 -10.107 1.00 0.00 C ATOM 1873 NE2 HIS A 116 -13.141 2.970 -10.806 1.00 0.00 N ATOM 0 H HIS A 116 -15.640 4.819 -7.940 1.00 0.00 H new ATOM 0 HA HIS A 116 -14.538 2.652 -6.528 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -13.398 5.294 -7.512 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -12.404 4.047 -6.786 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -12.628 1.578 -8.056 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -13.676 5.014 -10.214 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -12.566 0.930 -10.514 1.00 0.00 H new ATOM 1882 N ILE A 117 -14.762 5.471 -4.847 1.00 0.00 N ATOM 1883 CA ILE A 117 -14.675 6.046 -3.510 1.00 0.00 C ATOM 1884 C ILE A 117 -15.688 5.393 -2.567 1.00 0.00 C ATOM 1885 O ILE A 117 -15.388 5.129 -1.403 1.00 0.00 O ATOM 1886 CB ILE A 117 -14.911 7.576 -3.551 1.00 0.00 C ATOM 1887 CG1 ILE A 117 -13.862 8.242 -4.443 1.00 0.00 C ATOM 1888 CG2 ILE A 117 -14.863 8.178 -2.150 1.00 0.00 C ATOM 1889 CD1 ILE A 117 -12.441 8.011 -3.981 1.00 0.00 C ATOM 0 H ILE A 117 -15.135 6.103 -5.556 1.00 0.00 H new ATOM 0 HA ILE A 117 -13.670 5.854 -3.134 1.00 0.00 H new ATOM 0 HB ILE A 117 -15.904 7.756 -3.964 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -13.970 7.866 -5.460 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -14.054 9.314 -4.478 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -15.032 9.253 -2.210 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -15.637 7.723 -1.532 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -13.886 7.989 -1.706 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -11.752 8.512 -4.661 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -12.315 8.413 -2.975 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -12.230 6.942 -3.973 1.00 0.00 H new ATOM 1901 N GLU A 118 -16.892 5.144 -3.075 1.00 0.00 N ATOM 1902 CA GLU A 118 -17.946 4.535 -2.273 1.00 0.00 C ATOM 1903 C GLU A 118 -17.549 3.143 -1.790 1.00 0.00 C ATOM 1904 O GLU A 118 -17.816 2.776 -0.647 1.00 0.00 O ATOM 1905 CB GLU A 118 -19.245 4.457 -3.079 1.00 0.00 C ATOM 1906 CG GLU A 118 -19.887 5.812 -3.327 1.00 0.00 C ATOM 1907 CD GLU A 118 -21.172 5.711 -4.126 1.00 0.00 C ATOM 1908 OE1 GLU A 118 -21.091 5.588 -5.366 1.00 0.00 O ATOM 1909 OE2 GLU A 118 -22.259 5.756 -3.512 1.00 0.00 O ATOM 0 H GLU A 118 -17.161 5.354 -4.036 1.00 0.00 H new ATOM 0 HA GLU A 118 -18.101 5.164 -1.396 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -19.040 3.980 -4.037 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -19.954 3.819 -2.550 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -20.095 6.292 -2.371 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -19.183 6.452 -3.858 1.00 0.00 H new ATOM 1917 N ARG A 119 -16.917 2.368 -2.667 1.00 0.00 N ATOM 1918 CA ARG A 119 -16.498 1.014 -2.320 1.00 0.00 C ATOM 1919 C ARG A 119 -15.452 1.022 -1.210 1.00 0.00 C ATOM 1920 O ARG A 119 -15.518 0.219 -0.278 1.00 0.00 O ATOM 1921 CB ARG A 119 -15.944 0.301 -3.554 1.00 0.00 C ATOM 1922 CG ARG A 119 -17.001 -0.006 -4.603 1.00 0.00 C ATOM 1923 CD ARG A 119 -17.955 -1.090 -4.131 1.00 0.00 C ATOM 1924 NE ARG A 119 -18.983 -1.390 -5.127 1.00 0.00 N ATOM 1925 CZ ARG A 119 -20.147 -0.747 -5.212 1.00 0.00 C ATOM 1926 NH1 ARG A 119 -20.439 0.230 -4.362 1.00 0.00 N ATOM 1927 NH2 ARG A 119 -21.022 -1.083 -6.149 1.00 0.00 N ATOM 0 H ARG A 119 -16.685 2.653 -3.619 1.00 0.00 H new ATOM 0 HA ARG A 119 -17.374 0.477 -1.955 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -15.167 0.920 -4.003 