USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 796 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 40 GLN : amide:sc= 0.647 K(o=1.3,f=0.41) USER MOD Set 1.2: A 50 GLN : amide:sc= 0.662 K(o=1.3,f=-0.68) USER MOD Set 2.1: A 8 SER OG : rot -88:sc= 1.09 USER MOD Set 2.2: A 10 HIS : no HE2:sc= 0.824 K(o=1.9,f=-0.68) USER MOD Single : A 3 HIS : no HE2:sc= 0.649 K(o=0.65,f=-2.9!) USER MOD Single : A 4 ASN : amide:sc= -0.303 X(o=-0.3,f=-0.35) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0.638 K(o=0.64,f=-0.9) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= -0.0655 X(o=-0.065,f=-0.065) USER MOD Single : A 39 HIS : no HE2:sc= 0.462 K(o=0.46,f=-2.2!) USER MOD Single : A 45 CYS SG : rot 180:sc= -0.0198 USER MOD Single : A 48 SER OG : rot -108:sc= 0.594 USER MOD Single : A 54 SER OG : rot 180:sc= 0.333 USER MOD Single : A 55 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.13) USER MOD Single : A 57 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ -168:sc= 1.2 (180deg=1.18) USER MOD Single : A 91 LYS NZ :NH3+ -169:sc= 1.27 (180deg=1.13) USER MOD Single : A 95 TYR OH : rot -130:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 172:sc= 0.00323 (180deg=-0.108) USER MOD Single : A 98 GLN : amide:sc= -0.0631 K(o=-0.063,f=-0.77) USER MOD Single : A 99 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.00105 USER MOD Single : A 102 MET CE :methyl 180:sc= -0.582 (180deg=-0.582) USER MOD Single : A 117 CYS SG : rot -160:sc= -0.562 USER MOD Single : A 119 ASN : amide:sc= -0.151 X(o=-0.15,f=-0.38) USER MOD Single : A 121 THR OG1 : rot -7:sc= 0.559 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0.687 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 THR OG1 : rot 1:sc= 0.814 USER MOD ----------------------------------------------------------------- ATOM 34 N HIS A 3 70.043 90.398 19.659 1.00 35.35 N ATOM 35 CA HIS A 3 69.583 89.386 20.599 1.00 73.31 C ATOM 36 C HIS A 3 69.573 88.026 19.901 1.00 33.11 C ATOM 37 O HIS A 3 70.239 87.098 20.354 1.00 42.21 O ATOM 38 CB HIS A 3 68.198 89.768 21.142 1.00 15.51 C ATOM 39 CG HIS A 3 67.722 88.873 22.258 1.00 5.35 C ATOM 40 ND1 HIS A 3 67.317 87.563 22.050 1.00 72.42 N ATOM 41 CD2 HIS A 3 67.581 89.083 23.610 1.00 61.41 C ATOM 42 CE1 HIS A 3 66.962 87.059 23.244 1.00 71.44 C ATOM 43 NE2 HIS A 3 67.099 87.938 24.238 1.00 2.23 N ATOM 0 HA HIS A 3 70.258 89.324 21.452 1.00 73.31 H new ATOM 0 HB2 HIS A 3 68.228 90.797 21.500 1.00 15.51 H new ATOM 0 HB3 HIS A 3 67.475 89.735 20.327 1.00 15.51 H new ATOM 0 HD1 HIS A 3 67.293 87.073 21.156 1.00 72.42 H new ATOM 0 HD2 HIS A 3 67.812 90.009 24.115 1.00 61.41 H new ATOM 0 HE1 HIS A 3 66.604 86.050 23.384 1.00 71.44 H new ATOM 51 N ASN A 4 68.811 87.926 18.802 1.00 3.10 N ATOM 52 CA ASN A 4 68.628 86.733 17.979 1.00 55.02 C ATOM 53 C ASN A 4 67.815 85.655 18.706 1.00 50.52 C ATOM 54 O ASN A 4 67.717 85.651 19.932 1.00 12.21 O ATOM 55 CB ASN A 4 69.973 86.201 17.455 1.00 30.24 C ATOM 56 CG ASN A 4 69.783 85.172 16.341 1.00 3.10 C ATOM 57 OD1 ASN A 4 69.937 83.974 16.565 1.00 55.43 O ATOM 58 ND2 ASN A 4 69.430 85.634 15.140 1.00 53.14 N ATOM 0 H ASN A 4 68.279 88.721 18.449 1.00 3.10 H new ATOM 0 HA ASN A 4 68.041 87.023 17.108 1.00 55.02 H new ATOM 0 HB2 ASN A 4 70.572 87.032 17.083 1.00 30.24 H new ATOM 0 HB3 ASN A 4 70.529 85.749 18.276 1.00 30.24 H new ATOM 0 HD21 ASN A 4 69.278 84.985 14.368 1.00 53.14 H new ATOM 0 HD22 ASN A 4 69.312 86.637 14.994 1.00 53.14 H new ATOM 65 N SER A 5 67.207 84.748 17.935 1.00 74.23 N ATOM 66 CA SER A 5 66.381 83.666 18.447 1.00 33.25 C ATOM 67 C SER A 5 66.543 82.459 17.525 1.00 52.13 C ATOM 68 O SER A 5 65.818 82.326 16.541 1.00 72.53 O ATOM 69 CB SER A 5 64.920 84.126 18.531 1.00 3.14 C ATOM 70 OG SER A 5 64.792 85.225 19.407 1.00 14.23 O ATOM 0 H SER A 5 67.281 84.751 16.918 1.00 74.23 H new ATOM 0 HA SER A 5 66.692 83.383 19.453 1.00 33.25 H new ATOM 0 HB2 SER A 5 64.563 84.402 17.539 1.00 3.14 H new ATOM 0 HB3 SER A 5 64.294 83.304 18.878 1.00 3.14 H new ATOM 0 HG SER A 5 63.854 85.505 19.446 1.00 14.23 H new ATOM 76 N ILE A 6 67.505 81.585 17.847 1.00 14.45 N ATOM 77 CA ILE A 6 67.776 80.369 17.091 1.00 5.23 C ATOM 78 C ILE A 6 66.593 79.409 17.260 1.00 51.51 C ATOM 79 O ILE A 6 66.065 79.271 18.362 1.00 15.15 O ATOM 80 CB ILE A 6 69.102 79.734 17.562 1.00 4.01 C ATOM 81 CG1 ILE A 6 70.262 80.735 17.393 1.00 31.02 C ATOM 82 CG2 ILE A 6 69.388 78.442 16.779 1.00 53.12 C ATOM 83 CD1 ILE A 6 71.619 80.182 17.836 1.00 21.23 C ATOM 0 H ILE A 6 68.121 81.710 18.650 1.00 14.45 H new ATOM 0 HA ILE A 6 67.888 80.599 16.032 1.00 5.23 H new ATOM 0 HB ILE A 6 69.011 79.482 18.619 1.00 4.01 H new ATOM 0 HG12 ILE A 6 70.325 81.032 16.346 1.00 31.02 H new ATOM 0 HG13 ILE A 6 70.041 81.635 17.967 1.00 31.02 H new ATOM 0 HG21 ILE A 6 70.326 78.008 17.124 1.00 53.12 H new ATOM 0 HG22 ILE A 6 68.578 77.731 16.942 1.00 53.12 H new ATOM 0 HG23 ILE A 6 69.463 78.670 15.716 1.00 53.12 H new ATOM 0 HD11 ILE A 6 72.387 80.941 17.688 1.00 21.23 H new ATOM 0 HD12 ILE A 6 71.575 79.911 18.891 1.00 21.23 H new ATOM 0 HD13 ILE A 6 71.863 79.299 17.245 1.00 21.23 H new ATOM 95 N ARG A 7 66.180 78.756 16.166 1.00 74.31 N ATOM 96 CA ARG A 7 65.128 77.746 16.159 1.00 30.34 C ATOM 97 C ARG A 7 65.571 76.568 15.291 1.00 64.32 C ATOM 98 O ARG A 7 66.393 76.734 14.390 1.00 75.43 O ATOM 99 CB ARG A 7 63.810 78.343 15.642 1.00 60.22 C ATOM 100 CG ARG A 7 63.337 79.512 16.515 1.00 24.11 C ATOM 101 CD ARG A 7 61.979 80.043 16.046 1.00 43.42 C ATOM 102 NE ARG A 7 61.572 81.225 16.820 1.00 51.22 N ATOM 103 CZ ARG A 7 62.033 82.475 16.636 1.00 72.44 C ATOM 104 NH1 ARG A 7 62.937 82.742 15.683 1.00 32.24 N ATOM 105 NH2 ARG A 7 61.583 83.466 17.417 1.00 22.23 N ATOM 0 H ARG A 7 66.581 78.923 15.243 1.00 74.31 H new ATOM 0 HA ARG A 7 64.955 77.395 17.176 1.00 30.34 H new ATOM 0 HB2 ARG A 7 63.943 78.686 14.616 1.00 60.22 H new ATOM 0 HB3 ARG A 7 63.043 77.569 15.623 1.00 60.22 H new ATOM 0 HG2 ARG A 7 63.264 79.187 17.553 1.00 24.11 H new ATOM 0 HG3 ARG A 7 64.074 80.314 16.483 1.00 24.11 H new ATOM 0 HD2 ARG A 7 62.032 80.299 14.988 1.00 43.42 H new ATOM 0 HD3 ARG A 7 61.226 79.262 16.148 1.00 43.42 H new ATOM 0 HE ARG A 7 60.882 81.085 17.558 1.00 51.22 H new ATOM 0 HH11 ARG A 7 63.285 81.992 15.085 1.00 32.24 H new ATOM 0 HH12 ARG A 7 63.277 83.695 15.555 1.00 32.24 H new ATOM 0 HH21 ARG A 7 60.896 83.270 18.145 1.00 22.23 H new ATOM 0 HH22 ARG A 7 61.928 84.417 17.284 1.00 22.23 H new ATOM 119 N SER A 8 65.032 75.376 15.575 1.00 12.50 N ATOM 120 CA SER A 8 65.359 74.144 14.874 1.00 51.03 C ATOM 121 C SER A 8 64.188 73.175 15.035 1.00 55.32 C ATOM 122 O SER A 8 64.133 72.418 16.001 1.00 13.14 O ATOM 123 CB SER A 8 66.676 73.573 15.417 1.00 3.03 C ATOM 124 OG SER A 8 67.013 72.373 14.754 1.00 14.20 O ATOM 0 H SER A 8 64.343 75.246 16.315 1.00 12.50 H new ATOM 0 HA SER A 8 65.509 74.324 13.810 1.00 51.03 H new ATOM 0 HB2 SER A 8 67.475 74.303 15.287 1.00 3.03 H new ATOM 0 HB3 SER A 8 66.584 73.389 16.487 1.00 3.03 H new ATOM 0 HG SER A 8 66.594 71.616 15.214 1.00 14.20 H new ATOM 130 N GLY A 9 63.237 73.224 14.094 1.00 63.22 N ATOM 131 CA GLY A 9 62.051 72.383 14.108 1.00 22.14 C ATOM 132 C GLY A 9 62.396 70.937 13.751 1.00 42.11 C ATOM 133 O GLY A 9 63.275 70.695 12.925 1.00 40.52 O ATOM 0 H GLY A 9 63.277 73.858 13.296 1.00 63.22 H new ATOM 0 HA2 GLY A 9 61.589 72.417 15.095 1.00 22.14 H new ATOM 0 HA3 GLY A 9 61.318 72.771 13.400 1.00 22.14 H new ATOM 137 N HIS A 10 61.693 69.984 14.375 1.00 33.43 N ATOM 138 CA HIS A 10 61.848 68.554 14.138 1.00 0.40 C ATOM 139 C HIS A 10 60.479 67.879 14.183 1.00 20.20 C ATOM 140 O HIS A 10 59.527 68.427 14.740 1.00 14.52 O ATOM 141 CB HIS A 10 62.786 67.945 15.190 1.00 53.31 C ATOM 142 CG HIS A 10 64.151 68.582 15.216 1.00 41.32 C ATOM 143 ND1 HIS A 10 65.041 68.477 14.158 1.00 15.14 N ATOM 144 CD2 HIS A 10 64.781 69.375 16.144 1.00 1.22 C ATOM 145 CE1 HIS A 10 66.133 69.189 14.485 1.00 72.45 C ATOM 146 NE2 HIS A 10 66.036 69.765 15.685 1.00 35.50 N ATOM 0 H HIS A 10 60.984 70.198 15.076 1.00 33.43 H new ATOM 0 HA HIS A 10 62.288 68.394 13.154 1.00 0.40 H new ATOM 0 HB2 HIS A 10 62.328 68.044 16.174 1.00 53.31 H new ATOM 0 HB3 HIS A 10 62.895 66.878 14.995 1.00 53.31 H new ATOM 0 HD1 HIS A 10 64.894 67.957 13.293 1.00 15.14 H new ATOM 0 HD2 HIS A 10 64.361 69.657 17.098 1.00 1.22 H new ATOM 0 HE1 HIS A 10 66.997 69.285 13.845 1.00 72.45 H new ATOM 154 N GLY A 11 60.385 66.682 13.595 1.00 11.24 N ATOM 155 CA GLY A 11 59.166 65.895 13.571 1.00 44.02 C ATOM 156 C GLY A 11 59.368 64.629 12.741 1.00 4.14 C ATOM 157 O GLY A 11 60.492 64.298 12.365 1.00 34.34 O ATOM 0 H GLY A 11 61.168 66.234 13.119 1.00 11.24 H new ATOM 0 HA2 GLY A 11 58.877 65.629 14.588 1.00 44.02 H new ATOM 0 HA3 GLY A 11 58.352 66.486 13.152 1.00 44.02 H new ATOM 161 N GLY A 12 58.266 63.934 12.448 1.00 50.15 N ATOM 162 CA GLY A 12 58.253 62.740 11.621 1.00 43.13 C ATOM 163 C GLY A 12 56.823 62.440 11.176 1.00 65.45 C ATOM 164 O GLY A 12 55.875 63.016 11.710 1.00 60.13 O ATOM 0 H GLY A 12 57.342 64.197 12.790 1.00 50.15 H new ATOM 0 HA2 GLY A 12 58.893 62.882 10.750 1.00 43.13 H new ATOM 0 HA3 GLY A 12 58.656 61.895 12.179 1.00 43.13 H new ATOM 168 N LEU A 13 56.680 61.551 10.188 1.00 13.32 N ATOM 169 CA LEU A 13 55.400 61.179 9.599 1.00 4.34 C ATOM 170 C LEU A 13 55.021 59.766 10.042 1.00 13.30 C ATOM 171 O LEU A 13 55.893 58.928 10.270 1.00 30.14 O ATOM 172 CB LEU A 13 55.487 61.257 8.068 1.00 35.22 C ATOM 173 CG LEU A 13 55.905 62.639 7.534 1.00 73.32 C ATOM 174 CD1 LEU A 13 56.034 62.569 6.009 1.00 61.33 C ATOM 175 CD2 LEU A 13 54.894 63.734 7.900 1.00 73.21 C ATOM 0 H LEU A 13 57.471 61.062 9.770 1.00 13.32 H new ATOM 0 HA LEU A 13 54.630 61.872 9.939 1.00 4.34 H new ATOM 0 HB2 LEU A 13 56.201 60.512 7.717 1.00 35.22 H new ATOM 0 HB3 LEU A 13 54.517 60.994 7.645 1.00 35.22 H new ATOM 0 HG LEU A 13 56.858 62.898 7.996 1.00 73.32 H new ATOM 0 HD11 LEU A 13 56.330 63.545 5.624 1.00 61.33 H new ATOM 0 HD12 LEU A 13 56.788 61.829 5.741 1.00 61.33 H new ATOM 0 HD13 LEU A 13 55.076 62.283 5.576 1.00 61.33 H new ATOM 0 HD21 LEU A 13 55.233 64.690 7.501 1.00 73.21 H new ATOM 0 HD22 LEU A 13 53.921 63.488 7.475 1.00 73.21 H new ATOM 0 HD23 LEU A 13 54.809 63.803 8.984 1.00 73.21 H new ATOM 187 N ASN A 14 53.714 59.505 10.158 1.00 64.52 N ATOM 188 CA ASN A 14 53.196 58.192 10.510 1.00 2.13 C ATOM 189 C ASN A 14 53.379 57.228 9.337 1.00 72.33 C ATOM 190 O ASN A 14 53.087 57.582 8.196 1.00 40.33 O ATOM 191 CB ASN A 14 51.716 58.297 10.894 1.00 63.14 C ATOM 192 CG ASN A 14 51.112 56.915 11.144 1.00 72.41 C ATOM 193 OD1 ASN A 14 50.340 56.418 10.329 1.00 74.11 O ATOM 194 ND2 ASN A 14 51.480 56.284 12.260 1.00 14.45 N ATOM 0 H ASN A 14 52.989 60.206 10.008 1.00 64.52 H new ATOM 0 HA ASN A 14 53.749 57.807 11.367 1.00 2.13 H new ATOM 0 HB2 ASN A 14 51.612 58.910 11.789 1.00 63.14 H new ATOM 0 HB3 ASN A 14 51.166 58.799 10.098 1.00 63.14 H new ATOM 0 HD21 ASN A 14 51.117 55.352 12.462 1.00 14.45 H new ATOM 0 HD22 ASN A 14 52.124 56.733 12.911 1.00 14.45 H new ATOM 201 N GLN A 15 53.845 56.010 9.636 1.00 33.53 N ATOM 202 CA GLN A 15 54.027 54.943 8.662 1.00 65.05 C ATOM 203 C GLN A 15 52.818 54.005 8.695 1.00 0.21 C ATOM 204 O GLN A 15 52.178 53.788 7.667 1.00 14.30 O ATOM 205 CB GLN A 15 55.334 54.194 8.943 1.00 25.40 C ATOM 206 CG GLN A 15 56.552 55.124 8.849 1.00 21.12 C ATOM 207 CD GLN A 15 57.857 54.340 8.966 1.00 1.21 C ATOM 208 OE1 GLN A 15 58.611 54.236 8.003 1.00 43.33 O ATOM 209 NE2 GLN A 15 58.128 53.783 10.149 1.00 62.32 N ATOM 0 H GLN A 15 54.110 55.739 10.583 1.00 33.53 H new ATOM 0 HA GLN A 15 54.098 55.366 7.660 1.00 65.05 H new ATOM 0 HB2 GLN A 15 55.292 53.749 9.937 1.00 25.40 H new ATOM 0 HB3 GLN A 15 55.445 53.376 8.231 1.00 25.40 H new ATOM 0 HG2 GLN A 15 56.531 55.660 7.900 1.00 21.12 H new ATOM 0 HG3 GLN A 15 56.503 55.873 9.639 1.00 21.12 H new ATOM 0 HE21 GLN A 15 57.476 53.892 10.926 1.00 62.32 H new ATOM 0 HE22 GLN A 15 58.987 53.248 10.276 1.00 62.32 H new ATOM 218 N LEU A 16 52.515 53.454 9.878 1.00 1.30 N ATOM 219 CA LEU A 16 51.407 52.541 10.117 1.00 24.12 C ATOM 220 C LEU A 16 50.418 53.216 11.065 1.00 5.33 C ATOM 221 O LEU A 16 50.738 53.442 12.231 1.00 64.55 O ATOM 222 CB LEU A 16 51.927 51.228 10.721 1.00 3.10 C ATOM 223 CG LEU A 16 52.925 50.477 9.821 1.00 52.21 C ATOM 224 CD1 LEU A 16 53.429 49.232 10.560 1.00 51.21 C ATOM 225 CD2 LEU A 16 52.303 50.056 8.485 1.00 50.14 C ATOM 0 H LEU A 16 53.059 53.643 10.720 1.00 1.30 H new ATOM 0 HA LEU A 16 50.907 52.304 9.178 1.00 24.12 H new ATOM 0 HB2 LEU A 16 52.406 51.444 11.676 1.00 3.10 H new ATOM 0 HB3 LEU A 16 51.079 50.575 10.930 1.00 3.10 H new ATOM 0 HG LEU A 16 53.748 51.157 9.600 1.00 52.21 H new ATOM 0 HD11 LEU A 16 54.136 48.695 9.928 1.00 51.21 H new ATOM 0 HD12 LEU A 16 53.923 49.532 11.484 1.00 51.21 H new ATOM 0 HD13 LEU A 16 52.586 48.582 10.794 1.00 51.21 H new ATOM 0 HD21 LEU A 16 53.047 49.530 7.887 1.00 50.14 H new ATOM 0 HD22 LEU A 16 51.455 49.397 8.670 1.00 50.14 H new ATOM 0 HD23 LEU A 16 51.964 50.941 7.947 1.00 50.14 H new ATOM 375 N PRO A 27 32.732 41.167 4.327 1.00 44.40 N ATOM 376 CA PRO A 27 32.080 39.923 3.950 1.00 14.45 C ATOM 377 C PRO A 27 32.932 38.749 4.460 1.00 62.11 C ATOM 378 O PRO A 27 33.906 38.960 5.184 1.00 45.21 O ATOM 379 CB PRO A 27 32.013 39.980 2.421 1.00 24.20 C ATOM 380 CG PRO A 27 33.321 40.682 2.062 1.00 32.21 C ATOM 381 CD PRO A 27 33.524 41.669 3.215 1.00 32.12 C ATOM 0 HA PRO A 27 31.084 39.789 4.373 1.00 14.45 H new ATOM 0 HB2 PRO A 27 31.951 38.985 1.980 1.00 24.20 H new ATOM 0 HB3 PRO A 27 31.144 40.538 2.073 1.00 24.20 H new ATOM 0 HG2 PRO A 27 34.148 39.976 1.987 1.00 32.21 H new ATOM 0 HG3 PRO A 27 33.252 41.194 1.102 1.00 32.21 H new ATOM 0 HD2 PRO A 27 34.577 41.737 3.487 1.00 32.12 H new ATOM 0 HD3 PRO A 27 33.203 42.671 2.930 1.00 32.12 H new ATOM 389 N GLU A 28 32.588 37.514 4.070 1.00 45.33 N ATOM 390 CA GLU A 28 33.204 36.293 4.591 1.00 74.11 C ATOM 391 C GLU A 28 34.718 36.186 4.330 1.00 23.45 C ATOM 392 O GLU A 28 35.366 35.303 4.884 1.00 24.35 O ATOM 393 CB GLU A 28 32.431 35.069 4.072 1.00 3.31 C ATOM 394 CG GLU A 28 32.787 33.776 4.826 1.00 42.13 C ATOM 395 CD GLU A 28 31.790 32.651 4.568 1.00 1.32 C ATOM 396 OE1 GLU A 28 31.524 32.386 3.376 1.00 73.54 O ATOM 397 OE2 GLU A 28 31.305 32.075 5.568 1.00 73.13 O ATOM 0 H GLU A 28 31.864 37.336 3.374 1.00 45.33 H new ATOM 0 HA GLU A 28 33.129 36.332 5.678 1.00 74.11 H new ATOM 0 HB2 GLU A 28 31.361 35.255 4.164 1.00 3.31 H new ATOM 0 HB3 GLU A 28 32.641 34.935 3.011 1.00 3.31 H new ATOM 0 HG2 GLU A 28 33.783 33.449 4.528 1.00 42.13 H new ATOM 0 HG3 GLU A 28 32.826 33.983 5.895 1.00 42.13 H new ATOM 404 N VAL A 29 35.321 37.095 3.552 1.00 75.13 N ATOM 405 CA VAL A 29 36.775 37.201 3.474 1.00 5.11 C ATOM 406 C VAL A 29 37.387 37.374 4.871 1.00 22.45 C ATOM 407 O VAL A 29 38.446 36.815 5.154 1.00 53.32 O ATOM 408 CB VAL A 29 37.178 38.332 2.508 1.00 23.24 C ATOM 409 CG1 VAL A 29 36.953 39.732 3.093 1.00 52.35 C ATOM 410 CG2 VAL A 29 38.647 38.187 2.095 1.00 71.42 C ATOM 0 H VAL A 29 34.820 37.766 2.969 1.00 75.13 H new ATOM 0 HA VAL A 29 37.178 36.272 3.070 1.00 5.11 H new ATOM 0 HB VAL A 29 36.530 38.233 1.637 1.00 23.24 H new ATOM 0 HG11 VAL A 29 37.256 40.484 2.364 1.00 52.35 H new ATOM 0 HG12 VAL A 29 35.897 39.862 3.330 1.00 52.35 H new ATOM 0 HG13 VAL A 29 37.546 39.847 4.001 1.00 52.35 H new ATOM 0 HG21 VAL A 29 38.915 38.994 1.413 1.00 71.42 H new ATOM 0 HG22 VAL A 29 39.280 38.236 2.981 1.00 71.42 H new ATOM 0 HG23 VAL A 29 38.792 37.228 1.597 1.00 71.42 H new ATOM 420 N VAL A 30 36.704 38.113 5.757 1.00 71.13 N ATOM 421 CA VAL A 30 37.150 38.327 7.126 1.00 72.24 C ATOM 422 C VAL A 30 37.214 37.007 7.901 1.00 3.42 C ATOM 423 O VAL A 30 38.121 36.836 8.707 1.00 10.42 O ATOM 424 CB VAL A 30 36.278 39.388 7.820 1.00 12.53 C ATOM 425 CG1 VAL A 30 34.961 38.802 8.340 1.00 62.45 C ATOM 426 CG2 VAL A 30 37.033 40.042 8.984 1.00 73.24 C ATOM 0 H VAL A 30 35.824 38.578 5.535 1.00 71.13 H new ATOM 0 HA VAL A 30 38.167 38.718 7.106 1.00 72.24 H new ATOM 0 HB VAL A 30 36.046 40.140 7.066 1.00 12.53 H new ATOM 0 HG11 VAL A 30 34.379 39.587 8.822 1.00 62.45 H new ATOM 0 HG12 VAL A 30 34.393 38.388 7.507 1.00 62.45 H new ATOM 0 HG13 VAL A 30 35.174 38.013 9.062 1.00 62.45 H new ATOM 0 HG21 VAL A 30 36.395 40.788 9.458 1.00 73.24 H new ATOM 0 HG22 VAL A 30 37.305 39.280 9.715 1.00 73.24 H new ATOM 0 HG23 VAL A 30 37.936 40.523 8.608 1.00 73.24 H new ATOM 436 N ARG A 31 36.286 36.069 7.647 1.00 45.44 N ATOM 437 CA ARG A 31 36.292 34.744 8.263 1.00 31.53 C ATOM 438 C ARG A 31 37.644 34.071 8.027 1.00 55.54 C ATOM 439 O ARG A 31 38.258 33.564 8.962 1.00 35.23 O ATOM 440 CB ARG A 31 35.147 33.894 7.700 1.00 25.34 C ATOM 441 CG ARG A 31 35.023 32.531 8.388 1.00 55.35 C ATOM 442 CD ARG A 31 33.855 31.757 7.771 1.00 42.55 C ATOM 443 NE ARG A 31 33.762 30.400 8.320 1.00 3.23 N ATOM 444 CZ ARG A 31 32.916 29.454 7.881 1.00 21.15 C ATOM 445 NH1 ARG A 31 32.015 29.720 6.925 1.00 33.20 N ATOM 446 NH2 ARG A 31 32.981 28.224 8.408 1.00 45.22 N ATOM 0 H ARG A 31 35.508 36.216 7.004 1.00 45.44 H new ATOM 0 HA ARG A 31 36.140 34.844 9.338 1.00 31.53 H new ATOM 0 HB2 ARG A 31 34.209 34.438 7.811 1.00 25.34 H new ATOM 0 HB3 ARG A 31 35.304 33.743 6.632 1.00 25.34 H new ATOM 0 HG2 ARG A 31 35.949 31.967 8.273 1.00 55.35 H new ATOM 0 HG3 ARG A 31 34.861 32.664 9.458 1.00 55.35 H new ATOM 0 HD2 ARG A 31 32.923 32.291 7.958 1.00 42.55 H new ATOM 0 HD3 ARG A 31 33.982 31.706 6.690 1.00 42.55 H new ATOM 0 HE ARG A 31 34.385 30.157 9.091 1.00 3.23 H new ATOM 0 HH11 ARG A 31 31.964 30.654 6.518 1.00 33.20 H new ATOM 0 HH12 ARG A 31 31.381 28.988 6.604 1.00 33.20 H new ATOM 0 HH21 ARG A 31 33.667 28.016 9.133 1.00 45.22 H new ATOM 0 HH22 ARG A 31 32.344 27.496 8.084 1.00 45.22 H new ATOM 460 N GLN A 32 38.112 34.093 6.776 1.00 34.54 N ATOM 461 CA GLN A 32 39.378 33.499 6.379 1.00 42.01 C ATOM 462 C GLN A 32 40.540 34.196 7.090 1.00 15.04 C ATOM 463 O GLN A 32 41.406 33.522 7.640 1.00 32.40 O ATOM 464 CB GLN A 32 39.548 33.530 4.852 1.00 11.12 C ATOM 465 CG GLN A 32 38.334 32.978 4.086 1.00 0.52 C ATOM 466 CD GLN A 32 37.856 31.637 4.627 1.00 14.24 C ATOM 467 OE1 GLN A 32 38.603 30.661 4.631 1.00 34.12 O ATOM 468 NE2 GLN A 32 36.604 31.581 5.079 1.00 62.04 N ATOM 0 H GLN A 32 37.610 34.532 6.004 1.00 34.54 H new ATOM 0 HA GLN A 32 39.379 32.452 6.682 1.00 42.01 H new ATOM 0 HB2 GLN A 32 39.730 34.557 4.536 1.00 11.12 H new ATOM 0 HB3 GLN A 32 40.431 32.952 4.581 1.00 11.12 H new ATOM 0 HG2 GLN A 32 37.518 33.698 4.140 1.00 0.52 H new ATOM 0 HG3 GLN A 32 38.593 32.868 3.033 1.00 0.52 H new ATOM 0 HE21 GLN A 32 36.016 32.415 5.058 1.00 62.04 H new ATOM 0 HE22 GLN A 32 36.233 30.705 5.446 1.00 62.04 H new ATOM 477 N ARG A 33 40.539 35.537 7.121 1.00 12.52 N ATOM 478 CA ARG A 33 41.554 36.304 7.836 1.00 3.24 C ATOM 479 C ARG A 33 41.616 35.902 9.314 1.00 71.43 C ATOM 480 O ARG A 33 42.705 35.702 9.845 1.00 32.44 O ATOM 481 CB ARG A 33 41.299 37.810 7.713 1.00 33.31 C ATOM 482 CG ARG A 33 41.478 38.327 6.281 1.00 45.42 C ATOM 483 CD ARG A 33 41.187 39.830 6.176 1.00 1.11 C ATOM 484 NE ARG A 33 42.161 40.648 6.920 1.00 2.15 N ATOM 485 CZ ARG A 33 42.008 41.135 8.166 1.00 71.32 C ATOM 486 NH1 ARG A 33 40.958 40.789 8.925 1.00 11.30 N ATOM 487 NH2 ARG A 33 42.925 41.979 8.657 1.00 5.55 N ATOM 0 H ARG A 33 39.838 36.111 6.653 1.00 12.52 H new ATOM 0 HA ARG A 33 42.515 36.076 7.375 1.00 3.24 H new ATOM 0 HB2 ARG A 33 40.286 38.031 8.051 1.00 33.31 H new ATOM 0 HB3 ARG A 33 41.980 38.345 8.375 1.00 33.31 H new ATOM 0 HG2 ARG A 33 42.497 38.130 5.949 1.00 45.42 H new ATOM 0 HG3 ARG A 33 40.813 37.781 5.612 1.00 45.42 H new ATOM 0 HD2 ARG A 33 41.196 40.126 5.127 1.00 1.11 H new ATOM 0 HD3 ARG A 33 40.185 40.030 6.555 1.00 1.11 H new ATOM 0 HE ARG A 33 43.037 40.867 6.445 1.00 2.15 H new ATOM 0 HH11 ARG A 33 40.256 40.145 8.561 1.00 11.30 H new ATOM 0 HH12 ARG A 33 40.862 41.170 9.866 1.00 11.30 H new ATOM 0 HH21 ARG A 33 43.728 42.246 8.088 1.00 5.55 H new ATOM 0 HH22 ARG A 33 42.820 42.354 9.600 1.00 5.55 H new ATOM 501 N ILE A 34 40.456 35.782 9.973 1.00 55.23 N ATOM 502 CA ILE A 34 40.354 35.387 11.373 1.00 14.53 C ATOM 503 C ILE A 34 40.952 33.991 11.558 1.00 12.51 C ATOM 504 O ILE A 34 41.766 33.802 12.455 1.00 15.23 O ATOM 505 CB ILE A 34 38.890 35.463 11.854 1.00 22.13 C ATOM 506 CG1 ILE A 34 38.392 36.919 11.862 1.00 11.02 C ATOM 507 CG2 ILE A 34 38.740 34.889 13.271 1.00 71.42 C ATOM 508 CD1 ILE A 34 36.865 36.989 11.750 1.00 70.54 C ATOM 0 H ILE A 34 39.552 35.961 9.537 1.00 55.23 H new ATOM 0 HA ILE A 34 40.925 36.080 11.990 1.00 14.53 H new ATOM 0 HB ILE A 34 38.294 34.872 11.158 1.00 22.13 H new ATOM 0 HG12 ILE A 34 38.714 37.410 12.780 1.00 11.02 H new ATOM 0 HG13 ILE A 34 38.844 37.464 11.034 1.00 11.02 H new ATOM 0 HG21 ILE A 34 37.698 34.956 13.582 1.00 71.42 H new ATOM 0 HG22 ILE A 34 39.053 33.845 13.276 1.00 71.42 H new ATOM 0 HG23 ILE A 34 39.362 35.458 13.962 1.00 71.42 H new ATOM 0 HD11 ILE A 34 36.547 38.032 11.759 1.00 70.54 H new ATOM 0 HD12 ILE A 34 36.547 36.520 10.819 1.00 70.54 H new ATOM 0 HD13 ILE A 34 36.414 36.465 12.593 1.00 70.54 H new ATOM 520 N VAL A 35 40.568 33.028 10.710 1.00 20.14 N ATOM 521 CA VAL A 35 41.083 31.661 10.736 1.00 54.14 C ATOM 522 C VAL A 35 42.614 31.656 10.647 1.00 34.12 C ATOM 523 O VAL A 35 43.276 31.061 11.498 1.00 22.12 O ATOM 524 CB VAL A 35 40.418 30.839 9.612 1.00 25.32 C ATOM 525 CG1 VAL A 35 41.136 29.512 9.334 1.00 70.22 C ATOM 526 CG2 VAL A 35 38.955 30.535 9.964 1.00 12.42 C ATOM 0 H VAL A 35 39.878 33.184 9.975 1.00 20.14 H new ATOM 0 HA VAL A 35 40.829 31.189 11.685 1.00 54.14 H new ATOM 0 HB VAL A 35 40.481 31.453 8.713 1.00 25.32 H new ATOM 0 HG11 VAL A 35 40.621 28.980 8.534 1.00 70.22 H new ATOM 0 HG12 VAL A 35 42.165 29.711 9.034 1.00 70.22 H new ATOM 0 HG13 VAL A 35 41.133 28.901 10.236 1.00 70.22 H new ATOM 0 HG21 VAL A 35 38.501 29.955 9.161 1.00 12.42 H new ATOM 0 HG22 VAL A 35 38.915 29.964 10.892 1.00 12.42 H new ATOM 0 HG23 VAL A 35 38.409 31.470 10.090 1.00 12.42 H new ATOM 536 N ASP A 36 43.174 32.319 9.628 1.00 73.42 N ATOM 537 CA ASP A 36 44.604 32.368 9.376 1.00 71.33 C ATOM 538 C ASP A 36 45.348 32.986 10.562 1.00 21.21 C ATOM 539 O ASP A 36 46.312 32.412 11.065 1.00 74.21 O ATOM 540 CB ASP A 36 44.862 33.181 8.101 1.00 25.21 C ATOM 541 CG ASP A 36 44.249 32.570 6.840 1.00 11.31 C ATOM 542 OD1 ASP A 36 44.165 31.325 6.781 1.00 13.44 O ATOM 543 OD2 ASP A 36 43.887 33.368 5.949 1.00 41.34 O ATOM 0 H ASP A 36 42.627 32.845 8.946 1.00 73.42 H new ATOM 0 HA ASP A 36 44.976 31.352 9.244 1.00 71.33 H new ATOM 0 HB2 ASP A 36 44.463 34.186 8.236 1.00 25.21 H new ATOM 0 HB3 ASP A 36 45.938 33.282 7.958 1.00 25.21 H new ATOM 548 N LEU A 37 44.897 34.164 11.002 1.00 11.33 N ATOM 549 CA LEU A 37 45.532 34.940 12.057 1.00 71.34 C ATOM 550 C LEU A 37 45.463 34.204 13.397 