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -15.470 -0.630 -3.244 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -17.562 0.900 -4.831 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -16.517 -0.323 -5.527 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -17.392 -1.996 -3.908 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -18.431 -0.774 -3.203 1.00 0.00 H new ATOM 0 HE ARG A 119 -18.798 -2.136 -5.797 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -19.770 0.493 -3.638 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -21.332 0.718 -4.433 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -20.804 -1.833 -6.805 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -21.913 -0.591 -6.215 1.00 0.00 H new ATOM 1941 N LEU A 120 -14.488 1.932 -1.309 1.00 0.00 N ATOM 1942 CA LEU A 120 -13.434 2.039 -0.307 1.00 0.00 C ATOM 1943 C LEU A 120 -13.978 2.583 1.010 1.00 0.00 C ATOM 1944 O LEU A 120 -13.585 2.139 2.087 1.00 0.00 O ATOM 1945 CB LEU A 120 -12.287 2.914 -0.815 1.00 0.00 C ATOM 1946 CG LEU A 120 -12.667 4.351 -1.169 1.00 0.00 C ATOM 1947 CD1 LEU A 120 -12.531 5.254 0.047 1.00 0.00 C ATOM 1948 CD2 LEU A 120 -11.797 4.857 -2.311 1.00 0.00 C ATOM 0 H LEU A 120 -14.415 2.605 -2.072 1.00 0.00 H new ATOM 0 HA LEU A 120 -13.048 1.036 -0.124 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -11.507 2.939 -0.054 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -11.856 2.442 -1.698 1.00 0.00 H new ATOM 0 HG LEU A 120 -13.708 4.367 -1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -12.806 6.273 -0.224 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -13.190 4.899 0.839 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -11.499 5.238 0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -12.077 5.882 -2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -10.750 4.828 -2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -11.941 4.224 -3.186 1.00 0.00 H new ATOM 1960 N LYS A 121 -14.883 3.555 0.914 1.00 0.00 N ATOM 1961 CA LYS A 121 -15.471 4.170 2.095 1.00 0.00 C ATOM 1962 C LYS A 121 -16.212 3.132 2.936 1.00 0.00 C ATOM 1963 O LYS A 121 -16.135 3.148 4.164 1.00 0.00 O ATOM 1964 CB LYS A 121 -16.437 5.274 1.669 1.00 0.00 C ATOM 1965 CG LYS A 121 -16.929 6.130 2.817 1.00 0.00 C ATOM 1966 CD LYS A 121 -17.876 7.212 2.329 1.00 0.00 C ATOM 1967 CE LYS A 121 -17.681 8.500 3.103 1.00 0.00 C ATOM 1968 NZ LYS A 121 -18.651 8.629 4.226 1.00 0.00 N ATOM 0 H LYS A 121 -15.223 3.931 0.029 1.00 0.00 H new ATOM 0 HA LYS A 121 -14.671 4.595 2.700 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -15.944 5.913 0.936 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -17.295 4.822 1.171 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -17.436 5.503 3.550 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -16.079 6.588 3.323 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -17.709 7.394 1.267 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -18.906 6.873 2.436 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -16.665 8.537 3.496 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -17.793 9.349 2.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -18.483 9.524 4.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -19.621 8.620 3.