1.00 53.02 C ATOM 551 O LEU A 37 46.458 34.163 14.120 1.00 50.51 O ATOM 552 CB LEU A 37 44.850 36.317 12.111 1.00 64.14 C ATOM 553 CG LEU A 37 45.595 37.370 12.942 1.00 4.12 C ATOM 554 CD1 LEU A 37 46.807 37.926 12.183 1.00 12.04 C ATOM 555 CD2 LEU A 37 44.635 38.526 13.239 1.00 75.32 C ATOM 0 H LEU A 37 44.062 34.610 10.623 1.00 11.33 H new ATOM 0 HA LEU A 37 46.592 35.076 11.844 1.00 71.34 H new ATOM 0 HB2 LEU A 37 44.736 36.691 11.094 1.00 64.14 H new ATOM 0 HB3 LEU A 37 43.847 36.195 12.520 1.00 64.14 H new ATOM 0 HG LEU A 37 45.947 36.900 13.861 1.00 4.12 H new ATOM 0 HD11 LEU A 37 47.313 38.669 12.799 1.00 12.04 H new ATOM 0 HD12 LEU A 37 47.497 37.114 11.955 1.00 12.04 H new ATOM 0 HD13 LEU A 37 46.473 38.390 11.255 1.00 12.04 H new ATOM 0 HD21 LEU A 37 45.150 39.284 13.830 1.00 75.32 H new ATOM 0 HD22 LEU A 37 44.294 38.966 12.302 1.00 75.32 H new ATOM 0 HD23 LEU A 37 43.777 38.152 13.797 1.00 75.32 H new ATOM 567 N ALA A 38 44.308 33.600 13.709 1.00 54.54 N ATOM 568 CA ALA A 38 44.072 32.829 14.926 1.00 44.23 C ATOM 569 C ALA A 38 45.053 31.666 15.088 1.00 71.40 C ATOM 570 O ALA A 38 45.304 31.253 16.218 1.00 63.45 O ATOM 571 CB ALA A 38 42.631 32.311 14.958 1.00 73.10 C ATOM 0 H ALA A 38 43.491 33.639 13.100 1.00 54.54 H new ATOM 0 HA ALA A 38 44.236 33.506 15.765 1.00 44.23 H new ATOM 0 HB1 ALA A 38 42.470 31.738 15.871 1.00 73.10 H new ATOM 0 HB2 ALA A 38 41.941 33.154 14.932 1.00 73.10 H new ATOM 0 HB3 ALA A 38 42.455 31.672 14.093 1.00 73.10 H new ATOM 577 N HIS A 39 45.612 31.153 13.983 1.00 54.14 N ATOM 578 CA HIS A 39 46.594 30.075 13.995 1.00 64.42 C ATOM 579 C HIS A 39 47.802 30.425 14.878 1.00 65.05 C ATOM 580 O HIS A 39 48.373 29.537 15.510 1.00 72.22 O ATOM 581 CB HIS A 39 47.013 29.751 12.553 1.00 72.42 C ATOM 582 CG HIS A 39 47.616 28.380 12.362 1.00 10.43 C ATOM 583 ND1 HIS A 39 48.531 27.823 13.243 1.00 35.52 N ATOM 584 CD2 HIS A 39 47.438 27.432 11.383 1.00 62.25 C ATOM 585 CE1 HIS A 39 48.855 26.608 12.771 1.00 75.31 C ATOM 586 NE2 HIS A 39 48.221 26.309 11.636 1.00 51.30 N ATOM 0 H HIS A 39 45.387 31.485 13.045 1.00 54.14 H new ATOM 0 HA HIS A 39 46.141 29.186 14.433 1.00 64.42 H new ATOM 0 HB2 HIS A 39 46.140 29.842 11.907 1.00 72.42 H new ATOM 0 HB3 HIS A 39 47.734 30.499 12.222 1.00 72.42 H new ATOM 0 HD1 HIS A 39 48.892 28.256 14.093 1.00 35.52 H new ATOM 0 HD2 HIS A 39 46.781 27.543 10.533 1.00 62.25 H new ATOM 0 HE1 HIS A 39 49.554 25.944 13.258 1.00 75.31 H new ATOM 594 N GLN A 40 48.174 31.711 14.947 1.00 64.44 N ATOM 595 CA GLN A 40 49.225 32.203 15.834 1.00 70.13 C ATOM 596 C GLN A 40 48.943 31.888 17.309 1.00 72.24 C ATOM 597 O GLN A 40 49.880 31.678 18.077 1.00 30.03 O ATOM 598 CB GLN A 40 49.361 33.721 15.674 1.00 22.25 C ATOM 599 CG GLN A 40 49.776 34.113 14.253 1.00 15.33 C ATOM 600 CD GLN A 40 49.877 35.623 14.106 1.00 53.53 C ATOM 601 OE1 GLN A 40 50.964 36.165 13.919 1.00 73.34 O ATOM 602 NE2 GLN A 40 48.734 36.302 14.180 1.00 55.34 N ATOM 0 H GLN A 40 47.746 32.443 14.380 1.00 64.44 H new ATOM 0 HA GLN A 40 50.147 31.695 15.551 1.00 70.13 H new ATOM 0 HB2 GLN A 40 48.412 34.198 15.919 1.00 22.25 H new ATOM 0 HB3 GLN A 40 50.099 34.096 16.384 1.00 22.25 H new ATOM 0 HG2 GLN A 40 50.736 33.657 14.013 1.00 15.33 H new ATOM 0 HG3 GLN A 40 49.051 33.723 13.539 1.00 15.33 H new ATOM 0 HE21 GLN A 40 47.856 35.807 14.337 1.00 55.34 H new ATOM 0 HE22 GLN A 40 48.736 37.317 14.080 1.00 55.34 H new ATOM 611 N GLY A 41 47.663 31.902 17.703 1.00 21.22 N ATOM 612 CA GLY A 41 47.215 31.828 19.084 1.00 34.21 C ATOM 613 C GLY A 41 46.814 33.225 19.550 1.00 51.23 C ATOM 614 O GLY A 41 47.388 33.756 20.501 1.00 11.11 O ATOM 0 H GLY A 41 46.891 31.968 17.040 1.00 21.22 H new ATOM 0 HA2 GLY A 41 46.370 31.145 19.170 1.00 34.21 H new ATOM 0 HA3 GLY A 41 48.009 31.433 19.717 1.00 34.21 H new ATOM 618 N VAL A 42 45.835 33.823 18.859 1.00 5.13 N ATOM 619 CA VAL A 42 45.405 35.196 19.081 1.00 72.41 C ATOM 620 C VAL A 42 44.717 35.337 20.437 1.00 61.44 C ATOM 621 O VAL A 42 43.686 34.714 20.689 1.00 43.31 O ATOM 622 CB VAL A 42 44.494 35.648 17.925 1.00 24.32 C ATOM 623 CG1 VAL A 42 43.738 36.949 18.222 1.00 71.43 C ATOM 624 CG2 VAL A 42 45.341 35.869 16.667 1.00 40.52 C ATOM 0 H VAL A 42 45.315 33.352 18.119 1.00 5.13 H new ATOM 0 HA VAL A 42 46.279 35.848 19.099 1.00 72.41 H new ATOM 0 HB VAL A 42 43.757 34.857 17.785 1.00 24.32 H new ATOM 0 HG11 VAL A 42 43.115 37.211 17.367 1.00 71.43 H new ATOM 0 HG12 VAL A 42 43.109 36.811 19.101 1.00 71.43 H new ATOM 0 HG13 VAL A 42 44.453 37.750 18.409 1.00 71.43 H new ATOM 0 HG21 VAL A 42 44.698 36.189 15.847 1.00 40.52 H new ATOM 0 HG22 VAL A 42 46.089 36.637 16.862 1.00 40.52 H new ATOM 0 HG23 VAL A 42 45.839 34.938 16.395 1.00 40.52 H new ATOM 634 N ARG A 43 45.277 36.208 21.282 1.00 31.12 N ATOM 635 CA ARG A 43 44.660 36.696 22.505 1.00 25.20 C ATOM 636 C ARG A 43 43.767 37.895 22.149 1.00 33.45 C ATOM 637 O ARG A 43 44.022 38.547 21.136 1.00 63.22 O ATOM 638 CB ARG A 43 45.770 37.115 23.481 1.00 55.44 C ATOM 639 CG ARG A 43 46.811 36.006 23.676 1.00 24.15 C ATOM 640 CD ARG A 43 47.795 36.367 24.791 1.00 33.13 C ATOM 641 NE ARG A 43 48.807 35.314 24.957 1.00 30.43 N ATOM 642 CZ ARG A 43 49.779 35.316 25.885 1.00 30.24 C ATOM 643 NH1 ARG A 43 49.891 36.325 26.761 1.00 40.32 N ATOM 644 NH2 ARG A 43 50.646 34.296 25.935 1.00 13.43 N ATOM 0 H ARG A 43 46.204 36.602 21.122 1.00 31.12 H new ATOM 0 HA ARG A 43 44.051 35.924 22.976 1.00 25.20 H new ATOM 0 HB2 ARG A 43 46.262 38.013 23.107 1.00 55.44 H new ATOM 0 HB3 ARG A 43 45.328 37.371 24.444 1.00 55.44 H new ATOM 0 HG2 ARG A 43 46.309 35.070 23.919 1.00 24.15 H new ATOM 0 HG3 ARG A 43 47.354 35.845 22.745 1.00 24.15 H new ATOM 0 HD2 ARG A 43 48.283 37.313 24.558 1.00 33.13 H new ATOM 0 HD3 ARG A 43 47.255 36.509 25.727 1.00 33.13 H new ATOM 0 HE ARG A 43 48.769 34.520 24.318 1.00 30.43 H new ATOM 0 HH11 ARG A 43 49.233 37.104 26.728 1.00 40.32 H new ATOM 0 HH12 ARG A 43 50.634 36.313 27.460 1.00 40.32 H new ATOM 0 HH21 ARG A 43 50.566 33.525 25.272 1.00 13.43 H new ATOM 0 HH22 ARG A 43 51.387 34.290 26.636 1.00 13.43 H new ATOM 658 N PRO A 44 42.740 38.220 22.956 1.00 60.31 N ATOM 659 CA PRO A 44 41.879 39.380 22.743 1.00 53.44 C ATOM 660 C PRO A 44 42.620 40.663 23.150 1.00 44.13 C ATOM 661 O PRO A 44 42.270 41.311 24.134 1.00 14.24 O ATOM 662 CB PRO A 44 40.635 39.103 23.593 1.00 52.04 C ATOM 663 CG PRO A 44 41.196 38.300 24.766 1.00 50.42 C ATOM 664 CD PRO A 44 42.287 37.455 24.107 1.00 51.53 C ATOM 0 HA PRO A 44 41.599 39.531 21.701 1.00 53.44 H new ATOM 0 HB2 PRO A 44 40.159 40.026 23.926 1.00 52.04 H new ATOM 0 HB3 PRO A 44 39.885 38.539 23.039 1.00 52.04 H new ATOM 0 HG2 PRO A 44 41.601 38.948 25.543 1.00 50.42 H new ATOM 0 HG3 PRO A 44 40.432 37.680 25.234 1.00 50.42 H new ATOM 0 HD2 PRO A 44 43.108 37.267 24.799 1.00 51.53 H new ATOM 0 HD3 PRO A 44 41.898 36.483 23.802 1.00 51.53 H new ATOM 672 N CYS A 45 43.660 40.994 22.375 1.00 45.34 N ATOM 673 CA CYS A 45 44.654 42.044 22.585 1.00 24.33 C ATOM 674 C CYS A 45 45.821 41.857 21.604 1.00 41.13 C ATOM 675 O CYS A 45 46.442 42.835 21.194 1.00 21.13 O ATOM 676 CB CYS A 45 45.163 42.105 24.036 1.00 50.13 C ATOM 677 SG CYS A 45 45.782 40.494 24.596 1.00 41.05 S ATOM 0 H CYS A 45 43.840 40.486 21.509 1.00 45.34 H new ATOM 0 HA CYS A 45 44.165 42.999 22.394 1.00 24.33 H new ATOM 0 HB2 CYS A 45 45.958 42.847 24.112 1.00 50.13 H new ATOM 0 HB3 CYS A 45 44.356 42.433 24.692 1.00 50.13 H new ATOM 0 HG CYS A 45 46.202 40.593 25.822 1.00 41.05 H new ATOM 683 N ASP A 46 46.112 40.611 21.203 1.00 33.22 N ATOM 684 CA ASP A 46 47.105 40.309 20.179 1.00 11.44 C ATOM 685 C ASP A 46 46.723 40.915 18.822 1.00 64.43 C ATOM 686 O ASP A 46 47.598 41.232 18.018 1.00 73.35 O ATOM 687 CB ASP A 46 47.294 38.790 20.078 1.00 64.41 C ATOM 688 CG ASP A 46 48.444 38.409 19.152 1.00 32.23 C ATOM 689 OD1 ASP A 46 49.483 39.102 19.212 1.00 72.12 O ATOM 690 OD2 ASP A 46 48.266 37.425 18.402 1.00 65.51 O ATOM 0 H ASP A 46 45.658 39.783 21.587 1.00 33.22 H new ATOM 0 HA ASP A 46 48.052 40.764 20.470 1.00 11.44 H new ATOM 0 HB2 ASP A 46 47.481 38.383 21.072 1.00 64.41 H new ATOM 0 HB3 ASP A 46 46.372 38.335 19.715 1.00 64.41 H new ATOM 695 N ILE A 47 45.421 41.118 18.580 1.00 12.32 N ATOM 696 CA ILE A 47 44.947 41.914 17.457 1.00 44.23 C ATOM 697 C ILE A 47 45.492 43.336 17.591 1.00 63.21 C ATOM 698 O ILE A 47 46.148 43.831 16.677 1.00 55.03 O ATOM 699 CB ILE A 47 43.410 41.938 17.404 1.00 32.41 C ATOM 700 CG1 ILE A 47 42.775 40.539 17.321 1.00 52.54 C ATOM 701 CG2 ILE A 47 42.946 42.812 16.228 1.00 55.41 C ATOM 702 CD1 ILE A 47 43.240 39.727 16.110 1.00 65.42 C ATOM 0 H ILE A 47 44.675 40.733 19.159 1.00 12.32 H new ATOM 0 HA ILE A 47 45.304 41.465 16.530 1.00 44.23 H new ATOM 0 HB ILE A 47 43.068 42.366 18.346 1.00 32.41 H new ATOM 0 HG12 ILE A 47 43.011 39.987 18.231 1.00 52.54 H new ATOM 0 HG13 ILE A 47 41.691 40.643 17.284 1.00 52.54 H new ATOM 0 HG21 ILE A 47 41.857 42.827 16.193 1.00 55.41 H new ATOM 0 HG22 ILE A 47 43.319 43.828 16.360 1.00 55.41 H new ATOM 0 HG23 ILE A 47 43.333 42.402 15.295 1.00 55.41 H new ATOM 0 HD11 ILE A 47 42.752 38.752 16.116 1.00 65.42 H new ATOM 0 HD12 ILE A 47 42.979 40.258 15.194 1.00 65.42 H new ATOM 0 HD13 ILE A 47 44.321 39.592 16.156 1.00 65.42 H new ATOM 714 N SER A 48 45.220 43.982 18.732 1.00 61.32 N ATOM 715 CA SER A 48 45.650 45.340 19.036 1.00 5.34 C ATOM 716 C SER A 48 47.149 45.526 18.777 1.00 10.01 C ATOM 717 O SER A 48 47.538 46.535 18.192 1.00 53.45 O ATOM 718 CB SER A 48 45.277 45.706 20.478 1.00 12.44 C ATOM 719 OG SER A 48 43.973 45.265 20.797 1.00 3.32 O ATOM 0 H SER A 48 44.680 43.557 19.485 1.00 61.32 H new ATOM 0 HA SER A 48 45.126 46.022 18.366 1.00 5.34 H new ATOM 0 HB2 SER A 48 45.994 45.258 21.166 1.00 12.44 H new ATOM 0 HB3 SER A 48 45.341 46.786 20.610 1.00 12.44 H new ATOM 0 HG SER A 48 43.372 46.037 20.857 1.00 3.32 H new ATOM 725 N ARG A 49 47.976 44.542 19.173 1.00 33.32 N ATOM 726 CA ARG A 49 49.407 44.534 18.887 1.00 23.00 C ATOM 727 C ARG A 49 49.666 44.655 17.386 1.00 51.22 C ATOM 728 O ARG A 49 50.237 45.642 16.931 1.00 11.33 O ATOM 729 CB ARG A 49 50.077 43.247 19.393 1.00 14.42 C ATOM 730 CG ARG A 49 50.089 43.141 20.915 1.00 32.01 C ATOM 731 CD ARG A 49 50.856 41.895 21.389 1.00 14.02 C ATOM 732 NE ARG A 49 52.248 41.881 20.905 1.00 23.11 N ATOM 733 CZ ARG A 49 52.752 41.118 19.916 1.00 25.34 C ATOM 734 NH1 ARG A 49 52.007 40.217 19.260 1.00 53.52 N ATOM 735 NH2 ARG A 49 54.038 41.270 19.567 1.00 31.03 N ATOM 0 H ARG A 49 47.661 43.729 19.703 1.00 33.32 H new ATOM 0 HA ARG A 49 49.834 45.391 19.407 1.00 23.00 H new ATOM 0 HB2 ARG A 49 49.555 42.385 18.978 1.00 14.42 H new ATOM 0 HB3 ARG A 49 51.102 43.208 19.023 1.00 14.42 H new ATOM 0 HG2 ARG A 49 50.547 44.034 21.339 1.00 32.01 H new ATOM 0 HG3 ARG A 49 49.065 43.102 21.286 1.00 32.01 H new ATOM 0 HD2 ARG A 49 50.852 41.860 22.478 1.00 14.02 H new ATOM 0 HD3 ARG A 49 50.342 40.999 21.039 1.00 14.02 H new ATOM 0 HE ARG A 49 52.898 42.516 21.368 1.00 23.11 H new ATOM 0 HH11 ARG A 49 51.025 40.092 19.505 1.00 53.52 H new ATOM 0 HH12 ARG A 49 52.422 39.656 18.516 1.00 53.52 H new ATOM 0 HH21 ARG A 49 54.619 41.956 20.049 1.00 31.03 H new ATOM 0 HH22 ARG A 49 54.435 40.700 18.820 1.00 31.03 H new ATOM 749 N GLN A 50 49.290 43.617 16.637 1.00 1.32 N ATOM 750 CA GLN A 50 49.650 43.445 15.239 1.00 42.25 C ATOM 751 C GLN A 50 49.071 44.540 14.341 1.00 5.33 C ATOM 752 O GLN A 50 49.783 45.077 13.492 1.00 25.13 O ATOM 753 CB GLN A 50 49.167 42.065 14.789 1.00 4.54 C ATOM 754 CG GLN A 50 49.928 40.955 15.519 1.00 73.32 C ATOM 755 CD GLN A 50 49.374 39.592 15.130 1.00 65.22 C ATOM 756 OE1 GLN A 50 49.786 39.015 14.128 1.00 72.02 O ATOM 757 NE2 GLN A 50 48.430 39.081 15.919 1.00 41.11 N ATOM 0 H GLN A 50 48.713 42.858 16.999 1.00 1.32 H new ATOM 0 HA GLN A 50 50.733 43.523 15.146 1.00 42.25 H new ATOM 0 HB2 GLN A 50 48.099 41.968 14.984 1.00 4.54 H new ATOM 0 HB3 GLN A 50 49.306 41.960 13.713 1.00 4.54 H new ATOM 0 HG2 GLN A 50 50.988 41.008 15.272 1.00 73.32 H new ATOM 0 HG3 GLN A 50 49.844 41.095 16.597 1.00 73.32 H new ATOM 0 HE21 GLN A 50 48.119 39.597 16.742 1.00 41.11 H new ATOM 0 HE22 GLN A 50 48.019 38.174 15.700 1.00 41.11 H new ATOM 766 N LEU A 51 47.781 44.848 14.515 1.00 54.35 N ATOM 767 CA LEU A 51 47.026 45.745 13.651 1.00 42.20 C ATOM 768 C LEU A 51 47.194 47.200 14.089 1.00 73.24 C ATOM 769 O LEU A 51 46.842 48.097 13.328 1.00 65.44 O ATOM 770 CB LEU A 51 45.537 45.350 13.637 1.00 61.01 C ATOM 771 CG LEU A 51 45.164 44.118 12.791 1.00 45.44 C ATOM 772 CD1 LEU A 51 45.346 44.362 11.288 1.00 21.35 C ATOM 773 CD2 LEU A 51 45.896 42.836 13.202 1.00 3.32 C ATOM 0 H LEU A 51 47.225 44.468 15.281 1.00 54.35 H new ATOM 0 HA LEU A 51 47.419 45.653 12.639 1.00 42.20 H new ATOM 0 HB2 LEU A 51 45.222 45.167 14.664 1.00 61.01 H new ATOM 0 HB3 LEU A 51 44.961 46.201 13.274 1.00 61.01 H new ATOM 0 HG LEU A 51 44.105 43.963 12.996 1.00 45.44 H new ATOM 0 HD11 LEU A 51 45.069 43.463 10.737 1.00 21.35 H new ATOM 0 HD12 LEU A 51 44.710 45.190 10.974 1.00 21.35 H new ATOM 0 HD13 LEU A 51 46.388 44.607 11.083 1.00 21.35 H new ATOM 0 HD21 LEU A 51 45.579 42.014 12.560 1.00 3.32 H new ATOM 0 HD22 LEU A 51 46.971 42.982 13.100 1.00 3.32 H new ATOM 0 HD23 LEU A 51 45.659 42.598 14.239 1.00 3.32 H new ATOM 785 N ARG A 52 47.760 47.442 15.280 1.00 3.23 N ATOM 786 CA ARG A 52 48.100 48.763 15.797 1.00 11.02 C ATOM 787 C ARG A 52 46.840 49.565 16.134 1.00 52.20 C ATOM 788 O ARG A 52 46.776 50.768 15.892 1.00 72.53 O ATOM 789 CB ARG A 52 49.030 49.541 14.843 1.00 41.45 C ATOM 790 CG ARG A 52 50.118 48.691 14.177 1.00 41.12 C ATOM 791 CD ARG A 52 51.171 48.163 15.155 1.00 14.11 C ATOM 792 NE ARG A 52 51.773 46.928 14.637 1.00 54.33 N ATOM 793 CZ ARG A 52 52.818 46.283 15.179 1.00 51.34 C ATOM 794 NH1 ARG A 52 53.435 46.766 16.267 1.00 64.01 N ATOM 795 NH2 ARG A 52 53.244 45.142 14.621 1.00 13.34 N ATOM 0 H ARG A 52 48.000 46.692 15.928 1.00 3.23 H new ATOM 0 HA ARG A 52 48.657 48.612 16.722 1.00 11.02 H new ATOM 0 HB2 ARG A 52 48.424 50.006 14.065 1.00 41.45 H new ATOM 0 HB3 ARG A 52 49.507 50.347 15.400 1.00 41.45 H new ATOM 0 HG2 ARG A 52 49.649 47.847 13.672 1.00 41.12 H new ATOM 0 HG3 ARG A 52 50.613 49.286 13.410 1.00 41.12 H new ATOM 0 HD2 ARG A 52 51.944 48.916 15.309 1.00 14.11 H new ATOM 0 HD3 ARG A 52 50.713 47.973 16.126 1.00 14.11 H new ATOM 0 HE ARG A 52 51.362 46.526 13.794 1.00 54.33 H new ATOM 0 HH11 ARG A 52 53.111 47.634 16.694 1.00 64.01 H new ATOM 0 HH12 ARG A 52 54.228 46.265 16.668 1.00 64.01 H new ATOM 0 HH21 ARG A 52 52.775 44.773 13.794 1.00 13.34 H new ATOM 0 HH22 ARG A 52 54.037 44.643 15.023 1.00 13.34 H new ATOM 809 N VAL A 53 45.840 48.874 16.689 1.00 14.23 N ATOM 810 CA VAL A 53 44.527 49.423 17.023 1.00 44.21 C ATOM 811 C VAL A 53 44.266 49.345 18.531 1.00 12.52 C ATOM 812 O VAL A 53 45.107 48.859 19.284 1.00 50.33 O ATOM 813 CB VAL A 53 43.431 48.710 16.211 1.00 54.35 C ATOM 814 CG1 VAL A 53 43.651 48.930 14.712 1.00 40.22 C ATOM 815 CG2 VAL A 53 43.344 47.210 16.516 1.00 12.21 C ATOM 0 H VAL A 53 45.927 47.885 16.925 1.00 14.23 H new ATOM 0 HA VAL A 53 44.508 50.479 16.752 1.00 44.21 H new ATOM 0 HB VAL A 53 42.481 49.152 16.511 1.00 54.35 H new ATOM 0 HG11 VAL A 53 42.868 48.420 14.151 1.00 40.22 H new ATOM 0 HG12 VAL A 53 43.618 49.997 14.492 1.00 40.22 H new ATOM 0 HG13 VAL A 53 44.623 48.530 14.424 1.00 40.22 H new ATOM 0 HG21 VAL A 53 42.554 46.762 15.914 1.00 12.21 H new ATOM 0 HG22 VAL A 53 44.296 46.735 16.278 1.00 12.21 H new ATOM 0 HG23 VAL A 53 43.121 47.066 17.573 1.00 12.21 H new ATOM 825 N SER A 54 43.095 49.838 18.958 1.00 14.54 N ATOM 826 CA SER A 54 42.651 49.839 20.344 1.00 2.20 C ATOM 827 C SER A 54 41.692 48.667 20.584 1.00 62.11 C ATOM 828 O SER A 54 42.136 47.589 20.979 1.00 63.21 O ATOM 829 CB SER A 54 42.028 51.204 20.679 1.00 44.52 C ATOM 830 OG SER A 54 41.018 51.558 19.751 1.00 53.04 O ATOM 0 H SER A 54 42.416 50.258 18.323 1.00 14.54 H new ATOM 0 HA SER A 54 43.496 49.696 21.017 1.00 2.20 H new ATOM 0 HB2 SER A 54 41.606 51.175 21.684 1.00 44.52 H new ATOM 0 HB3 SER A 54 42.805 51.968 20.681 1.00 44.52 H new ATOM 0 HG SER A 54 40.642 52.430 19.994 1.00 53.04 H new ATOM 836 N HIS A 55 40.389 48.890 20.358 1.00 11.45 N ATOM 837 CA HIS A 55 39.308 47.952 20.652 1.00 11.43 C ATOM 838 C HIS A 55 38.202 48.025 19.592 1.00 72.34 C ATOM 839 O HIS A 55 37.669 46.995 19.186 1.00 1.32 O ATOM 840 CB HIS A 55 38.733 48.238 22.045 1.00 1.41 C ATOM 841 CG HIS A 55 39.743 48.083 23.154 1.00 54.40 C ATOM 842 ND1 HIS A 55 40.205 49.158 23.900 1.00 32.12 N ATOM 843 CD2 HIS A 55 40.411 46.988 23.646 1.00 62.44 C ATOM 844 CE1 HIS A 55 41.105 48.677 24.776 1.00 10.54 C ATOM 845 NE2 HIS A 55 41.275 47.358 24.671 1.00 14.51 N ATOM 0 H HIS A 55 40.052 49.762 19.950 1.00 11.45 H new ATOM 0 HA HIS A 55 39.718 46.942 20.634 1.00 11.43 H new ATOM 0 HB2 HIS A 55 38.336 49.253 22.065 1.00 1.41 H new ATOM 0 HB3 HIS A 55 37.896 47.565 22.229 1.00 1.41 H new ATOM 0 HD2 HIS A 55 40.283 45.978 23.286 1.00 62.44 H new ATOM 0 HE1 HIS A 55 41.634 49.293 25.488 1.00 10.54 H new ATOM 0 HE2 HIS A 55 41.895 46.759 25.216 1.00 14.51 H new ATOM 853 N GLY A 56 37.848 49.237 19.142 1.00 30.50 N ATOM 854 CA GLY A 56 36.800 49.449 18.151 1.00 14.20 C ATOM 855 C GLY A 56 37.038 48.638 16.876 1.00 21.42 C ATOM 856 O GLY A 56 36.121 47.991 16.371 1.00 1.34 O ATOM 0 H GLY A 56 38.288 50.100 19.462 1.00 30.50 H new ATOM 0 HA2 GLY A 56 35.836 49.174 18.580 1.00 14.20 H new ATOM 0 HA3 GLY A 56 36.748 50.509 17.901 1.00 14.20 H new ATOM 860 N CYS A 57 38.275 48.661 16.367 1.00 13.23 N ATOM 861 CA CYS A 57 38.663 47.921 15.174 1.00 43.01 C ATOM 862 C CYS A 57 38.945 46.449 15.488 1.00 41.31 C ATOM 863 O CYS A 57 38.837 45.625 14.586 1.00 60.12 O ATOM 864 CB CYS A 57 39.874 48.577 14.506 1.00 63.43 C ATOM 865 SG CYS A 57 39.405 50.154 13.739 1.00 13.51 S ATOM 0 H CYS A 57 39.037 49.200 16.779 1.00 13.23 H new ATOM 0 HA CYS A 57 37.824 47.950 14.479 1.00 43.01 H new ATOM 0 HB2 CYS A 57 40.657 48.745 15.245 1.00 63.43 H new ATOM 0 HB3 CYS A 57 40.286 47.908 13.751 1.00 63.43 H new ATOM 0 HG CYS A 57 40.448 50.692 13.181 1.00 13.51 H new ATOM 871 N VAL A 58 39.276 46.099 16.740 1.00 54.31 N ATOM 872 CA VAL A 58 39.457 44.704 17.134 1.00 52.11 C ATOM 873 C VAL A 58 38.178 43.918 16.834 1.00 34.30 C ATOM 874 O VAL A 58 38.246 42.836 16.257 1.00 10.42 O ATOM 875 CB VAL A 58 39.855 44.581 18.616 1.00 1.03 C ATOM 876 CG1 VAL A 58 39.973 43.112 19.045 1.00 35.20 C ATOM 877 CG2 VAL A 58 41.185 45.289 18.887 1.00 70.44 C ATOM 0 H VAL A 58 39.423 46.769 17.495 1.00 54.31 H new ATOM 0 HA VAL A 58 40.276 44.281 16.553 1.00 52.11 H new ATOM 0 HB VAL A 58 39.066 45.057 19.197 1.00 1.03 H new ATOM 0 HG11 VAL A 58 40.255 43.062 20.097 1.00 35.20 H new ATOM 0 HG12 VAL A 58 39.014 42.613 18.902 1.00 35.20 H new ATOM 0 HG13 VAL A 58 40.733 42.617 18.441 1.00 35.20 H new ATOM 0 HG21 VAL A 58 41.443 45.187 19.941 1.00 70.44 H new ATOM 0 HG22 VAL A 58 41.968 44.839 18.276 1.00 70.44 H new ATOM 0 HG23 VAL A 58 41.092 46.346 18.637 1.00 70.44 H new ATOM 887 N SER A 59 37.020 44.483 17.195 1.00 41.43 N ATOM 888 CA SER A 59 35.723 43.899 16.892 1.00 62.23 C ATOM 889 C SER A 59 35.548 43.680 15.385 1.00 22.22 C ATOM 890 O SER A 59 35.119 42.605 14.974 1.00 50.54 O ATOM 891 CB SER A 59 34.612 44.782 17.468 1.00 62.43 C ATOM 892 OG SER A 59 33.351 44.177 17.259 1.00 14.11 O ATOM 0 H SER A 59 36.964 45.363 17.708 1.00 41.43 H new ATOM 0 HA SER A 59 35.662 42.917 17.361 1.00 62.23 H new ATOM 0 HB2 SER A 59 34.777 44.938 18.534 1.00 62.43 H new ATOM 0 HB3 SER A 59 34.636 45.764 16.995 1.00 62.43 H new ATOM 0 HG SER A 59 32.648 44.749 17.632 1.00 14.11 H new ATOM 898 N LYS A 60 35.886 44.683 14.562 1.00 42.34 N ATOM 899 CA LYS A 60 35.776 44.585 13.109 1.00 4.01 C ATOM 900 C LYS A 60 36.635 43.437 12.574 1.00 43.12 C ATOM 901 O LYS A 60 36.156 42.644 11.765 1.00 43.04 O ATOM 902 CB LYS A 60 36.164 45.906 12.434 1.00 51.40 C ATOM 903 CG LYS A 60 35.254 47.063 12.860 1.00 43.20 C ATOM 904 CD LYS A 60 35.606 48.327 12.067 1.00 44.54 C ATOM 905 CE LYS A 60 34.770 49.511 12.563 1.00 33.44 C ATOM 906 NZ LYS A 60 35.094 50.748 11.829 1.00 12.15 N ATOM 0 H LYS A 60 36.242 45.581 14.889 1.00 42.34 H new ATOM 0 HA LYS A 60 34.734 44.376 12.869 1.00 4.01 H new ATOM 0 HB2 LYS A 60 37.197 46.149 12.682 1.00 51.40 H new ATOM 0 HB3 LYS A 60 36.115 45.787 11.352 1.00 51.40 H new ATOM 0 HG2 LYS A 60 34.211 46.797 12.691 1.00 43.20 H new ATOM 0 HG3 LYS A 60 35.366 47.251 13.928 1.00 43.20 H new ATOM 0 HD2 LYS A 60 36.667 48.550 12.176 1.00 44.54 H new ATOM 0 HD3 LYS A 60 35.423 48.162 11.005 1.00 44.54 H new ATOM 0 HE2 LYS A 60 33.710 49.284 12.445 1.00 33.44 H new ATOM 0 HE3 LYS A 60 34.947 49.662 13.628 1.00 33.44 H new ATOM 0 HZ1 LYS A 60 34.510 51.529 12.190 1.00 12.15 H new ATOM 0 HZ2 LYS A 60 36.100 50.977 11.962 1.00 12.15 H new ATOM 0 HZ3 LYS A 60 34.901 50.611 10.816 1.00 12.15 H new ATOM 920 N ILE A 61 37.893 43.343 13.026 1.00 32.54 N ATOM 921 CA ILE A 61 38.802 42.254 12.687 1.00 71.44 C ATOM 922 C ILE A 61 38.174 40.910 13.062 1.00 61.42 C ATOM 923 O ILE A 61 38.207 39.984 12.256 1.00 0.00 O ATOM 924 CB ILE A 61 40.167 42.468 13.368 1.00 3.41 C ATOM 925 CG1 ILE A 61 40.884 43.731 12.854 1.00 0.01 C ATOM 926 CG2 ILE A 61 41.068 41.235 13.207 1.00 51.11 C ATOM 927 CD1 ILE A 61 41.564 43.542 11.498 1.00 72.35 C ATOM 0 H ILE A 61 38.309 44.036 13.648 1.00 32.54 H new ATOM 0 HA ILE A 61 38.975 42.246 11.611 1.00 71.44 H new ATOM 0 HB ILE A 61 39.967 42.615 14.429 1.00 3.41 H new ATOM 0 HG12 ILE A 61 40.161 44.543 12.778 1.00 0.01 H new ATOM 0 HG13 ILE A 61 41.631 44.037 13.586 1.00 0.01 H new ATOM 0 HG21 ILE A 61 42.024 41.416 13.698 1.00 51.11 H new ATOM 0 HG22 ILE A 61 40.585 40.370 13.661 1.00 51.11 H new ATOM 0 HG23 ILE A 61 41.235 41.042 12.147 1.00 51.11 H new ATOM 0 HD11 ILE A 61 42.048 44.473 11.201 1.00 72.35 H new ATOM 0 HD12 ILE A 61 42.312 42.752 11.573 1.00 72.35 H new ATOM 0 HD13 ILE A 61 40.818 43.266 10.752 1.00 72.35 H new ATOM 939 N LEU A 62 37.585 40.814 14.262 1.00 31.03 N ATOM 940 CA LEU A 62 36.879 39.626 14.729 1.00 54.13 C ATOM 941 C LEU A 62 35.598 39.335 13.935 1.00 34.23 C ATOM 942 O LEU A 62 35.073 38.228 14.040 1.00 64.11 O ATOM 943 CB LEU A 62 36.592 39.727 16.239 1.00 61.14 C ATOM 944 CG LEU A 62 37.368 38.716 17.098 1.00 5.45 C ATOM 945 CD1 LEU A 62 36.961 37.270 16.784 1.00 64.20 C ATOM 946 CD2 LEU A 62 38.887 38.905 16.983 1.00 42.54 C ATOM 0 H LEU A 62 37.589 41.575 14.942 1.00 31.03 H new ATOM 0 HA LEU A 62 37.539 38.777 14.553 1.00 54.13 H new ATOM 0 HB2 LEU A 62 36.834 40.735 16.577 1.00 61.14 H new ATOM 0 HB3 LEU A 62 35.524 39.583 16.405 1.00 61.14 H new ATOM 0 HG LEU A 62 37.097 38.915 18.135 1.00 5.45 H new ATOM 0 HD11 LEU A 62 37.532 36.587 17.412 1.00 64.20 H new ATOM 0 HD12 LEU A 62 35.897 37.141 16.981 1.00 64.20 H new ATOM 0 HD13 LEU A 62 37.164 