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -18.528 7.833 4.884 1.00 0.00 H new ATOM 1982 N LYS A 122 -16.921 2.226 2.267 1.00 0.00 N ATOM 1983 CA LYS A 122 -17.667 1.180 2.954 1.00 0.00 C ATOM 1984 C LYS A 122 -16.719 0.303 3.766 1.00 0.00 C ATOM 1985 O LYS A 122 -17.031 -0.093 4.886 1.00 0.00 O ATOM 1986 CB LYS A 122 -18.426 0.319 1.941 1.00 0.00 C ATOM 1987 CG LYS A 122 -19.407 1.105 1.086 1.00 0.00 C ATOM 1988 CD LYS A 122 -20.359 1.929 1.935 1.00 0.00 C ATOM 1989 CE LYS A 122 -21.445 2.576 1.090 1.00 0.00 C ATOM 1990 NZ LYS A 122 -21.102 3.978 0.721 1.00 0.00 N ATOM 0 H LYS A 122 -16.993 2.197 1.250 1.00 0.00 H new ATOM 0 HA LYS A 122 -18.383 1.651 3.628 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -17.708 -0.179 1.290 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -18.967 -0.462 2.475 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -18.857 1.763 0.413 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -19.978 0.417 0.462 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -20.817 1.292 2.692 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -19.800 2.701 2.464 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -21.598 1.989 0.184 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -22.387 2.565 1.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -21.868 4.383 0.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -20.981 4.545 1.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -20.217 3.987 0.175 1.00 0.00 H new ATOM 2004 N ASN A 123 -15.557 0.024 3.181 1.00 0.00 N ATOM 2005 CA ASN A 123 -14.518 -0.793 3.810 1.00 0.00 C ATOM 2006 C ASN A 123 -13.889 -0.067 5.001 1.00 0.00 C ATOM 2007 O ASN A 123 -13.019 0.785 4.818 1.00 0.00 O ATOM 2008 CB ASN A 123 -13.433 -1.148 2.789 1.00 0.00 C ATOM 2009 CG ASN A 123 -12.472 -2.201 3.306 1.00 0.00 C ATOM 2010 OD1 ASN A 123 -11.272 -1.956 3.433 1.00 0.00 O ATOM 2011 ND2 ASN A 123 -12.996 -3.385 3.607 1.00 0.00 N ATOM 0 H ASN A 123 -15.306 0.360 2.251 1.00 0.00 H new ATOM 0 HA ASN A 123 -14.986 -1.708 4.173 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -13.903 -1.508 1.874 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -12.875 -0.248 2.528 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -12.398 -4.133 3.958 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -13.996 -3.546 3.487 1.00 0.00 H new ATOM 2018 N PRO A 124 -14.329 -0.362 6.243 1.00 0.00 N ATOM 2019 CA PRO A 124 -13.798 0.299 7.432 1.00 0.00 C ATOM 2020 C PRO A 124 -12.522 -0.357 7.946 1.00 0.00 C ATOM 2021 O PRO A 124 -12.232 -0.322 9.142 1.00 0.00 O ATOM 2022 CB PRO A 124 -14.924 0.125 8.441 1.00 0.00 C ATOM 2023 CG PRO A 124 -15.550 -1.181 8.081 1.00 0.00 C ATOM 2024 CD PRO A 124 -15.374 -1.350 6.590 1.00 0.00 C ATOM 0 HA PRO A 124 -13.521 1.335 7.239 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -14.544 0.115 9.462 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -15.644 0.941 8.377 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -15.076 -2.000 8.622 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -16.606 -1.191 8.350 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -15.066 -2.364 6.336 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -16.302 -1.155 6.053 1.00 0.00 H new ATOM 2032 N ASN A 125 -11.758 -0.939 7.029 1.00 0.00 N ATOM 2033 CA ASN A 125 -10.499 -1.588 7.377 1.00 0.00 C ATOM 2034 C ASN A 125 -9.318 -0.661 7.080 1.00 0.00 C ATOM 2035 O ASN A 125 -8.224 -0.840 7.615 1.00 0.00 O ATOM 2036 CB ASN A 125 -10.344 -2.896 6.600 1.00 0.00 C ATOM 2037 CG ASN A 125 -11.312 -3.964 7.068 1.00 0.00 C ATOM 2038 OD1 ASN A 125 -11.802 -3.923 8.197 1.00 0.00 O ATOM 2039 ND2 ASN A 125 -11.593 -4.929 6.200 1.00 0.00 N ATOM 0 H ASN A 125 -11.989 -0.975 6.036 1.00 0.00 H new ATOM 0 HA ASN A 125 -10.510 -1.810 8.444 