37.054 15.735 1.00 64.20 H new ATOM 0 HD21 LEU A 62 39.394 38.169 17.607 1.00 42.54 H new ATOM 0 HD22 LEU A 62 39.193 38.773 15.945 1.00 42.54 H new ATOM 0 HD23 LEU A 62 39.155 39.908 17.315 1.00 42.54 H new ATOM 958 N GLY A 63 35.113 40.286 13.124 1.00 33.25 N ATOM 959 CA GLY A 63 34.070 40.066 12.140 1.00 23.24 C ATOM 960 C GLY A 63 32.949 41.089 12.266 1.00 73.40 C ATOM 961 O GLY A 63 32.790 41.751 13.291 1.00 61.41 O ATOM 0 H GLY A 63 35.450 41.249 13.143 1.00 33.25 H new ATOM 0 HA2 GLY A 63 34.498 40.117 11.139 1.00 23.24 H new ATOM 0 HA3 GLY A 63 33.662 39.063 12.261 1.00 23.24 H new ATOM 1314 N LYS A 87 0.288 -0.561 1.552 1.00 42.43 N ATOM 1315 CA LYS A 87 -0.091 -1.926 1.226 1.00 74.12 C ATOM 1316 C LYS A 87 -1.229 -2.426 2.116 1.00 0.41 C ATOM 1317 O LYS A 87 -1.972 -3.314 1.709 1.00 44.21 O ATOM 1318 CB LYS A 87 1.143 -2.832 1.313 1.00 43.02 C ATOM 1319 CG LYS A 87 2.081 -2.644 0.112 1.00 40.43 C ATOM 1320 CD LYS A 87 1.565 -3.395 -1.126 1.00 51.31 C ATOM 1321 CE LYS A 87 2.329 -2.975 -2.388 1.00 11.45 C ATOM 1322 NZ LYS A 87 1.657 -3.456 -3.609 1.00 12.34 N ATOM 0 HA LYS A 87 -0.471 -1.951 0.205 1.00 74.12 H new ATOM 0 HB2 LYS A 87 1.686 -2.618 2.234 1.00 43.02 H new ATOM 0 HB3 LYS A 87 0.825 -3.873 1.365 1.00 43.02 H new ATOM 0 HG2 LYS A 87 2.173 -1.582 -0.117 1.00 40.43 H new ATOM 0 HG3 LYS A 87 3.078 -3.003 0.368 1.00 40.43 H new ATOM 0 HD2 LYS A 87 1.672 -4.469 -0.974 1.00 51.31 H new ATOM 0 HD3 LYS A 87 0.502 -3.196 -1.258 1.00 51.31 H new ATOM 0 HE2 LYS A 87 2.412 -1.889 -2.420 1.00 11.45 H new ATOM 0 HE3 LYS A 87 3.344 -3.371 -2.349 1.00 11.45 H new ATOM 0 HZ1 LYS A 87 2.292 -3.337 -4.424 1.00 12.34 H new ATOM 0 HZ2 LYS A 87 1.418 -4.462 -3.500 1.00 12.34 H new ATOM 0 HZ3 LYS A 87 0.787 -2.908 -3.765 1.00 12.34 H new ATOM 1336 N VAL A 88 -1.381 -1.837 3.307 1.00 52.24 N ATOM 1337 CA VAL A 88 -2.488 -2.091 4.212 1.00 34.41 C ATOM 1338 C VAL A 88 -3.814 -1.825 3.489 1.00 62.34 C ATOM 1339 O VAL A 88 -4.674 -2.701 3.456 1.00 0.12 O ATOM 1340 CB VAL A 88 -2.329 -1.215 5.465 1.00 61.53 C ATOM 1341 CG1 VAL A 88 -3.456 -1.461 6.473 1.00 73.52 C ATOM 1342 CG2 VAL A 88 -0.980 -1.463 6.160 1.00 11.13 C ATOM 0 H VAL A 88 -0.716 -1.154 3.670 1.00 52.24 H new ATOM 0 HA VAL A 88 -2.489 -3.134 4.529 1.00 34.41 H new ATOM 0 HB VAL A 88 -2.373 -0.181 5.123 1.00 61.53 H new ATOM 0 HG11 VAL A 88 -3.309 -0.824 7.345 1.00 73.52 H new ATOM 0 HG12 VAL A 88 -4.415 -1.228 6.011 1.00 73.52 H new ATOM 0 HG13 VAL A 88 -3.446 -2.506 6.781 1.00 73.52 H new ATOM 0 HG21 VAL A 88 -0.902 -0.827 7.042 1.00 11.13 H new ATOM 0 HG22 VAL A 88 -0.912 -2.509 6.460 1.00 11.13 H new ATOM 0 HG23 VAL A 88 -0.168 -1.230 5.472 1.00 11.13 H new ATOM 1352 N VAL A 89 -3.966 -0.637 2.883 1.00 12.23 N ATOM 1353 CA VAL A 89 -5.143 -0.274 2.099 1.00 44.44 C ATOM 1354 C VAL A 89 -5.332 -1.246 0.927 1.00 62.24 C ATOM 1355 O VAL A 89 -6.458 -1.652 0.637 1.00 4.52 O ATOM 1356 CB VAL A 89 -5.048 1.190 1.625 1.00 74.14 C ATOM 1357 CG1 VAL A 89 -6.219 1.558 0.702 1.00 25.11 C ATOM 1358 CG2 VAL A 89 -5.057 2.154 2.819 1.00 72.30 C ATOM 0 H VAL A 89 -3.264 0.102 2.928 1.00 12.23 H new ATOM 0 HA VAL A 89 -6.026 -0.354 2.733 1.00 44.44 H new ATOM 0 HB VAL A 89 -4.110 1.282 1.077 1.00 74.14 H new ATOM 0 HG11 VAL A 89 -6.121 2.597 0.386 1.00 25.11 H new ATOM 0 HG12 VAL A 89 -6.209 0.910 -0.174 1.00 25.11 H new ATOM 0 HG13 VAL A 89 -7.159 1.429 1.238 1.00 25.11 H new ATOM 0 HG21 VAL A 89 -4.989 3.180 2.458 1.00 72.30 H new ATOM 0 HG22 VAL A 89 -5.982 2.028 3.382 1.00 72.30 H new ATOM 0 HG23 VAL A 89 -4.206 1.940 3.466 1.00 72.30 H new ATOM 1368 N GLU A 90 -4.232 -1.633 0.266 1.00 22.21 N ATOM 1369 CA GLU A 90 -4.264 -2.562 -0.857 1.00 2.31 C ATOM 1370 C GLU A 90 -4.785 -3.951 -0.465 1.00 62.12 C ATOM 1371 O GLU A 90 -5.198 -4.691 -1.353 1.00 22.31 O ATOM 1372 CB GLU A 90 -2.888 -2.657 -1.529 1.00 64.44 C ATOM 1373 CG GLU A 90 -2.441 -1.309 -2.111 1.00 73.22 C ATOM 1374 CD GLU A 90 -1.030 -1.384 -2.687 1.00 41.24 C ATOM 1375 OE1 GLU A 90 -0.843 -2.165 -3.646 1.00 4.23 O ATOM 1376 OE2 GLU A 90 -0.149 -0.680 -2.148 1.00 2.34 O ATOM 0 H GLU A 90 -3.295 -1.306 0.501 1.00 22.21 H new ATOM 0 HA GLU A 90 -4.974 -2.157 -1.578 1.00 2.31 H new ATOM 0 HB2 GLU A 90 -2.152 -3.001 -0.802 1.00 64.44 H new ATOM 0 HB3 GLU A 90 -2.923 -3.402 -2.324 1.00 64.44 H new ATOM 0 HG2 GLU A 90 -3.137 -1.001 -2.891 1.00 73.22 H new ATOM 0 HG3 GLU A 90 -2.477 -0.547 -1.333 1.00 73.22 H new ATOM 1383 N LYS A 91 -4.811 -4.315 0.829 1.00 41.34 N ATOM 1384 CA LYS A 91 -5.434 -5.562 1.261 1.00 13.20 C ATOM 1385 C LYS A 91 -6.928 -5.513 0.946 1.00 22.30 C ATOM 1386 O LYS A 91 -7.382 -6.262 0.087 1.00 62.33 O ATOM 1387 CB LYS A 91 -5.161 -5.856 2.745 1.00 1.23 C ATOM 1388 CG LYS A 91 -3.669 -5.983 3.085 1.00 14.50 C ATOM 1389 CD LYS A 91 -2.968 -7.022 2.201 1.00 72.24 C ATOM 1390 CE LYS A 91 -1.547 -7.323 2.677 1.00 41.42 C ATOM 1391 NZ LYS A 91 -0.947 -8.400 1.868 1.00 64.21 N ATOM 0 H LYS A 91 -4.408 -3.761 1.585 1.00 41.34 H new ATOM 0 HA LYS A 91 -4.989 -6.390 0.709 1.00 13.20 H new ATOM 0 HB2 LYS A 91 -5.596 -5.060 3.350 1.00 1.23 H new ATOM 0 HB3 LYS A 91 -5.668 -6.780 3.022 1.00 1.23 H new ATOM 0 HG2 LYS A 91 -3.185 -5.014 2.961 1.00 14.50 H new ATOM 0 HG3 LYS A 91 -3.558 -6.263 4.133 1.00 14.50 H new ATOM 0 HD2 LYS A 91 -3.550 -7.944 2.196 1.00 72.24 H new ATOM 0 HD3 LYS A 91 -2.936 -6.659 1.174 1.00 72.24 H new ATOM 0 HE2 LYS A 91 -0.936 -6.423 2.606 1.00 41.42 H new ATOM 0 HE3 LYS A 91 -1.563 -7.615 3.727 1.00 41.42 H new ATOM 0 HZ1 LYS A 91 -0.064 -8.720 2.315 1.00 64.21 H new ATOM 0 HZ2 LYS A 91 -1.611 -9.198 1.804 1.00 64.21 H new ATOM 0 HZ3 LYS A 91 -0.742 -8.043 0.913 1.00 64.21 H new ATOM 1405 N ILE A 92 -7.674 -4.605 1.591 1.00 60.23 N ATOM 1406 CA ILE A 92 -9.073 -4.326 1.279 1.00 20.44 C ATOM 1407 C ILE A 92 -9.293 -4.226 -0.236 1.00 21.55 C ATOM 1408 O ILE A 92 -10.181 -4.889 -0.769 1.00 55.55 O ATOM 1409 CB ILE A 92 -9.546 -3.038 1.982 1.00 3.34 C ATOM 1410 CG1 ILE A 92 -9.233 -3.045 3.487 1.00 24.22 C ATOM 1411 CG2 ILE A 92 -11.063 -2.867 1.796 1.00 12.54 C ATOM 1412 CD1 ILE A 92 -8.038 -2.147 3.825 1.00 53.21 C ATOM 0 H ILE A 92 -7.311 -4.037 2.356 1.00 60.23 H new ATOM 0 HA ILE A 92 -9.669 -5.159 1.652 1.00 20.44 H new ATOM 0 HB ILE A 92 -9.005 -2.210 1.525 1.00 3.34 H new ATOM 0 HG12 ILE A 92 -10.109 -2.708 4.042 1.00 24.22 H new ATOM 0 HG13 ILE A 92 -9.024 -4.065 3.810 1.00 24.22 H new ATOM 0 HG21 ILE A 92 -11.390 -1.955 2.295 1.00 12.54 H new ATOM 0 HG22 ILE A 92 -11.294 -2.802 0.733 1.00 12.54 H new ATOM 0 HG23 ILE A 92 -11.581 -3.723 2.228 1.00 12.54 H new ATOM 0 HD11 ILE A 92 -7.850 -2.180 4.898 1.00 53.21 H new ATOM 0 HD12 ILE A 92 -7.156 -2.499 3.291 1.00 53.21 H new ATOM 0 HD13 ILE A 92 -8.257 -1.122 3.527 1.00 53.21 H new ATOM 1424 N GLY A 93 -8.475 -3.410 -0.918 1.00 42.40 N ATOM 1425 CA GLY A 93 -8.539 -3.212 -2.359 1.00 43.12 C ATOM 1426 C GLY A 93 -8.562 -4.539 -3.117 1.00 34.11 C ATOM 1427 O GLY A 93 -9.540 -4.841 -3.797 1.00 62.21 O ATOM 0 H GLY A 93 -7.741 -2.863 -0.468 1.00 42.40 H new ATOM 0 HA2 GLY A 93 -9.431 -2.637 -2.607 1.00 43.12 H new ATOM 0 HA3 GLY A 93 -7.680 -2.624 -2.683 1.00 43.12 H new ATOM 1431 N ASP A 94 -7.494 -5.333 -2.986 1.00 34.24 N ATOM 1432 CA ASP A 94 -7.348 -6.606 -3.673 1.00 50.15 C ATOM 1433 C ASP A 94 -8.462 -7.576 -3.296 1.00 4.11 C ATOM 1434 O ASP A 94 -9.009 -8.237 -4.170 1.00 20.11 O ATOM 1435 CB ASP A 94 -5.981 -7.229 -3.374 1.00 62.31 C ATOM 1436 CG ASP A 94 -4.808 -6.409 -3.911 1.00 62.11 C ATOM 1437 OD1 ASP A 94 -5.030 -5.632 -4.865 1.00 3.15 O ATOM 1438 OD2 ASP A 94 -3.696 -6.594 -3.369 1.00 2.21 O ATOM 0 H ASP A 94 -6.700 -5.100 -2.390 1.00 34.24 H new ATOM 0 HA ASP A 94 -7.420 -6.410 -4.743 1.00 50.15 H new ATOM 0 HB2 ASP A 94 -5.871 -7.344 -2.296 1.00 62.31 H new ATOM 0 HB3 ASP A 94 -5.944 -8.229 -3.806 1.00 62.31 H new ATOM 1443 N TYR A 95 -8.802 -7.674 -2.008 1.00 13.00 N ATOM 1444 CA TYR A 95 -9.818 -8.593 -1.519 1.00 63.13 C ATOM 1445 C TYR A 95 -11.183 -8.315 -2.165 1.00 64.25 C ATOM 1446 O TYR A 95 -11.931 -9.254 -2.429 1.00 12.12 O ATOM 1447 CB TYR A 95 -9.874 -8.527 0.015 1.00 14.22 C ATOM 1448 CG TYR A 95 -8.590 -8.844 0.778 1.00 1.51 C ATOM 1449 CD1 TYR A 95 -7.442 -9.360 0.140 1.00 31.10 C ATOM 1450 CD2 TYR A 95 -8.533 -8.570 2.157 1.00 52.12 C ATOM 1451 CE1 TYR A 95 -6.284 -9.643 0.883 1.00 14.34 C ATOM 1452 CE2 TYR A 95 -7.414 -8.953 2.913 1.00 40.11 C ATOM 1453 CZ TYR A 95 -6.287 -9.494 2.277 1.00 75.54 C ATOM 1454 OH TYR A 95 -5.199 -9.869 3.008 1.00 14.35 O ATOM 0 H TYR A 95 -8.373 -7.111 -1.274 1.00 13.00 H new ATOM 0 HA TYR A 95 -9.548 -9.609 -1.806 1.00 63.13 H new ATOM 0 HB2 TYR A 95 -10.195 -7.525 0.298 1.00 14.22 H new ATOM 0 HB3 TYR A 95 -10.647 -9.217 0.354 1.00 14.22 H new ATOM 0 HD1 TYR A 95 -7.454 -9.538 -0.925 1.00 31.10 H new ATOM 0 HD2 TYR A 95 -9.356 -8.061 2.637 1.00 52.12 H new ATOM 0 HE1 TYR A 95 -5.389 -9.976 0.379 1.00 14.34 H new ATOM 0 HE2 TYR A 95 -7.421 -8.831 3.986 1.00 40.11 H new ATOM 0 HH TYR A 95 -5.485 -10.441 3.751 1.00 14.35 H new ATOM 1464 N LYS A 96 -11.492 -7.042 -2.453 1.00 61.30 N ATOM 1465 CA LYS A 96 -12.703 -6.643 -3.165 1.00 35.31 C ATOM 1466 C LYS A 96 -12.566 -6.845 -4.677 1.00 63.33 C ATOM 1467 O LYS A 96 -13.522 -7.292 -5.308 1.00 43.12 O ATOM 1468 CB LYS A 96 -13.082 -5.198 -2.806 1.00 22.31 C ATOM 1469 CG LYS A 96 -14.058 -5.132 -1.619 1.00 25.33 C ATOM 1470 CD LYS A 96 -13.551 -5.867 -0.368 1.00 11.11 C ATOM 1471 CE LYS A 96 -14.513 -5.749 0.820 1.00 14.50 C ATOM 1472 NZ LYS A 96 -15.869 -6.227 0.490 1.00 23.13 N ATOM 0 H LYS A 96 -10.897 -6.255 -2.192 1.00 61.30 H new ATOM 0 HA LYS A 96 -13.517 -7.292 -2.843 1.00 35.31 H new ATOM 0 HB2 LYS A 96 -12.179 -4.637 -2.564 1.00 22.31 H new ATOM 0 HB3 LYS A 96 -13.534 -4.716 -3.673 1.00 22.31 H new ATOM 0 HG2 LYS A 96 -14.242 -4.087 -1.368 1.00 25.33 H new ATOM 0 HG3 LYS A 96 -15.014 -5.561 -1.920 1.00 25.33 H new ATOM 0 HD2 LYS A 96 -13.402 -6.920 -0.606 1.00 11.11 H new ATOM 0 HD3 LYS A 96 -12.579 -5.464 -0.084 1.00 11.11 H new ATOM 0 HE2 LYS A 96 -14.122 -6.323 1.660 1.00 14.50 H new ATOM 0 HE3 LYS A 96 -14.565 -4.709 1.141 1.00 14.50 H new ATOM 0 HZ1 LYS A 96 -16.447 -6.256 1.354 1.00 23.13 H new ATOM 0 HZ2 LYS A 96 -16.307 -5.581 -0.198 1.00 23.13 H new ATOM 0 HZ3 LYS A 96 -15.811 -7.181 0.081 1.00 23.13 H new ATOM 1486 N ARG A 97 -11.399 -6.551 -5.270 1.00 63.30 N ATOM 1487 CA ARG A 97 -11.131 -6.873 -6.672 1.00 51.24 C ATOM 1488 C ARG A 97 -11.356 -8.368 -6.935 1.00 34.23 C ATOM 1489 O ARG A 97 -11.957 -8.732 -7.944 1.00 34.40 O ATOM 1490 CB ARG A 97 -9.701 -6.474 -7.063 1.00 61.03 C ATOM 1491 CG ARG A 97 -9.524 -4.952 -7.157 1.00 2.24 C ATOM 1492 CD ARG A 97 -8.049 -4.556 -7.300 1.00 54.43 C ATOM 1493 NE ARG A 97 -7.431 -5.197 -8.472 1.00 72.13 N ATOM 1494 CZ ARG A 97 -6.475 -6.144 -8.473 1.00 63.32 C ATOM 1495 NH1 ARG A 97 -5.846 -6.536 -7.355 1.00 14.24 N ATOM 1496 NH2 ARG A 97 -6.139 -6.718 -9.637 1.00 23.45 N ATOM 0 H ARG A 97 -10.625 -6.088 -4.794 1.00 63.30 H new ATOM 0 HA ARG A 97 -11.826 -6.302 -7.287 1.00 51.24 H new ATOM 0 HB2 ARG A 97 -9.001 -6.874 -6.329 1.00 61.03 H new ATOM 0 HB3 ARG A 97 -9.450 -6.926 -8.022 1.00 61.03 H new ATOM 0 HG2 ARG A 97 -10.086 -4.573 -8.011 1.00 2.24 H new ATOM 0 HG3 ARG A 97 -9.941 -4.482 -6.266 1.00 2.24 H new ATOM 0 HD2 ARG A 97 -7.969 -3.473 -7.392 1.00 54.43 H new ATOM 0 HD3 ARG A 97 -7.505 -4.841 -6.399 1.00 54.43 H new ATOM 0 HE ARG A 97 -7.765 -4.889 -9.385 1.00 72.13 H new ATOM 0 HH11 ARG A 97 -6.087 -6.112 -6.459 1.00 14.24 H new ATOM 0 HH12 ARG A 97 -5.127 -7.258 -7.401 1.00 14.24 H new ATOM 0 HH21 ARG A 97 -6.605 -6.435 -10.499 1.00 23.45 H new ATOM 0 HH22 ARG A 97 -5.417 -7.438 -9.661 1.00 23.45 H new ATOM 1510 N GLN A 98 -10.888 -9.225 -6.018 1.00 20.40 N ATOM 1511 CA GLN A 98 -11.074 -10.664 -6.065 1.00 40.32 C ATOM 1512 C GLN A 98 -12.558 -10.994 -5.883 1.00 62.43 C ATOM 1513 O GLN A 98 -13.185 -11.532 -6.793 1.00 4.34 O ATOM 1514 CB GLN A 98 -10.223 -11.346 -4.979 1.00 44.23 C ATOM 1515 CG GLN A 98 -8.718 -11.302 -5.280 1.00 73.34 C ATOM 1516 CD GLN A 98 -8.307 -12.176 -6.464 1.00 74.13 C ATOM 1517 OE1 GLN A 98 -8.978 -13.149 -6.799 1.00 73.32 O ATOM 1518 NE2 GLN A 98 -7.187 -11.830 -7.102 1.00 41.22 N ATOM 0 H GLN A 98 -10.356 -8.918 -5.204 1.00 20.40 H new ATOM 0 HA GLN A 98 -10.748 -11.040 -7.035 1.00 40.32 H new ATOM 0 HB2 GLN A 98 -10.411 -10.861 -4.021 1.00 44.23 H new ATOM 0 HB3 GLN A 98 -10.537 -12.385 -4.878 1.00 44.23 H new ATOM 0 HG2 GLN A 98 -8.426 -10.271 -5.481 1.00 73.34 H new ATOM 0 HG3 GLN A 98 -8.169 -11.622 -4.394 1.00 73.34 H new ATOM 0 HE21 GLN A 98 -6.656 -11.015 -6.795 1.00 41.22 H new ATOM 0 HE22 GLN A 98 -6.862 -12.380 -7.897 1.00 41.22 H new ATOM 1527 N ASN A 99 -13.102 -10.682 -4.700 1.00 13.31 N ATOM 1528 CA ASN A 99 -14.433 -11.065 -4.268 1.00 22.52 C ATOM 1529 C ASN A 99 -15.255 -9.803 -3.976 1.00 22.30 C ATOM 1530 O ASN A 99 -15.360 -9.403 -2.817 1.00 63.25 O ATOM 1531 CB ASN A 99 -14.283 -11.927 -3.008 1.00 63.24 C ATOM 1532 CG ASN A 99 -13.568 -13.259 -3.235 1.00 41.43 C ATOM 1533 OD1 ASN A 99 -13.313 -13.667 -4.366 1.00 4.42 O ATOM 1534 ND2 ASN A 99 -13.247 -13.952 -2.142 1.00 41.23 N ATOM 0 H ASN A 99 -12.601 -10.136 -3.999 1.00 13.31 H new ATOM 0 HA ASN A 99 -14.952 -11.633 -5.041 1.00 22.52 H new ATOM 0 HB2 ASN A 99 -13.735 -11.358 -2.257 1.00 63.24 H new ATOM 0 HB3 ASN A 99 -15.273 -12.125 -2.598 1.00 63.24 H new ATOM 0 HD21 ASN A 99 -12.774 -14.852 -2.229 1.00 41.23 H new ATOM 0 HD22 ASN A 99 -13.474 -13.582 -1.219 1.00 41.23 H new ATOM 1541 N PRO A 100 -15.851 -9.160 -4.996 1.00 24.53 N ATOM 1542 CA PRO A 100 -16.629 -7.941 -4.815 1.00 43.34 C ATOM 1543 C PRO A 100 -17.955 -8.218 -4.097 1.00 1.02 C ATOM 1544 O PRO A 100 -18.421 -7.379 -3.329 1.00 22.35 O ATOM 1545 CB PRO A 100 -16.839 -7.379 -6.223 1.00 10.21 C ATOM 1546 CG PRO A 100 -16.808 -8.623 -7.108 1.00 22.44 C ATOM 1547 CD PRO A 100 -15.779 -9.511 -6.408 1.00 40.23 C ATOM 0 HA PRO A 100 -16.112 -7.223 -4.179 1.00 43.34 H new ATOM 0 HB2 PRO A 100 -17.788 -6.850 -6.307 1.00 10.21 H new ATOM 0 HB3 PRO A 100 -16.055 -6.673 -6.495 1.00 10.21 H new ATOM 0 HG2 PRO A 100 -17.785 -9.103 -7.165 1.00 22.44 H new ATOM 0 HG3 PRO A 100 -16.510 -8.386 -8.129 1.00 22.44 H new ATOM 0 HD2 PRO A 100 -16.004 -10.566 -6.561 1.00 40.23 H new ATOM 0 HD3 PRO A 100 -14.778 -9.338 -6.804 1.00 40.23 H new ATOM 1555 N THR A 101 -18.551 -9.392 -4.338 1.00 71.42 N ATOM 1556 CA THR A 101 -19.786 -9.834 -3.705 1.00 35.33 C ATOM 1557 C THR A 101 -19.616 -9.978 -2.189 1.00 55.24 C ATOM 1558 O THR A 101 -20.520 -9.620 -1.435 1.00 42.24 O ATOM 1559 CB THR A 101 -20.237 -11.156 -4.343 1.00 25.32 C ATOM 1560 OG1 THR A 101 -19.178 -12.093 -4.311 1.00 11.11 O ATOM 1561 CG2 THR A 101 -20.675 -10.946 -5.797 1.00 1.24 C ATOM 0 H THR A 101 -18.173 -10.073 -4.996 1.00 71.42 H new ATOM 0 HA THR A 101 -20.556 -9.080 -3.866 1.00 35.33 H new ATOM 0 HB THR A 101 -21.085 -11.532 -3.771 1.00 25.32 H new ATOM 0 HG1 THR A 101 -19.473 -12.934 -4.718 1.00 11.11 H new ATOM 0 HG21 THR A 101 -20.989 -11.899 -6.224 1.00 1.24 H new ATOM 0 HG22 THR A 101 -21.507 -10.242 -5.828 1.00 1.24 H new ATOM 0 HG23 THR A 101 -19.841 -10.547 -6.374 1.00 1.24 H new ATOM 1569 N MET A 102 -18.462 -10.492 -1.742 1.00 1.43 N ATOM 1570 CA MET A 102 -18.165 -10.672 -0.328 1.00 33.21 C ATOM 1571 C MET A 102 -18.000 -9.335 0.383 1.00 62.04 C ATOM 1572 O MET A 102 -17.731 -8.304 -0.233 1.00 11.14 O ATOM 1573 CB MET A 102 -16.894 -11.502 -0.152 1.00 11.21 C ATOM 1574 CG MET A 102 -17.129 -12.981 -0.440 1.00 61.21 C ATOM 1575 SD MET A 102 -18.103 -13.901 0.781 1.00 43.21 S ATOM 1576 CE MET A 102 -16.925 -13.926 2.157 1.00 34.34 C ATOM 0 H MET A 102 -17.709 -10.794 -2.360 1.00 1.43 H new ATOM 0 HA MET A 102 -19.009 -11.198 0.118 1.00 33.21 H new ATOM 0 HB2 MET A 102 -16.119 -11.122 -0.818 1.00 11.21 H new ATOM 0 HB3 MET A 102 -16.524 -11.386 0.867 1.00 11.21 H new ATOM 0 HG2 MET A 102 -17.627 -13.065 -1.406 1.00 61.21 H new ATOM 0 HG3 MET A 102 -16.158 -13.467 -0.538 1.00 61.21 H new ATOM 0 HE1 MET A 102 -17.363 -14.458 3.002 1.00 34.34 H new ATOM 0 HE2 MET A 102 -16.011 -14.432 1.845 1.00 34.34 H new ATOM 0 HE3 MET A 102 -16.691 -12.904 2.454 1.00 34.34 H new ATOM 1586 N PHE A 103 -18.174 -9.391 1.705 1.00 32.04 N ATOM 1587 CA PHE A 103 -18.356 -8.230 2.566 1.00 64.21 C ATOM 1588 C PHE A 103 -17.186 -8.056 3.534 1.00 12.43 C ATOM 1589 O PHE A 103 -16.488 -9.013 3.862 1.00 75.45 O ATOM 1590 CB PHE A 103 -19.690 -8.355 3.318 1.00 23.30 C ATOM 1591 CG PHE A 103 -20.459 -7.051 3.389 1.00 70.21 C ATOM 1592 CD1 PHE A 103 -20.193 -6.116 4.408 1.00 1.33 C ATOM 1593 CD2 PHE A 103 -21.379 -6.731 2.373 1.00 63.43 C ATOM 1594 CE1 PHE A 103 -20.881 -4.891 4.436 1.00 42.34 C ATOM 1595 CE2 PHE A 103 -22.057 -5.501 2.395 1.00 2.54 C ATOM 1596 CZ PHE A 103 -21.815 -4.584 3.432 1.00 40.32 C ATOM 0 H PHE A 103 -18.192 -10.273 2.217 1.00 32.04 H new ATOM 0 HA PHE A 103 -18.382 -7.335 1.944 1.00 64.21 H new ATOM 0 HB2 PHE A 103 -20.307 -9.107 2.827 1.00 23.30 H new ATOM 0 HB3 PHE A 103 -19.497 -8.711 4.330 1.00 23.30 H new ATOM 0 HD1 PHE A 103 -19.460 -6.341 5.168 1.00 1.33 H new ATOM 0 HD2 PHE A 103 -21.564 -7.433 1.574 1.00 63.43 H new ATOM 0 HE1 PHE A 103 -20.692 -4.184 5.230 1.00 42.34 H new ATOM 0 HE2 PHE A 103 -22.764 -5.260 1.615 1.00 2.54 H new ATOM 0 HZ PHE A 103 -22.346 -3.644 3.457 1.00 40.32 H new ATOM 1606 N ALA A 104 -16.984 -6.814 3.990 1.00 13.53 N ATOM 1607 CA ALA A 104 -15.922 -6.418 4.906 1.00 35.43 C ATOM 1608 C ALA A 104 -15.907 -7.265 6.181 1.00 71.21 C ATOM 1609 O ALA A 104 -14.838 -7.662 6.642 1.00 0.14 O ATOM 1610 CB ALA A 104 -16.094 -4.939 5.252 1.00 22.10 C ATOM 0 H ALA A 104 -17.581 -6.033 3.718 1.00 13.53 H new ATOM 0 HA ALA A 104 -14.965 -6.582 4.410 1.00 35.43 H new ATOM 0 HB1 ALA A 104 -15.304 -4.631 5.937 1.00 22.10 H new ATOM 0 HB2 ALA A 104 -16.036 -4.343 4.341 1.00 22.10 H new ATOM 0 HB3 ALA A 104 -17.064 -4.786 5.725 1.00 22.10 H new ATOM 1616 N TRP A 105 -17.093 -7.536 6.741 1.00 32.20 N ATOM 1617 CA TRP A 105 -17.276 -8.329 7.949 1.00 41.11 C ATOM 1618 C TRP A 105 -16.585 -9.690 7.832 1.00 2.42 C ATOM 1619 O TRP A 105 -15.905 -10.123 8.759 1.00 53.45 O ATOM 1620 CB TRP A 105 -18.773 -8.526 8.219 1.00 62.41 C ATOM 1621 CG TRP A 105 -19.632 -7.298 8.206 1.00 73.41 C ATOM 1622 CD1 TRP A 105 -19.363 -6.138 8.844 1.00 14.31 C ATOM 1623 CD2 TRP A 105 -20.914 -7.091 7.534 1.00 72.20 C ATOM 1624 NE1 TRP A 105 -20.380 -5.231 8.625 1.00 65.23 N ATOM 1625 CE2 TRP A 105 -21.363 -5.769 7.820 1.00 32.15 C ATOM 1626 CE3 TRP A 105 -21.738 -7.884 6.706 1.00 40.34 C ATOM 1627 CZ2 TRP A 105 -22.570 -5.261 7.315 1.00 30.12 C ATOM 1628 CZ3 TRP A 105 -22.942 -7.378 6.180 1.00 0.44 C ATOM 1629 CH2 TRP A 105 -23.358 -6.070 6.482 1.00 54.14 C ATOM 0 H TRP A 105 -17.972 -7.197 6.350 1.00 32.20 H new ATOM 0 HA TRP A 105 -16.822 -7.790 8.780 1.00 41.11 H new ATOM 0 HB2 TRP A 105 -19.163 -9.221 7.475 1.00 62.41 H new ATOM 0 HB3 TRP A 105 -18.882 -9.006 9.192 1.00 62.41 H new ATOM 0 HD1 TRP A 105 -18.481 -5.948 9.438 1.00 14.31 H new ATOM 0 HE1 TRP A 105 -20.402 -4.286 9.008 1.00 65.23 H new ATOM 0 HE3 TRP A 105 -21.440 -8.895 6.472 1.00 40.34 H new ATOM 0 HZ2 TRP A 105 -22.888 -4.260 7.564 1.00 30.12 H new ATOM 0 HZ3 TRP A 105 -23.550 -8.000 5.540 1.00 0.44 H new ATOM 0 HH2 TRP A 105 -24.282 -5.688 6.074 1.00 54.14 H new ATOM 1640 N GLU A 106 -16.762 -10.352 6.684 1.00 70.14 N ATOM 1641 CA GLU A 106 -16.200 -11.655 6.385 1.00 71.11 C ATOM 1642 C GLU A 106 -14.701 -11.508 6.126 1.00 72.45 C ATOM 1643 O GLU A 106 -13.887 -12.254 6.666 1.00 2.20 O ATOM 1644 CB GLU A 106 -16.909 -12.193 5.136 1.00 3.41 C ATOM 1645 CG GLU A 106 -18.428 -12.315 5.346 1.00 64.20 C ATOM 1646 CD GLU A 106 -19.169 -12.524 4.030 1.00 32.42 C ATOM 1647 OE1 GLU A 106 -19.124 -11.587 3.202 1.00 73.34 O ATOM 1648 OE2 GLU A 106 -19.768 -13.609 3.874 1.00 34.04 O ATOM 0 H GLU A 106 -17.320 -9.975 5.918 1.00 70.14 H new ATOM 0 HA GLU A 106 -16.340 -12.344 7.218 1.00 71.11 H new ATOM 0 HB2 GLU A 106 -16.711 -11.531 4.293 1.00 3.41 H new ATOM 0 HB3 GLU A 106 -16.499 -13.169 4.878 1.00 3.41 H new ATOM 0 HG2 GLU A 106 -18.636 -13.149 6.016 1.00 64.20 H new ATOM 0 HG3 GLU A 106 -18.801 -11.414 5.833 1.00 64.20 H new ATOM 1655 N ILE A 107 -14.355 -10.528 5.285 1.00 65.05 N ATOM 1656 CA ILE A 107 -13.011 -10.267 4.794 1.00 5.12 C ATOM 1657 C ILE A 107 -12.062 -9.769 5.896 1.00 32.33 C ATOM 1658 O ILE A 107 -10.846 -9.825 5.708 1.00 60.03 O ATOM 1659 CB ILE A 107 -13.141 -9.347 3.567 1.00 42.30 C ATOM 1660 CG1 ILE A 107 -13.696 -10.203 2.411 1.00 74.34 C ATOM 1661 CG2 ILE A 107 -11.816 -8.703 3.154 1.00 21.43 C ATOM 1662 CD1 ILE A 107 -14.271 -9.361 1.277 1.00 72.52 C ATOM 0 H ILE A 107 -15.040 -9.869 4.915 1.00 65.05 H new ATOM 0 HA ILE A 107 -12.525 -11.189 4.474 1.00 5.12 H new ATOM 0 HB ILE A 107 -13.807 -8.521 3.818 1.00 42.30 H new ATOM 0 HG12 ILE A 107 -12.900 -10.837 2.020 1.00 74.34 H new ATOM 0 HG13 ILE A 107 -14.472 -10.866 2.795 1.00 74.34 H new ATOM 0 HG21 ILE A 107 -11.976 -8.067 2.283 1.00 21.43 H new ATOM 0 HG22 ILE A 107 -11.432 -8.101 3.977 1.00 21.43 H new ATOM 0 HG23 ILE A 107 -11.095 -9.482 2.906 1.00 21.43 H new ATOM 0 HD11 ILE A 107 -14.647 -10.017 0.491 1.00 72.52 H new ATOM 0 HD12 ILE A 107 -15.087 -8.746 1.658 1.00 72.52 H new ATOM 0 HD13 ILE A 107 -13.491 -8.717 0.870 1.00 72.52 H new ATOM 1674 N ARG A 108 -12.594 -9.397 7.070 1.00 61.03 N ATOM 1675 CA ARG A 108 -11.855 -9.365 8.330 1.00 24.21 C ATOM 1676 C ARG A 108 -10.902 -10.560 8.415 1.00 21.13 C ATOM 1677 O ARG A 108 -9.713 -10.400 8.675 1.00 22.22 O ATOM 1678 CB ARG A 108 -12.858 -9.431 9.493 1.00 4.33 C ATOM 1679 CG ARG A 108 -12.177 -9.401 10.868 1.00 64.01 C ATOM 1680 CD ARG A 108 -13.178 -9.772 11.967 1.00 62.25 C ATOM 1681 NE ARG A 108 -12.550 -9.724 13.294 1.00 30.34 N ATOM 1682 CZ ARG A 108 -11.753 -10.672 13.819 1.00 62.24 C ATOM 1683 NH1 ARG A 108 -11.521 -11.826 13.175 1.00 5.02 N ATOM 1684 NH2 ARG A 108 -11.173 -10.449 15.007 1.00 63.41 N ATOM 0 H ARG A 108 -13.567 -9.106 7.166 1.00 61.03 H new ATOM 0 HA ARG A 108 -11.272 -8.445 8.385 1.00 24.21 H new ATOM 0 HB2 ARG A 108 -13.551 -8.593 9.417 1.00 4.33 H new ATOM 0 HB3 ARG A 108 -13.450 -10.342 9.405 1.00 4.33 H new ATOM 0 HG2 ARG A 108 -11.338 -10.097 10.881 1.00 64.01 H new ATOM 0 HG3 ARG A 108 -11.770 -8.408 11.058 1.00 64.01 H new ATOM 0 HD2 ARG A 108 -14.025 -9.087 11.937 1.00 62.25 H new ATOM 0 HD3 ARG A 108 -13.570 -10.772 11.783 1.00 62.25 H new ATOM 0 HE ARG A 108 -12.734 -8.901 13.867 1.00 30.34 H new ATOM 0 HH11 ARG A 108 -11.953 -11.999 12.267 1.00 5.02 H new ATOM 0 HH12 ARG A 108 -10.913 -12.530 13.593 1.00 5.02 H new ATOM 0 HH21 ARG A 108 -11.339 -9.571 15.499 1.00 63.41 H new ATOM 0 HH22 ARG A 108 -10.566 -11.157 15.419 1.00 63.41 H new ATOM 1698 N ASP A 109 -11.444 -11.760 8.191 1.00 55.54 N ATOM 1699 CA ASP A 109 -10.737 -13.013 8.379 1.00 53.41 C ATOM 1700 C ASP A 109 -9.797 -13.339 7.212 1.00 1.25 C