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -10.502 -2.706 5.538 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -9.323 -3.262 6.709 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -12.238 -5.676 6.459 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -11.164 -4.923 5.275 1.00 0.00 H new ATOM 2046 N SER A 126 -9.554 0.331 6.224 1.00 0.00 N ATOM 2047 CA SER A 126 -8.524 1.293 5.851 1.00 0.00 C ATOM 2048 C SER A 126 -9.016 2.719 6.077 1.00 0.00 C ATOM 2049 O SER A 126 -10.218 2.983 6.040 1.00 0.00 O ATOM 2050 CB SER A 126 -8.123 1.105 4.387 1.00 0.00 C ATOM 2051 OG SER A 126 -9.231 1.291 3.522 1.00 0.00 O ATOM 0 H SER A 126 -10.456 0.488 5.774 1.00 0.00 H new ATOM 0 HA SER A 126 -7.651 1.120 6.481 1.00 0.00 H new ATOM 0 HB2 SER A 126 -7.335 1.813 4.130 1.00 0.00 H new ATOM 0 HB3 SER A 126 -7.712 0.105 4.246 1.00 0.00 H new ATOM 0 HG SER A 126 -8.945 1.167 2.593 1.00 0.00 H new ATOM 2057 N LYS A 127 -8.084 3.636 6.315 1.00 0.00 N ATOM 2058 CA LYS A 127 -8.432 5.033 6.550 1.00 0.00 C ATOM 2059 C LYS A 127 -8.228 5.867 5.288 1.00 0.00 C ATOM 2060 O LYS A 127 -7.119 5.947 4.757 1.00 0.00 O ATOM 2061 CB LYS A 127 -7.590 5.599 7.696 1.00 0.00 C ATOM 2062 CG LYS A 127 -7.889 7.056 8.015 1.00 0.00 C ATOM 2063 CD LYS A 127 -7.025 7.562 9.158 1.00 0.00 C ATOM 2064 CE LYS A 127 -7.322 9.019 9.480 1.00 0.00 C ATOM 2065 NZ LYS A 127 -6.549 9.495 10.660 1.00 0.00 N ATOM 0 H LYS A 127 -7.084 3.438 6.350 1.00 0.00 H new ATOM 0 HA LYS A 127 -9.486 5.080 6.823 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -7.759 4.999 8.590 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -6.535 5.501 7.442 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -7.717 7.667 7.129 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -8.941 7.164 8.277 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -7.197 6.950 10.044 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -5.973 7.454 8.895 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -7.083 9.638 8.615 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -8.388 9.138 9.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -6.779 10.492 10.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -6.796 8.921 11.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -5.531 9.405 10.467 1.00 0.00 H new ATOM 2079 N PHE A 128 -9.305 6.486 4.812 1.00 0.00 N ATOM 2080 CA PHE A 128 -9.246 7.313 3.612 1.00 0.00 C ATOM 2081 C PHE A 128 -8.478 8.605 3.874 1.00 0.00 C ATOM 2082 O PHE A 128 -8.841 9.390 4.749 1.00 0.00 O ATOM 2083 CB PHE A 128 -10.662 7.638 3.126 1.00 0.00 C ATOM 2084 CG PHE A 128 -10.701 8.491 1.888 1.00 0.00 C ATOM 2085 CD1 PHE A 128 -10.721 9.873 1.986 1.00 0.00 C ATOM 2086 CD2 PHE A 128 -10.714 7.912 0.630 1.00 0.00 C ATOM 2087 CE1 PHE A 128 -10.758 10.661 0.851 1.00 0.00 C ATOM 2088 CE2 PHE A 128 -10.750 8.695 -0.508 1.00 0.00 C ATOM 2089 CZ PHE A 128 -10.771 10.071 -0.398 1.00 0.00 C ATOM 0 H PHE A 128 -10.229 6.430 5.240 1.00 0.00 H new ATOM 0 HA PHE A 128 -8.720 6.752 2.840 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -11.191 6.705 2.930 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -11.201 8.148 3.924 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -10.708 10.340 2.960 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -10.696 6.836 0.537 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -10.777 11.737 0.941 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -10.762 8.231 -1.483 1.00 0.00 H new ATOM 0 HZ PHE A 128 -10.798 10.685 -1.286 1.00 0.00 H new