ATOM 1701 O ASP A 109 -8.945 -14.213 7.359 1.00 10.10 O ATOM 1702 CB ASP A 109 -11.748 -14.131 8.646 1.00 2.41 C ATOM 1703 CG ASP A 109 -12.674 -13.824 9.828 1.00 11.21 C ATOM 1704 OD1 ASP A 109 -12.224 -13.116 10.759 1.00 75.12 O ATOM 1705 OD2 ASP A 109 -13.825 -14.306 9.781 1.00 44.34 O ATOM 0 H ASP A 109 -12.404 -11.882 7.868 1.00 55.54 H new ATOM 0 HA ASP A 109 -10.087 -12.917 9.249 1.00 53.41 H new ATOM 0 HB2 ASP A 109 -12.349 -14.292 7.751 1.00 2.41 H new ATOM 0 HB3 ASP A 109 -11.212 -15.060 8.842 1.00 2.41 H new ATOM 1710 N ARG A 110 -9.903 -12.640 6.070 1.00 5.12 N ATOM 1711 CA ARG A 110 -8.957 -12.809 4.971 1.00 71.44 C ATOM 1712 C ARG A 110 -7.600 -12.186 5.310 1.00 41.54 C ATOM 1713 O ARG A 110 -6.570 -12.687 4.858 1.00 34.10 O ATOM 1714 CB ARG A 110 -9.536 -12.306 3.643 1.00 4.33 C ATOM 1715 CG ARG A 110 -8.550 -12.599 2.502 1.00 51.03 C ATOM 1716 CD ARG A 110 -9.234 -12.681 1.131 1.00 3.23 C ATOM 1717 NE ARG A 110 -8.337 -12.378 0.001 1.00 72.10 N ATOM 1718 CZ ARG A 110 -7.052 -12.744 -0.179 1.00 11.54 C ATOM 1719 NH1 ARG A 110 -6.436 -13.638 0.605 1.00 10.14 N ATOM 1720 NH2 ARG A 110 -6.352 -12.185 -1.173 1.00 31.32 N ATOM 0 H ARG A 110 -10.636 -11.954 5.890 1.00 5.12 H new ATOM 0 HA ARG A 110 -8.782 -13.876 4.835 1.00 71.44 H new ATOM 0 HB2 ARG A 110 -10.491 -12.792 3.445 1.00 4.33 H new ATOM 0 HB3 ARG A 110 -9.730 -11.235 3.703 1.00 4.33 H new ATOM 0 HG2 ARG A 110 -7.789 -11.819 2.477 1.00 51.03 H new ATOM 0 HG3 ARG A 110 -8.037 -13.539 2.704 1.00 51.03 H new ATOM 0 HD2 ARG A 110 -9.644 -13.682 0.999 1.00 3.23 H new ATOM 0 HD3 ARG A 110 -10.074 -11.987 1.112 1.00 3.23 H new ATOM 0 HE ARG A 110 -8.744 -11.815 -0.746 1.00 72.10 H new ATOM 0 HH11 ARG A 110 -6.941 -14.073 1.377 1.00 10.14 H new ATOM 0 HH12 ARG A 110 -5.462 -13.884 0.430 1.00 10.14 H new ATOM 0 HH21 ARG A 110 -6.792 -11.493 -1.780 1.00 31.32 H new ATOM 0 HH22 ARG A 110 -5.379 -12.450 -1.323 1.00 31.32 H new ATOM 1734 N LEU A 111 -7.584 -11.135 6.143 1.00 54.14 N ATOM 1735 CA LEU A 111 -6.351 -10.602 6.711 1.00 11.13 C ATOM 1736 C LEU A 111 -5.616 -11.703 7.482 1.00 54.02 C ATOM 1737 O LEU A 111 -4.405 -11.862 7.333 1.00 71.13 O ATOM 1738 CB LEU A 111 -6.649 -9.403 7.622 1.00 33.31 C ATOM 1739 CG LEU A 111 -7.227 -8.205 6.851 1.00 20.54 C ATOM 1740 CD1 LEU A 111 -7.987 -7.259 7.786 1.00 61.33 C ATOM 1741 CD2 LEU A 111 -6.119 -7.414 6.140 1.00 72.11 C ATOM 0 H LEU A 111 -8.424 -10.637 6.437 1.00 54.14 H new ATOM 0 HA LEU A 111 -5.710 -10.255 5.901 1.00 11.13 H new ATOM 0 HB2 LEU A 111 -7.353 -9.706 8.397 1.00 33.31 H new ATOM 0 HB3 LEU A 111 -5.732 -9.098 8.126 1.00 33.31 H new ATOM 0 HG LEU A 111 -7.915 -8.609 6.108 1.00 20.54 H new ATOM 0 HD11 LEU A 111 -8.384 -6.422 7.212 1.00 61.33 H new ATOM 0 HD12 LEU A 111 -8.809 -7.797 8.259 1.00 61.33 H new ATOM 0 HD13 LEU A 111 -7.310 -6.884 8.553 1.00 61.33 H new ATOM 0 HD21 LEU A 111 -6.559 -6.573 5.604 1.00 72.11 H new ATOM 0 HD22 LEU A 111 -5.407 -7.042 6.877 1.00 72.11 H new ATOM 0 HD23 LEU A 111 -5.603 -8.065 5.434 1.00 72.11 H new ATOM 1753 N LEU A 112 -6.355 -12.482 8.282 1.00 30.00 N ATOM 1754 CA LEU A 112 -5.808 -13.587 9.057 1.00 45.21 C ATOM 1755 C LEU A 112 -5.317 -14.699 8.129 1.00 41.11 C ATOM 1756 O LEU A 112 -4.178 -15.147 8.252 1.00 44.35 O ATOM 1757 CB LEU A 112 -6.852 -14.140 10.042 1.00 4.13 C ATOM 1758 CG LEU A 112 -7.544 -13.082 10.915 1.00 65.53 C ATOM 1759 CD1 LEU A 112 -8.481 -13.783 11.905 1.00 32.02 C ATOM 1760 CD2 LEU A 112 -6.529 -12.233 11.680 1.00 21.14 C ATOM 0 H LEU A 112 -7.360 -12.356 8.406 1.00 30.00 H new ATOM 0 HA LEU A 112 -4.963 -13.209 9.632 1.00 45.21 H new ATOM 0 HB2 LEU A 112 -7.613 -14.678 9.477 1.00 4.13 H new ATOM 0 HB3 LEU A 112 -6.366 -14.866 10.694 1.00 4.13 H new ATOM 0 HG LEU A 112 -8.111 -12.417 10.264 1.00 65.53 H new ATOM 0 HD11 LEU A 112 -8.976 -13.038 12.528 1.00 32.02 H new ATOM 0 HD12 LEU A 112 -9.231 -14.352 11.356 1.00 32.02 H new ATOM 0 HD13 LEU A 112 -7.904 -14.458 12.536 1.00 32.02 H new ATOM 0 HD21 LEU A 112 -7.055 -11.496 12.287 1.00 21.14 H new ATOM 0 HD22 LEU A 112 -5.931 -12.875 12.327 1.00 21.14 H new ATOM 0 HD23 LEU A 112 -5.876 -11.722 10.973 1.00 21.14 H new ATOM 1772 N ALA A 113 -6.184 -15.143 7.212 1.00 73.21 N ATOM 1773 CA ALA A 113 -5.939 -16.272 6.326 1.00 75.52 C ATOM 1774 C ALA A 113 -4.702 -16.057 5.454 1.00 31.22 C ATOM 1775 O ALA A 113 -3.897 -16.973 5.295 1.00 1.04 O ATOM 1776 CB ALA A 113 -7.174 -16.521 5.457 1.00 60.54 C ATOM 0 H ALA A 113 -7.097 -14.712 7.067 1.00 73.21 H new ATOM 0 HA ALA A 113 -5.746 -17.150 6.943 1.00 75.52 H new ATOM 0 HB1 ALA A 113 -6.988 -17.366 4.795 1.00 60.54 H new ATOM 0 HB2 ALA A 113 -8.030 -16.741 6.095 1.00 60.54 H new ATOM 0 HB3 ALA A 113 -7.385 -15.633 4.861 1.00 60.54 H new ATOM 1782 N GLU A 114 -4.549 -14.850 4.893 1.00 55.22 N ATOM 1783 CA GLU A 114 -3.405 -14.497 4.067 1.00 52.55 C ATOM 1784 C GLU A 114 -2.126 -14.379 4.909 1.00 53.13 C ATOM 1785 O GLU A 114 -1.031 -14.581 4.387 1.00 65.30 O ATOM 1786 CB GLU A 114 -3.736 -13.214 3.297 1.00 2.53 C ATOM 1787 CG GLU A 114 -2.641 -12.854 2.288 1.00 53.12 C ATOM 1788 CD GLU A 114 -3.104 -11.764 1.328 1.00 43.34 C ATOM 1789 OE1 GLU A 114 -3.913 -12.107 0.437 1.00 32.30 O ATOM 1790 OE2 GLU A 114 -2.637 -10.615 1.498 1.00 51.13 O ATOM 0 H GLU A 114 -5.223 -14.093 5.005 1.00 55.22 H new ATOM 0 HA GLU A 114 -3.205 -15.288 3.344 1.00 52.55 H new ATOM 0 HB2 GLU A 114 -4.684 -13.339 2.774 1.00 2.53 H new ATOM 0 HB3 GLU A 114 -3.866 -12.392 4.001 1.00 2.53 H new ATOM 0 HG2 GLU A 114 -1.751 -12.518 2.820 1.00 53.12 H new ATOM 0 HG3 GLU A 114 -2.359 -13.742 1.723 1.00 53.12 H new ATOM 1797 N GLY A 115 -2.259 -14.076 6.208 1.00 24.34 N ATOM 1798 CA GLY A 115 -1.143 -13.980 7.136 1.00 12.32 C ATOM 1799 C GLY A 115 -0.606 -12.552 7.190 1.00 54.03 C ATOM 1800 O GLY A 115 0.602 -12.340 7.101 1.00 13.23 O ATOM 0 H GLY A 115 -3.163 -13.889 6.642 1.00 24.34 H new ATOM 0 HA2 GLY A 115 -1.463 -14.291 8.130 1.00 12.32 H new ATOM 0 HA3 GLY A 115 -0.349 -14.661 6.829 1.00 12.32 H new ATOM 1804 N VAL A 116 -1.513 -11.581 7.346 1.00 51.34 N ATOM 1805 CA VAL A 116 -1.195 -10.166 7.475 1.00 24.33 C ATOM 1806 C VAL A 116 -1.034 -9.811 8.956 1.00 22.31 C ATOM 1807 O VAL A 116 -0.147 -9.038 9.313 1.00 54.31 O ATOM 1808 CB VAL A 116 -2.295 -9.322 6.803 1.00 11.41 C ATOM 1809 CG1 VAL A 116 -1.941 -7.829 6.834 1.00 23.21 C ATOM 1810 CG2 VAL A 116 -2.488 -9.762 5.345 1.00 20.44 C ATOM 0 H VAL A 116 -2.515 -11.770 7.386 1.00 51.34 H new ATOM 0 HA VAL A 116 -0.253 -9.947 6.971 1.00 24.33 H new ATOM 0 HB VAL A 116 -3.219 -9.478 7.360 1.00 11.41 H new ATOM 0 HG11 VAL A 116 -2.734 -7.257 6.353 1.00 23.21 H new ATOM 0 HG12 VAL A 116 -1.833 -7.502 7.868 1.00 23.21 H new ATOM 0 HG13 VAL A 116 -1.003 -7.666 6.303 1.00 23.21 H new ATOM 0 HG21 VAL A 116 -3.268 -9.157 4.883 1.00 20.44 H new ATOM 0 HG22 VAL A 116 -1.554 -9.630 4.798 1.00 20.44 H new ATOM 0 HG23 VAL A 116 -2.779 -10.812 5.317 1.00 20.44 H new ATOM 1820 N CYS A 117 -1.905 -10.365 9.807 1.00 64.11 N ATOM 1821 CA CYS A 117 -1.985 -10.052 11.228 1.00 61.50 C ATOM 1822 C CYS A 117 -2.722 -11.174 11.965 1.00 72.11 C ATOM 1823 O CYS A 117 -3.317 -12.044 11.331 1.00 63.14 O ATOM 1824 CB CYS A 117 -2.694 -8.703 11.403 1.00 24.42 C ATOM 1825 SG CYS A 117 -4.306 -8.754 10.577 1.00 51.51 S ATOM 0 H CYS A 117 -2.590 -11.061 9.513 1.00 64.11 H new ATOM 0 HA CYS A 117 -0.985 -9.975 11.655 1.00 61.50 H new ATOM 0 HB2 CYS A 117 -2.824 -8.483 12.463 1.00 24.42 H new ATOM 0 HB3 CYS A 117 -2.084 -7.903 10.984 1.00 24.42 H new ATOM 0 HG CYS A 117 -4.717 -7.541 10.353 1.00 51.51 H new ATOM 1831 N ASP A 118 -2.678 -11.146 13.303 1.00 30.21 N ATOM 1832 CA ASP A 118 -3.268 -12.159 14.173 1.00 30.21 C ATOM 1833 C ASP A 118 -4.720 -11.817 14.522 1.00 3.11 C ATOM 1834 O ASP A 118 -5.193 -10.711 14.259 1.00 44.53 O ATOM 1835 CB ASP A 118 -2.422 -12.323 15.445 1.00 63.44 C ATOM 1836 CG ASP A 118 -0.957 -12.593 15.118 1.00 11.15 C ATOM 1837 OD1 ASP A 118 -0.626 -13.784 14.930 1.00 1.22 O ATOM 1838 OD2 ASP A 118 -0.196 -11.602 15.050 1.00 54.21 O ATOM 0 H ASP A 118 -2.218 -10.396 13.819 1.00 30.21 H new ATOM 0 HA ASP A 118 -3.276 -13.107 13.635 1.00 30.21 H new ATOM 0 HB2 ASP A 118 -2.499 -11.421 16.052 1.00 63.44 H new ATOM 0 HB3 ASP A 118 -2.819 -13.144 16.042 1.00 63.44 H new ATOM 1843 N ASN A 119 -5.423 -12.797 15.104 1.00 40.51 N ATOM 1844 CA ASN A 119 -6.861 -12.782 15.359 1.00 51.21 C ATOM 1845 C ASN A 119 -7.334 -11.592 16.199 1.00 23.34 C ATOM 1846 O ASN A 119 -8.467 -11.145 16.021 1.00 12.05 O ATOM 1847 CB ASN A 119 -7.291 -14.113 15.990 1.00 31.12 C ATOM 1848 CG ASN A 119 -6.638 -14.344 17.351 1.00 20.33 C ATOM 1849 OD1 ASN A 119 -5.511 -14.828 17.422 1.00 5.43 O ATOM 1850 ND2 ASN A 119 -7.337 -13.991 18.431 1.00 14.14 N ATOM 0 H ASN A 119 -4.981 -13.659 15.423 1.00 40.51 H new ATOM 0 HA ASN A 119 -7.348 -12.658 14.392 1.00 51.21 H new ATOM 0 HB2 ASN A 119 -8.375 -14.126 16.102 1.00 31.12 H new ATOM 0 HB3 ASN A 119 -7.030 -14.932 15.320 1.00 31.12 H new ATOM 0 HD21 ASN A 119 -6.938 -14.120 19.361 1.00 14.14 H new ATOM 0 HD22 ASN A 119 -8.270 -13.592 18.327 1.00 14.14 H new ATOM 1857 N ASP A 120 -6.484 -11.096 17.107 1.00 31.31 N ATOM 1858 CA ASP A 120 -6.783 -9.967 17.979 1.00 43.35 C ATOM 1859 C ASP A 120 -6.250 -8.669 17.373 1.00 64.24 C ATOM 1860 O ASP A 120 -6.923 -7.642 17.414 1.00 63.51 O ATOM 1861 CB ASP A 120 -6.166 -10.206 19.362 1.00 33.43 C ATOM 1862 CG ASP A 120 -6.808 -11.387 20.086 1.00 11.10 C ATOM 1863 OD1 ASP A 120 -8.049 -11.365 20.230 1.00 54.31 O ATOM 1864 OD2 ASP A 120 -6.047 -12.297 20.482 1.00 3.10 O ATOM 0 H ASP A 120 -5.551 -11.481 17.254 1.00 31.31 H new ATOM 0 HA ASP A 120 -7.864 -9.875 18.084 1.00 43.35 H new ATOM 0 HB2 ASP A 120 -5.096 -10.387 19.254 1.00 33.43 H new ATOM 0 HB3 ASP A 120 -6.278 -9.307 19.968 1.00 33.43 H new ATOM 1869 N THR A 121 -5.028 -8.717 16.827 1.00 54.30 N ATOM 1870 CA THR A 121 -4.312 -7.553 16.323 1.00 42.24 C ATOM 1871 C THR A 121 -4.951 -6.967 15.058 1.00 10.35 C ATOM 1872 O THR A 121 -4.708 -5.802 14.746 1.00 33.30 O ATOM 1873 CB THR A 121 -2.845 -7.929 16.073 1.00 53.42 C ATOM 1874 OG1 THR A 121 -2.766 -8.979 15.136 1.00 53.14 O ATOM 1875 CG2 THR A 121 -2.160 -8.381 17.366 1.00 33.35 C ATOM 0 H THR A 121 -4.505 -9.587 16.724 1.00 54.30 H new ATOM 0 HA THR A 121 -4.368 -6.771 17.081 1.00 42.24 H new ATOM 0 HB THR A 121 -2.340 -7.042 15.691 1.00 53.42 H new ATOM 0 HG1 THR A 121 -3.667 -9.307 14.935 1.00 53.14 H new ATOM 0 HG21 THR A 121 -1.122 -8.641 17.156 1.00 33.35 H new ATOM 0 HG22 THR A 121 -2.191 -7.572 18.096 1.00 33.35 H new ATOM 0 HG23 THR A 121 -2.678 -9.252 17.767 1.00 33.35 H new ATOM 1883 N VAL A 122 -5.744 -7.769 14.332 1.00 62.55 N ATOM 1884 CA VAL A 122 -6.470 -7.358 13.136 1.00 12.24 C ATOM 1885 C VAL A 122 -7.195 -6.023 13.360 1.00 3.25 C ATOM 1886 O VAL A 122 -7.861 -5.861 14.383 1.00 32.21 O ATOM 1887 CB VAL A 122 -7.418 -8.493 12.701 1.00 24.02 C ATOM 1888 CG1 VAL A 122 -8.515 -8.786 13.731 1.00 24.53 C ATOM 1889 CG2 VAL A 122 -8.068 -8.249 11.334 1.00 51.44 C ATOM 0 H VAL A 122 -5.898 -8.748 14.573 1.00 62.55 H new ATOM 0 HA VAL A 122 -5.768 -7.181 12.321 1.00 12.24 H new ATOM 0 HB VAL A 122 -6.769 -9.365 12.624 1.00 24.02 H new ATOM 0 HG11 VAL A 122 -9.149 -9.594 13.367 1.00 24.53 H new ATOM 0 HG12 VAL A 122 -8.058 -9.081 14.676 1.00 24.53 H new ATOM 0 HG13 VAL A 122 -9.119 -7.891 13.884 1.00 24.53 H new ATOM 0 HG21 VAL A 122 -8.723 -9.085 11.088 1.00 51.44 H new ATOM 0 HG22 VAL A 122 -8.651 -7.329 11.368 1.00 51.44 H new ATOM 0 HG23 VAL A 122 -7.293 -8.159 10.573 1.00 51.44 H new ATOM 1899 N PRO A 123 -7.042 -5.044 12.450 1.00 41.24 N ATOM 1900 CA PRO A 123 -7.561 -3.699 12.639 1.00 13.54 C ATOM 1901 C PRO A 123 -9.091 -3.665 12.588 1.00 4.41 C ATOM 1902 O PRO A 123 -9.740 -4.656 12.255 1.00 51.11 O ATOM 1903 CB PRO A 123 -6.928 -2.854 11.527 1.00 63.32 C ATOM 1904 CG PRO A 123 -6.674 -3.873 10.419 1.00 12.00 C ATOM 1905 CD PRO A 123 -6.285 -5.119 11.210 1.00 54.44 C ATOM 0 HA PRO A 123 -7.307 -3.309 13.624 1.00 13.54 H new ATOM 0 HB2 PRO A 123 -7.595 -2.058 11.197 1.00 63.32 H new ATOM 0 HB3 PRO A 123 -6.004 -2.380 11.858 1.00 63.32 H new ATOM 0 HG2 PRO A 123 -7.561 -4.039 9.808 1.00 12.00 H new ATOM 0 HG3 PRO A 123 -5.878 -3.553 9.746 1.00 12.00 H new ATOM 0 HD2 PRO A 123 -6.527 -6.026 10.657 1.00 54.44 H new ATOM 0 HD3 PRO A 123 -5.213 -5.141 11.405 1.00 54.44 H new ATOM 1913 N SER A 124 -9.650 -2.500 12.940 1.00 42.43 N ATOM 1914 CA SER A 124 -11.078 -2.235 13.031 1.00 10.13 C ATOM 1915 C SER A 124 -11.839 -2.739 11.803 1.00 42.34 C ATOM 1916 O SER A 124 -11.538 -2.339 10.678 1.00 22.51 O ATOM 1917 CB SER A 124 -11.291 -0.727 13.190 1.00 43.32 C ATOM 1918 OG SER A 124 -10.878 -0.299 14.471 1.00 22.22 O ATOM 0 H SER A 124 -9.087 -1.684 13.179 1.00 42.43 H new ATOM 0 HA SER A 124 -11.469 -2.772 13.895 1.00 10.13 H new ATOM 0 HB2 SER A 124 -10.730 -0.192 12.424 1.00 43.32 H new ATOM 0 HB3 SER A 124 -12.343 -0.485 13.042 1.00 43.32 H new ATOM 0 HG SER A 124 -11.020 0.667 14.555 1.00 22.22 H new ATOM 1924 N VAL A 125 -12.859 -3.575 12.036 1.00 1.32 N ATOM 1925 CA VAL A 125 -13.786 -4.044 11.013 1.00 61.31 C ATOM 1926 C VAL A 125 -14.469 -2.840 10.353 1.00 64.34 C ATOM 1927 O VAL A 125 -14.610 -2.779 9.134 1.00 15.43 O ATOM 1928 CB VAL A 125 -14.816 -5.004 11.635 1.00 43.05 C ATOM 1929 CG1 VAL A 125 -15.739 -5.581 10.553 1.00 43.21 C ATOM 1930 CG2 VAL A 125 -14.123 -6.168 12.356 1.00 12.51 C ATOM 0 H VAL A 125 -13.062 -3.949 12.963 1.00 1.32 H new ATOM 0 HA VAL A 125 -13.242 -4.593 10.245 1.00 61.31 H new ATOM 0 HB VAL A 125 -15.400 -4.430 12.354 1.00 43.05 H new ATOM 0 HG11 VAL A 125 -16.460 -6.257 11.012 1.00 43.21 H new ATOM 0 HG12 VAL A 125 -16.269 -4.769 10.056 1.00 43.21 H new ATOM 0 HG13 VAL A 125 -15.144 -6.128 9.821 1.00 43.21 H new ATOM 0 HG21 VAL A 125 -14.875 -6.830 12.785 1.00 12.51 H new ATOM 0 HG22 VAL A 125 -13.513 -6.725 11.645 1.00 12.51 H new ATOM 0 HG23 VAL A 125 -13.488 -5.777 13.151 1.00 12.51 H new ATOM 1940 N SER A 126 -14.859 -1.860 11.175 1.00 11.43 N ATOM 1941 CA SER A 126 -15.413 -0.595 10.729 1.00 65.55 C ATOM 1942 C SER A 126 -14.484 0.133 9.751 1.00 61.53 C ATOM 1943 O SER A 126 -14.981 0.805 8.851 1.00 3.33 O ATOM 1944 CB SER A 126 -15.703 0.284 11.949 1.00 42.41 C ATOM 1945 OG SER A 126 -16.537 -0.411 12.853 1.00 11.30 O ATOM 0 H SER A 126 -14.793 -1.934 12.190 1.00 11.43 H new ATOM 0 HA SER A 126 -16.338 -0.800 10.189 1.00 65.55 H new ATOM 0 HB2 SER A 126 -14.770 0.560 12.440 1.00 42.41 H new ATOM 0 HB3 SER A 126 -16.184 1.210 11.635 1.00 42.41 H new ATOM 0 HG SER A 126 -16.718 0.155 13.632 1.00 11.30 H new ATOM 1951 N SER A 127 -13.155 0.015 9.916 1.00 24.21 N ATOM 1952 CA SER A 127 -12.206 0.749 9.089 1.00 20.03 C ATOM 1953 C SER A 127 -12.164 0.152 7.685 1.00 32.13 C ATOM 1954 O SER A 127 -12.320 0.882 6.710 1.00 11.22 O ATOM 1955 CB SER A 127 -10.814 0.797 9.724 1.00 71.41 C ATOM 1956 OG SER A 127 -9.964 1.628 8.960 1.00 31.34 O ATOM 0 H SER A 127 -12.722 -0.585 10.618 1.00 24.21 H new ATOM 0 HA SER A 127 -12.547 1.781 9.014 1.00 20.03 H new ATOM 0 HB2 SER A 127 -10.883 1.173 10.745 1.00 71.41 H new ATOM 0 HB3 SER A 127 -10.397 -0.208 9.783 1.00 71.41 H new ATOM 0 HG SER A 127 -9.076 1.655 9.373 1.00 31.34 H new ATOM 1962 N ILE A 128 -11.980 -1.171 7.585 1.00 60.35 N ATOM 1963 CA ILE A 128 -12.007 -1.879 6.308 1.00 23.24 C ATOM 1964 C ILE A 128 -13.355 -1.715 5.592 1.00 21.11 C ATOM 1965 O ILE A 128 -13.390 -1.638 4.365 1.00 11.03 O ATOM 1966 CB ILE A 128 -11.590 -3.355 6.460 1.00 34.20 C ATOM 1967 CG1 ILE A 128 -12.428 -4.107 7.503 1.00 64.44 C ATOM 1968 CG2 ILE A 128 -10.096 -3.467 6.799 1.00 0.12 C ATOM 1969 CD1 ILE A 128 -12.100 -5.598 7.575 1.00 44.30 C ATOM 0 H ILE A 128 -11.809 -1.776 8.388 1.00 60.35 H new ATOM 0 HA ILE A 128 -11.259 -1.414 5.665 1.00 23.24 H new ATOM 0 HB ILE A 128 -11.778 -3.829 5.497 1.00 34.20 H new ATOM 0 HG12 ILE A 128 -12.266 -3.658 8.483 1.00 64.44 H new ATOM 0 HG13 ILE A 128 -13.485 -3.985 7.267 1.00 64.44 H new ATOM 0 HG21 ILE A 128 -9.824 -4.518 6.902 1.00 0.12 H new ATOM 0 HG22 ILE A 128 -9.507 -3.016 6.000 1.00 0.12 H new ATOM 0 HG23 ILE A 128 -9.896 -2.947 7.736 1.00 0.12 H new ATOM 0 HD11 ILE A 128 -12.726 -6.072 8.331 1.00 44.30 H new ATOM 0 HD12 ILE A 128 -12.289 -6.059 6.606 1.00 44.30 H new ATOM 0 HD13 ILE A 128 -11.051 -5.727 7.840 1.00 44.30 H new ATOM 1981 N ASN A 129 -14.457 -1.622 6.347 1.00 23.00 N ATOM 1982 CA ASN A 129 -15.775 -1.341 5.793 1.00 32.11 C ATOM 1983 C ASN A 129 -15.833 0.052 5.156 1.00 31.13 C ATOM 1984 O ASN A 129 -16.169 0.170 3.978 1.00 71.22 O ATOM 1985 CB ASN A 129 -16.851 -1.512 6.873 1.00 43.34 C ATOM 1986 CG ASN A 129 -18.242 -1.215 6.319 1.00 32.23 C ATOM 1987 OD1 ASN A 129 -18.761 -0.116 6.494 1.00 53.24 O ATOM 1988 ND2 ASN A 129 -18.850 -2.193 5.643 1.00 62.31 N ATOM 0 H ASN A 129 -14.453 -1.741 7.360 1.00 23.00 H new ATOM 0 HA ASN A 129 -15.972 -2.060 4.998 1.00 32.11 H new ATOM 0 HB2 ASN A 129 -16.821 -2.530 7.262 1.00 43.34 H new ATOM 0 HB3 ASN A 129 -16.640 -0.845 7.709 1.00 43.34 H new ATOM 0 HD21 ASN A 129 -19.779 -2.040 5.251 1.00 62.31 H new ATOM 0 HD22 ASN A 129 -18.385 -3.093 5.519 1.00 62.31 H new ATOM 1995 N ARG A 130 -15.526 1.107 5.923 1.00 21.22 N ATOM 1996 CA ARG A 130 -15.703 2.488 5.475 1.00 33.34 C ATOM 1997 C ARG A 130 -14.769 2.906 4.334 1.00 5.24 C ATOM 1998 O ARG A 130 -14.951 4.001 3.805 1.00 4.30 O ATOM 1999 CB ARG A 130 -15.670 3.479 6.656 1.00 42.21 C ATOM 2000 CG ARG A 130 -14.338 3.544 7.414 1.00 10.12 C ATOM 2001 CD ARG A 130 -13.265 4.458 6.814 1.00 24.41 C ATOM 2002 NE ARG A 130 -11.957 4.147 7.405 1.00 2.33 N ATOM 2003 CZ ARG A 130 -10.771 4.568 6.943 1.00 3.12 C ATOM 2004 NH1 ARG A 130 -10.699 5.466 5.950 1.00 64.12 N ATOM 2005 NH2 ARG A 130 -9.649 4.069 7.478 1.00 2.31 N ATOM 0 H ARG A 130 -15.150 1.024 6.867 1.00 21.22 H new ATOM 0 HA ARG A 130 -16.702 2.526 5.040 1.00 33.34 H new ATOM 0 HB2 ARG A 130 -15.906 4.475 6.281 1.00 42.21 H new ATOM 0 HB3 ARG A 130 -16.458 3.208 7.359 1.00 42.21 H new ATOM 0 HG2 ARG A 130 -14.539 3.874 8.433 1.00 10.12 H new ATOM 0 HG3 ARG A 130 -13.931 2.535 7.480 1.00 10.12 H new ATOM 0 HD2 ARG A 130 -13.226 4.326 5.733 1.00 24.41 H new ATOM 0 HD3 ARG A 130 -13.519 5.502 6.999 1.00 24.41 H new ATOM 0 HE ARG A 130 -11.950 3.560 8.239 1.00 2.33 H new ATOM 0 HH11 ARG A 130 -11.554 5.838 5.536 1.00 64.12 H new ATOM 0 HH12 ARG A 130 -9.790 5.777 5.609 1.00 64.12 H new ATOM 0 HH21 ARG A 130 -9.704 3.378 8.227 1.00 2.31 H new ATOM 0 HH22 ARG A 130 -8.739 4.380 7.137 1.00 2.31 H new ATOM 2019 N ILE A 131 -13.791 2.082 3.927 1.00 42.31 N ATOM 2020 CA ILE A 131 -12.969 2.375 2.753 1.00 11.31 C ATOM 2021 C ILE A 131 -13.890 2.597 1.547 1.00 52.12 C ATOM 2022 O ILE A 131 -13.847 3.646 0.910 1.00 12.25 O ATOM 2023 CB ILE A 131 -11.945 1.253 2.479 1.00 40.43 C ATOM 2024 CG1 ILE A 131 -11.103 0.874 3.707 1.00 34.44 C ATOM 2025 CG2 ILE A 131 -11.012 1.637 1.323 1.00 51.04 C ATOM 2026 CD1 ILE A 131 -10.454 2.047 4.448 1.00 11.32 C ATOM 0 H ILE A 131 -13.554 1.208 4.397 1.00 42.31 H new ATOM 0 HA ILE A 131 -12.392 3.280 2.940 1.00 11.31 H new ATOM 0 HB ILE A 131 -12.536 0.377 2.211 1.00 40.43 H new ATOM 0 HG12 ILE A 131 -11.737 0.331 4.407 1.00 34.44 H new ATOM 0 HG13 ILE A 131 -10.318 0.188 3.390 1.00 34.44 H new ATOM 0 HG21 ILE A 131 -10.299 0.831 1.148 1.00 51.04 H new ATOM 0 HG22 ILE A 131 -11.600 1.803 0.421 1.00 51.04 H new ATOM 0 HG23 ILE A 131 -10.473 2.549 1.578 1.00 51.04 H new ATOM 0 HD11 ILE A 131 -9.884 1.670 5.297 1.00 11.32 H new ATOM 0 HD12 ILE A 131 -9.787 2.581 3.771 1.00 11.32 H new ATOM 0 HD13 ILE A 131 -11.229 2.726 4.804 1.00 11.32 H new ATOM 2038 N ILE A 132 -14.759 1.617 1.288 1.00 52.43 N ATOM 2039 CA ILE A 132 -15.776 1.618 0.242 1.00 43.23 C ATOM 2040 C ILE A 132 -16.568 2.932 0.241 1.00 70.04 C ATOM 2041 O ILE A 132 -16.789 3.516 -0.818 1.00 24.32 O ATOM 2042 CB ILE A 132 -16.702 0.401 0.443 1.00 5.45 C ATOM 2043 CG1 ILE A 132 -15.922 -0.922 0.301 1.00 34.24 C ATOM 2044 CG2 ILE A 132 -17.864 0.421 -0.562 1.00 72.12 C ATOM 2045 CD1 ILE A 132 -16.603 -2.068 1.055 1.00 23.23 C ATOM 0 H ILE A 132 -14.770 0.756 1.834 1.00 52.43 H new ATOM 0 HA ILE A 132 -15.293 1.541 -0.732 1.00 43.23 H new ATOM 0 HB ILE A 132 -17.105 0.465 1.454 1.00 5.45 H new ATOM 0 HG12 ILE A 132 -15.836 -1.182 -0.754 1.00 34.24 H new ATOM 0 HG13 ILE A 132 -14.909 -0.789 0.680 1.00 34.24 H new ATOM 0 HG21 ILE A 132 -18.502 -0.448 -0.398 1.00 72.12 H new ATOM 0 HG22 ILE A 132 -18.448 1.331 -0.425 1.00 72.12 H new ATOM 0 HG23 ILE A 132 -17.468 0.394 -1.577 1.00 72.12 H new ATOM 0 HD11 ILE A 132 -16.022 -2.982 0.930 1.00 23.23 H new ATOM 0 HD12 ILE A 132 -16.665 -1.820 2.115 1.00 23.23 H new ATOM 0 HD13 ILE A 132 -17.607 -2.219 0.658 1.00 23.23 H new ATOM 2057 N ARG A 133 -17.001 3.392 1.421 1.00 34.44 N ATOM 2058 CA ARG A 133 -17.800 4.597 1.563 1.00 41.23 C ATOM 2059 C ARG A 133 -16.964 5.848 1.282 1.00 55.40 C ATOM 2060 O ARG A 133 -17.364 6.680 0.475 1.00 15.35 O ATOM 2061 CB ARG A 133 -18.446 4.635 2.955 1.00 63.41 C ATOM 2062 CG ARG A 133 -19.305 3.401 3.294 1.00 10.34 C ATOM 2063 CD ARG A 133 -20.666 3.349 2.582 1.00 60.02 C ATOM 2064 NE ARG A 133 -20.563 2.999 1.157 1.00 50.55 N ATOM 2065 CZ ARG A 133 -21.609 2.927 0.313 1.00 13.32 C ATOM 2066 NH1 ARG A 133 -22.861 3.109 0.756 1.00 72.31 N ATOM 2067 NH2 ARG A 133 -21.405 2.684 -0.988 1.00 73.13 N ATOM 0 H ARG A 133 -16.800 2.928 2.307 1.00 34.44 H new ATOM 0 HA ARG A 133 -18.600 4.582 0.822 1.00 41.23 H new ATOM 0 HB2 ARG A 133 -17.660 4.732 3.704 1.00 63.41 H new ATOM 0 HB3 ARG A 133 -19.068 5.527 3.029 1.00 63.41 H new ATOM 0 HG2 ARG A 133 -18.743 2.503 3.039 1.00 10.34 H new ATOM 0 HG3 ARG A 133 -19.473 3.377 4.371 1.00 10.34 H new ATOM 0 HD2 ARG A 133 -21.303 2.620 3.083 1.00 60.02 H new ATOM 0 HD3 ARG A 133 -21.155 4.318 2.677 1.00 60.02 H new ATOM 0 HE ARG A 133 -19.636 2.797 0.783 1.00 50.55 H new ATOM 0 HH11 ARG A 133 -23.029 3.305 1.743 1.00 72.31 H new ATOM 0 HH12 ARG A 133 -23.645 3.052 0.106 1.00 72.31 H new ATOM 0 HH21 ARG A 133 -20.457 2.553 -1.340 1.00 73.13 H new ATOM 0 HH22 ARG A 133 -22.198 2.630 -1.627 1.00 73.13 H new ATOM 2081 N THR A 134 -15.793 5.983 1.913 1.00 62.12 N ATOM 2082 CA THR A 134 -14.898 7.113 1.682 1.00 63.53 C ATOM 2083 C THR A 134 -14.507 7.248 0.203 1.00 72.13 C ATOM 2084 O THR A 134 -14.270 8.364 -0.255 1.00 52.23 O ATOM 2085 CB THR A 134 -13.672 7.047 2.606 1.00 32.31 C ATOM 2086 OG1 THR A 134 -13.008 5.808 2.491 1.00 74.52 O ATOM 2087 CG2 THR A 134 -14.064 7.279 4.069 1.00 74.52 C ATOM 0 H THR A 134 -15.443 5.311 2.596 1.00 62.12 H new ATOM 0 HA THR A 134 -15.445 8.021 1.935 1.00 63.53 H new ATOM 0 HB THR A 134 -12.995 7.841 2.290 1.00 32.31 H new ATOM 0 HG1 THR A 134 -13.470 5.249 1.831 1.00 74.52 H new ATOM 0 HG21 THR A 134 -13.175 7.226 4.697 1.00 74.52 H new ATOM 0 HG22 THR A 134 -14.522 8.263 4.171 1.00 74.52 H new ATOM 0 HG23 THR A 134 -14.774 6.514 4.381 1.00 74.52 H new