ATOM 2099 N GLU A 129 -7.418 8.822 3.100 1.00 0.00 N ATOM 2100 CA GLU A 129 -6.605 10.023 3.238 1.00 0.00 C ATOM 2101 C GLU A 129 -7.113 11.126 2.311 1.00 0.00 C ATOM 2102 O GLU A 129 -7.775 12.066 2.750 1.00 0.00 O ATOM 2103 CB GLU A 129 -5.138 9.712 2.937 1.00 0.00 C ATOM 2104 CG GLU A 129 -4.470 8.851 3.997 1.00 0.00 C ATOM 2105 CD GLU A 129 -4.476 9.504 5.366 1.00 0.00 C ATOM 2106 OE1 GLU A 129 -3.905 10.606 5.500 1.00 0.00 O ATOM 2107 OE2 GLU A 129 -5.052 8.913 6.302 1.00 0.00 O ATOM 0 H GLU A 129 -7.103 8.181 2.372 1.00 0.00 H new ATOM 0 HA GLU A 129 -6.684 10.373 4.267 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -5.073 9.205 1.974 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -4.589 10.649 2.842 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.981 7.890 4.054 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -3.441 8.648 3.700 1.00 0.00 H new ATOM 2115 N SER A 130 -6.799 10.998 1.024 1.00 0.00 N ATOM 2116 CA SER A 130 -7.224 11.977 0.029 1.00 0.00 C ATOM 2117 C SER A 130 -7.289 11.353 -1.360 1.00 0.00 C ATOM 2118 O SER A 130 -6.381 10.631 -1.771 1.00 0.00 O ATOM 2119 CB SER A 130 -6.277 13.176 0.015 1.00 0.00 C ATOM 2120 OG SER A 130 -6.082 13.690 1.321 1.00 0.00 O ATOM 0 H SER A 130 -6.251 10.225 0.646 1.00 0.00 H new ATOM 0 HA SER A 130 -8.223 12.317 0.303 1.00 0.00 H new ATOM 0 HB2 SER A 130 -5.318 12.880 -0.409 1.00 0.00 H new ATOM 0 HB3 SER A 130 -6.683 13.956 -0.629 1.00 0.00 H new ATOM 0 HG SER A 130 -5.471 14.455 1.284 1.00 0.00 H new ATOM 2126 N TYR A 131 -8.366 11.638 -2.082 1.00 0.00 N ATOM 2127 CA TYR A 131 -8.548 11.107 -3.430 1.00 0.00 C ATOM 2128 C TYR A 131 -8.688 12.236 -4.446 1.00 0.00 C ATOM 2129 O TYR A 131 -9.414 13.205 -4.216 1.00 0.00 O ATOM 2130 CB TYR A 131 -9.779 10.198 -3.480 1.00 0.00 C ATOM 2131 CG TYR A 131 -10.042 9.602 -4.846 1.00 0.00 C ATOM 2132 CD1 TYR A 131 -10.846 10.259 -5.770 1.00 0.00 C ATOM 2133 CD2 TYR A 131 -9.487 8.382 -5.211 1.00 0.00 C ATOM 2134 CE1 TYR A 131 -11.089 9.716 -7.017 1.00 0.00 C ATOM 2135 CE2 TYR A 131 -9.724 7.833 -6.457 1.00 0.00 C ATOM 2136 CZ TYR A 131 -10.525 8.504 -7.356 1.00 0.00 C ATOM 2137 OH TYR A 131 -10.763 7.963 -8.598 1.00 0.00 O ATOM 0 H TYR A 131 -9.128 12.234 -1.758 1.00 0.00 H new ATOM 0 HA TYR A 131 -7.665 10.523 -3.687 1.00 0.00 H new ATOM 0 HB2 TYR A 131 -9.652 9.390 -2.759 1.00 0.00 H new ATOM 0 HB3 TYR A 131 -10.654 10.769 -3.168 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -11.288 11.209 -5.509 1.00 0.00 H new ATOM 0 HD2 TYR A 131 -8.859 7.853 -4.509 1.00 0.00 H new ATOM 0 HE1 TYR A 131 -11.718 10.238 -7.723 1.00 0.00 H new ATOM 0 HE2 TYR A 131 -9.284 6.884 -6.725 1.00 0.00 H new ATOM 0 HH TYR A 131 -10.292 7.107 -8.678 1.00 0.00 H new ATOM 2147 N ASP A 132 -7.997 12.105 -5.574 1.00 0.00 N ATOM 2148 CA ASP A 132 -8.054 13.113 -6.628 1.00 0.00 C ATOM 2149 C ASP A 132 -8.802 12.578 -7.844 1.00 0.00 C ATOM 2150 O ASP A 132 -8.395 11.586 -8.447 1.00 0.00 O ATOM 2151 CB ASP A 132 -6.643 13.543 -7.029 1.00 0.00 C ATOM 2152 CG ASP A 132 -5.953 14.352 -5.948 1.00 0.00 C ATOM 2153 OD1 ASP A 132 -6.659 14.900 -5.075 1.00 0.00 O ATOM 2154 OD2 ASP A 132 -4.708 14.437 -5.974 1.00 0.00 O ATOM 0 H ASP A 132 -7.391 11.311 -5.782 1.00 0.00 H new ATOM 0 HA ASP A 132 -8.591 13.980 -6.243 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -6.047 12.658 -7.252 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -6.693 14.133 -7.944 1.00 0.00 H new ATOM 2160 N ALA A 133 -9.900 13.236 -8.194 1.00 0.00 N ATOM 2161 CA ALA A 133 -10.713 12.827 -9.334 1.00 0.00 C ATOM 2162 C ALA A 133 -10.005 13.084 -10.664 1.00 0.00 C ATOM 2163 O ALA A 133 -10.101 12.284 -11.594 1.00 0.00 O ATOM 2164 CB ALA A 133 -12.052 13.544 -9.307 1.00 0.00 C ATOM 0 H ALA A 133 -10.250 14.059 -7.703 1.00 0.00 H new ATOM 0 HA ALA A 133 -10.875 11.752 -9.251 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -12.650 13.231 -10.163 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -12.579 13.296 -8.386 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -11.889 14.621 -9.353 1.00 0.00 H new ATOM 2170 N ASP A 134 -9.318 14.218 -10.754 1.00 0.00 N ATOM 2171 CA ASP A 134 -8.617 14.596 -11.978 1.00 0.00 C ATOM 2172 C ASP A 134 -7.543 13.581 -12.365 1.00 0.00 C ATOM 2173 O ASP A 134 -7.374 13.270 -13.543 1.00 0.00 O ATOM 2174 CB ASP A 134 -7.983 15.979 -11.815 1.00 0.00 C ATOM 2175 CG ASP A 134 -9.014 17.089 -11.770 1.00 0.00 C ATOM 2176 OD1 ASP A 134 -8.684 18.185 -11.271 1.00 0.00 O ATOM 2177 OD2 ASP A 134 -10.152 16.865 -12.235 1.00 0.00 O ATOM 0 H ASP A 134 -9.231 14.892 -9.994 1.00 0.00 H new ATOM 0 HA ASP A 134 -9.356 14.619 -12.779 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -7.393 15.999 -10.899 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -7.295 16.160 -12.641 1.00 0.00 H new ATOM 2183 N SER A 135 -6.815 13.072 -11.378 1.00 0.00 N ATOM 2184 CA SER A 135 -5.756 12.101 -11.643 1.00 0.00 C ATOM 2185 C SER A 135 -6.203 10.679 -11.320 1.00 0.00 C ATOM 2186 O SER A 135 -5.602 9.710 -11.785 1.00 0.00 O ATOM 2187 CB SER A 135 -4.507 12.449 -10.834 1.00 0.00 C ATOM 2188 OG SER A 135 -3.892 13.627 -11.325 1.00 0.00 O ATOM 0 H SER A 135 -6.936 13.312 -10.394 1.00 0.00 H new ATOM 0 HA SER A 135 -5.525 12.147 -12.707 1.00 0.00 H new ATOM 0 HB2 SER A 135 -4.775 12.585 -9.786 1.00 0.00 H new ATOM 0 HB3 SER A 135 -3.800 11.621 -10.877 1.00 0.00 H new ATOM 0 HG SER A 135 -3.097 13.828 -10.789 1.00 0.00 H new ATOM 2194 N GLY A 136 -7.254 10.556 -10.516 1.00 0.00 N ATOM 2195 CA GLY A 136 -7.753 9.244 -10.143 1.00 0.00 C ATOM 2196 C GLY A 136 -6.901 8.582 -9.073 1.00 0.00 C ATOM 2197 O GLY A 136 -7.119 7.420 -8.728 1.00 0.00 O ATOM 0 H GLY A 136 -7.769 11.340 -10.116 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -8.777 9.337 -9.782 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -7.783 8.605 -11.026 1.00 0.00 H new ATOM 2201 N THR A 137 -5.925 9.322 -8.552 1.00 0.00 N ATOM 2202 CA THR A 137 -5.033 8.801 -7.521 1.00 0.00 C ATOM 2203 C THR A 137 -5.738 8.718 -6.171 1.00 0.00 C ATOM 2204 O THR A 137 -6.354 9.683 -5.719 1.00 0.00 O ATOM 2205 CB THR A 137 -3.790 9.684 -7.405 1.00 0.00 C ATOM 2206 OG1 THR A 137 -3.140 9.803 -8.657 1.00 0.00 O ATOM 2207 CG2 THR A 137 -2.776 9.160 -6.410 1.00 0.00 C ATOM 0 H THR A 137 -5.732 10.285 -8.828 1.00 0.00 H new ATOM 0 HA THR A 137 -4.735 7.794 -7.812 1.00 0.00 H new ATOM 0 HB THR A 137 -4.154 10.650 -7.056 1.00 0.00 H new ATOM 0 HG1 THR A 137 -2.349 10.373 -8.562 1.00 0.00 H new ATOM 0 HG21 THR A 137 -1.919 9.832 -6.376 1.00 0.00 H new ATOM 0 HG22 THR A 137 -3.232 9.103 -5.422 1.00 0.00 H new ATOM 0 HG23 THR A 137 -2.446 8.167 -6.715 1.00 0.00 H new ATOM 2215 N TYR A 138 -5.638 7.558 -5.532 1.00 0.00 N ATOM 2216 CA TYR A 138 -6.258 7.343 -4.228 1.00 0.00 C ATOM 2217 C TYR A 138 -5.199 6.993 -3.186 1.00 0.00 C ATOM 2218 O TYR A 138 -4.437 6.040 -3.357 1.00 0.00 O ATOM 2219 CB TYR A 138 -7.310 6.228 -4.325 1.00 0.00 C ATOM 2220 CG TYR A 138 -7.922 5.811 -2.999 1.00 0.00 C ATOM 2221 CD1 TYR A 138 -8.015 6.699 -1.931 1.00 0.00 C ATOM 2222 CD2 TYR A 138 -8.409 4.521 -2.822 1.00 0.00 C ATOM 2223 CE1 TYR A 138 -8.573 6.311 -0.727 1.00 0.00 C ATOM 2224 CE2 TYR A 138 -8.969 4.128 -1.621 1.00 0.00 C ATOM 2225 CZ TYR A 138 -9.049 5.026 -0.578 1.00 0.00 C ATOM 2226 OH TYR A 138 -9.605 4.637 0.619 1.00 0.00 O ATOM 0 H TYR A 138 -5.133 6.750 -5.896 1.00 0.00 H new ATOM 0 HA TYR A 138 -6.752 8.263 -3.916 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -8.108 6.558 -4.989 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -6.851 5.354 -4.788 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -7.645 7.707 -2.045 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -8.349 3.814 -3.636 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -8.636 7.011 0.093 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -9.342 3.122 -1.500 1.00 0.00 H new ATOM 0 HH TYR A 138 -8.917 4.221 1.180 1.00 0.00 H new ATOM 2236 N VAL A 139 -5.150 7.773 -2.110 1.00 0.00 N ATOM 2237 CA VAL A 139 -4.178 7.545 -1.047 1.00 0.00 C ATOM 2238 C VAL A 139 -4.865 7.273 0.290 1.00 0.00 C ATOM 2239 O VAL A 139 -5.653 8.085 0.774 1.00 0.00 O ATOM 2240 CB VAL A 139 -3.218 8.746 -0.900 1.00 0.00 C ATOM 2241 CG1 VAL A 139 -3.978 10.006 -0.514 1.00 0.00 C ATOM 2242 CG2 VAL A 139 -2.123 8.443 0.115 1.00 0.00 C ATOM 0 H VAL A 139 -5.771 8.567 -1.952 1.00 0.00 H new ATOM 0 HA VAL A 139 -3.601 6.664 -1.329 1.00 0.00 H new ATOM 0 HB VAL A 139 -2.746 8.920 -1.867 1.00 0.00 H new ATOM 0 HG11 VAL A 139 -3.279 10.837 -0.417 1.00 0.00 H new ATOM 0 HG12 VAL A 139 -4.713 10.238 -1.285 1.00 0.00 H new ATOM 0 HG13 VAL A 139 -4.487 9.847 0.437 1.00 0.00 H new ATOM 0 HG21 VAL A 139 -1.459 9.303 0.202 1.00 0.00 H new ATOM 0 HG22 VAL A 139 -2.574 8.233 1.085 1.00 0.00 H new ATOM 0 HG23 VAL A 139 -1.551 7.575 -0.214 1.00 0.00 H new ATOM 2252 N PHE A 140 -4.553 6.125 0.880 1.00 0.00 N ATOM 2253 CA PHE A 140 -5.125 5.734 2.163 1.00 0.00 C ATOM 2254 C PHE A 140 -4.135 4.878 2.950 1.00 0.00 C ATOM 2255 O PHE A 140 -3.201 4.317 2.378 1.00 0.00 O ATOM 2256 CB PHE A 140 -6.439 4.980 1.955 1.00 0.00 C ATOM 2257 CG PHE A 140 -6.302 3.741 1.117 1.00 0.00 C ATOM 2258 CD1 PHE A 140 -6.318 3.825 -0.266 1.00 0.00 C ATOM 2259 CD2 PHE A 140 -6.174 2.495 1.709 1.00 0.00 C ATOM 2260 CE1 PHE A 140 -6.207 2.689 -1.043 1.00 0.00 C ATOM 2261 CE2 PHE A 140 -6.060 1.355 0.935 1.00 0.00 C ATOM 2262 CZ PHE A 140 -6.079 1.453 -0.443 1.00 0.00 C ATOM 0 H PHE A 140 -3.903 5.445 0.487 1.00 0.00 H new ATOM 0 HA PHE A 140 -5.333 6.636 2.738 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -6.847 4.706 2.928 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -7.160 5.648 1.483 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -6.418 4.790 -0.741 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -6.163 2.413 2.786 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -6.220 2.768 -2.120 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -5.956 0.389 1.407 1.00 0.00 H new ATOM 0 HZ PHE A 140 -5.994 0.564 -1.050 1.00 0.00 H new ATOM 2272 N ILE A 141 -4.330 4.791 4.263 1.00 0.00 N ATOM 2273 CA ILE A 141 -3.432 4.012 5.109 1.00 0.00 C ATOM 2274 C ILE A 141 -4.154 2.854 5.792 1.00 0.00 C ATOM 2275 O ILE A 141 -5.100 3.054 6.553 1.00 0.00 O ATOM 2276 CB ILE A 141 -2.777 4.901 6.185 1.00 0.00 C ATOM 2277 CG1 ILE A 141 -3.844 5.534 7.081 1.00 0.00 C ATOM 2278 CG2 ILE A 141 -1.923 5.975 5.532 1.00 0.00 C ATOM 2279 CD1 ILE A 141 -3.278 6.226 8.302 1.00 0.00 C ATOM 0 H ILE A 141 -5.095 5.246 4.761 1.00 0.00 H new ATOM 0 HA ILE A 141 -2.663 3.604 4.453 1.00 0.00 H new ATOM 0 HB ILE A 141 -2.135 4.277 6.807 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -4.415 6.256 6.497 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -4.542 4.761 7.403 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -1.466 6.596 6.303 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -1.142 5.505 4.934 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -2.547 6.596 4.889 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -4.092 6.651 8.890 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -2.731 5.504 8.908 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -2.603 7.022 7.989 1.00 0.00 H new ATOM 2291 N VAL A 142 -3.683 1.639 5.519 1.00 0.00 N ATOM 2292 CA VAL A 142 -4.263 0.436 6.108 1.00 0.00 C ATOM 2293 C VAL A 142 -3.716 0.198 7.515 1.00 0.00 C ATOM 2294 O VAL A 142 -2.997 -0.772 7.757 1.00 0.00 O ATOM 2295 CB VAL A 142 -3.988 -0.803 5.232 1.00 0.00 C ATOM 2296 CG1 VAL A 142 -4.752 -2.009 5.757 1.00 0.00 C ATOM 2297 CG2 VAL A 142 -4.354 -0.523 3.781 1.00 0.00 C ATOM 0 H VAL A 142 -2.899 1.462 4.891 1.00 0.00 H new ATOM 0 HA VAL A 142 -5.340 0.592 6.167 1.00 0.00 H new ATOM 0 HB VAL A 142 -2.922 -1.028 5.278 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.545 -2.873 5.126 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -4.438 -2.222 6.779 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.821 -1.797 5.743 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.153 -1.408 3.178 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -5.412 -0.271 3.715 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -3.759 0.311 3.410 1.00 0.00 H new ATOM 2307 N ASN A 143 -4.050 1.088 8.444 1.00 0.00 N ATOM 2308 CA ASN A 143 -3.571 0.960 9.817 1.00 0.00 C ATOM 2309 C ASN A 143 -4.386 -0.074 10.587 1.00 0.00 C ATOM 2310 O ASN A 143 -5.520 0.184 10.989 1.00 0.00 O ATOM 2311 CB ASN A 143 -3.642 2.313 10.528 1.00 0.00 C ATOM 2312 CG ASN A 143 -2.493 3.225 10.151 1.00 0.00 C ATOM 2313 OD1 ASN A 143 -2.421 3.718 9.027 1.00 0.00 O ATOM 2314 ND2 ASN A 143 -1.588 3.458 11.093 1.00 0.00 N ATOM 0 H ASN A 143 -4.645 1.899 8.274 1.00 0.00 H new ATOM 0 HA ASN A 143 -2.534 0.625 9.784 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -4.585 2.801 10.282 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -3.637 2.154 11.606 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -0.794 4.067 10.897 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -1.687 3.028 12.013 1.00 0.00 H new ATOM 2321 N HIS A 144 -3.789 -1.244 10.795 1.00 0.00 N ATOM 2322 CA HIS A 144 -4.446 -2.324 11.524 1.00 0.00 C ATOM 2323 C HIS A 144 -4.777 -1.896 12.952 1.00 0.00 C ATOM 2324 O HIS A 144 -5.841 -2.220 13.479 1.00 0.00 O ATOM 2325 CB HIS A 144 -3.552 -3.568 11.540 1.00 0.00 C ATOM 2326 CG HIS A 144 -4.149 -4.732 12.271 1.00 0.00 C ATOM 2327 ND1 HIS A 144 -5.232 -5.445 11.797 1.00 0.00 N ATOM 2328 CD2 HIS A 144 -3.807 -5.312 13.447 1.00 0.00 C ATOM 2329 CE1 HIS A 144 -5.530 -6.410 12.650 1.00 0.00 C ATOM 2330 NE2 HIS A 144 -4.680 -6.350 13.658 1.00 0.00 N ATOM 0 H HIS A 144 -2.849 -1.469 10.468 1.00 0.00 H new ATOM 0 HA HIS A 144 -5.380 -2.562 11.014 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -3.341 -3.865 10.513 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -2.598 -3.312 12.000 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -2.998 -5.013 14.097 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -6.332 -7.125 12.541 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -4.673 -6.975 14.464 1.00 0.00 H new