USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD NoAdj-H: A 15 TPO H : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 89 HIS : no HD1:sc= -0.948 X(o=0.26,f=0.5) USER MOD Set 1.2: A 110 THR OG1 : rot 74:sc= 1.21 USER MOD Set 2.1: A 106 SER OG : rot -15:sc= 1.69 USER MOD Set 2.2: A 118 ASN : amide:sc= 0.313 K(o=2,f=1.1) USER MOD Set 3.1: A 65 GLN : amide:sc= -0.381 K(o=0.0028,f=-0.83) USER MOD Set 3.2: A 68 THR OG1 : rot 110:sc= 0.384 USER MOD Single : A 1 MET CE :methyl -163:sc= -0.222 (180deg=-0.649) USER MOD Single : A 1 MET N :NH3+ -114:sc= 0.165 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc=-0.00113 X(o=-0.0011,f=0) USER MOD Single : A 5 ASN : amide:sc= 0.00654 K(o=0.0065,f=-3.9!) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl -164:sc= -0.0993 (180deg=-0.494) USER MOD Single : A 28 SER OG : rot 68:sc= 1.25 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 161:sc= 1.24 USER MOD Single : A 37 THR OG1 : rot -46:sc= 0.455 USER MOD Single : A 41 ASN : amide:sc= -0.688 K(o=-0.69,f=-3.4!) USER MOD Single : A 46 SER OG : rot -103:sc= 0.911 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= 0.0257 K(o=0.026,f=-7.1!) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.0424 USER MOD Single : A 69 THR OG1 : rot -62:sc= 1.36 USER MOD Single : A 73 HIS : no HE2:sc= -2.2! C(o=-2.2!,f=-6!) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 86 SER OG : rot 157:sc= 0.763 USER MOD Single : A 95 ASN : amide:sc= -0.32 X(o=-0.32,f=-0.0081) USER MOD Single : A 108 ASN : amide:sc= -0.523 K(o=-0.52,f=-8.2!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= 0.106 X(o=0.11,f=-0.25) USER MOD Single : A 120 GLN : amide:sc= -0.705 K(o=-0.7,f=-7.8!) USER MOD Single : A 122 MET CE :methyl 159:sc= -0.354 (180deg=-1.92) USER MOD Single : A 123 GLN : amide:sc= -2.04! C(o=-2!,f=-3.9!) USER MOD Single : A 124 THR OG1 : rot -170:sc= -0.0139 USER MOD Single : A 129 GLN : amide:sc= 2.8 K(o=2.8,f=-10!) USER MOD Single : A 132 LYS NZ :NH3+ 162:sc= -0.0349 (180deg=-0.311) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.834 -9.948 11.990 1.00 11.00 N ATOM 2 CA MET A 1 20.221 -9.855 13.314 1.00 43.05 C ATOM 3 C MET A 1 20.067 -8.407 13.695 1.00 65.21 C ATOM 4 O MET A 1 20.546 -7.503 12.986 1.00 33.42 O ATOM 5 CB MET A 1 21.088 -10.540 14.387 1.00 15.31 C ATOM 6 CG MET A 1 21.210 -12.046 14.274 1.00 4.33 C ATOM 7 SD MET A 1 22.130 -12.774 15.658 1.00 11.22 S ATOM 8 CE MET A 1 23.692 -11.893 15.547 1.00 70.45 C ATOM 0 H1 MET A 1 20.151 -10.355 11.319 1.00 11.00 H new ATOM 0 H2 MET A 1 21.111 -8.999 11.668 1.00 11.00 H new ATOM 0 H3 MET A 1 21.676 -10.557 12.039 1.00 11.00 H new ATOM 0 HA MET A 1 19.253 -10.354 13.265 1.00 43.05 H new ATOM 0 HB2 MET A 1 22.089 -10.109 14.348 1.00 15.31 H new ATOM 0 HB3 MET A 1 20.676 -10.300 15.367 1.00 15.31 H new ATOM 0 HG2 MET A 1 20.214 -12.486 14.233 1.00 4.33 H new ATOM 0 HG3 MET A 1 21.709 -12.298 13.338 1.00 4.33 H new ATOM 0 HE1 MET A 1 24.452 -12.426 16.118 1.00 70.45 H new ATOM 0 HE2 MET A 1 24.000 -11.829 14.503 1.00 70.45 H new ATOM 0 HE3 MET A 1 23.573 -10.888 15.952 1.00 70.45 H new ATOM 20 N SER A 2 19.402 -8.177 14.788 1.00 3.24 N ATOM 21 CA SER A 2 19.285 -6.873 15.344 1.00 53.21 C ATOM 22 C SER A 2 20.533 -6.671 16.206 1.00 61.41 C ATOM 23 O SER A 2 20.759 -7.419 17.159 1.00 41.42 O ATOM 24 CB SER A 2 18.012 -6.814 16.183 1.00 11.55 C ATOM 25 OG SER A 2 16.895 -7.287 15.429 1.00 54.21 O ATOM 0 H SER A 2 18.922 -8.902 15.321 1.00 3.24 H new ATOM 0 HA SER A 2 19.218 -6.091 14.587 1.00 53.21 H new ATOM 0 HB2 SER A 2 18.134 -7.418 17.082 1.00 11.55 H new ATOM 0 HB3 SER A 2 17.831 -5.790 16.509 1.00 11.55 H new ATOM 0 HG SER A 2 16.086 -7.245 15.981 1.00 54.21 H new ATOM 31 N ASP A 3 21.362 -5.731 15.839 1.00 14.31 N ATOM 32 CA ASP A 3 22.635 -5.542 16.507 1.00 64.10 C ATOM 33 C ASP A 3 22.555 -4.416 17.511 1.00 52.53 C ATOM 34 O ASP A 3 21.616 -3.606 17.487 1.00 55.44 O ATOM 35 CB ASP A 3 23.759 -5.284 15.488 1.00 65.01 C ATOM 36 CG ASP A 3 23.625 -3.966 14.747 1.00 53.42 C ATOM 37 OD1 ASP A 3 22.579 -3.723 14.121 1.00 14.04 O ATOM 38 OD2 ASP A 3 24.593 -3.178 14.732 1.00 12.23 O ATOM 0 H ASP A 3 21.183 -5.077 15.077 1.00 14.31 H new ATOM 0 HA ASP A 3 22.870 -6.460 17.045 1.00 64.10 H new ATOM 0 HB2 ASP A 3 24.718 -5.303 16.006 1.00 65.01 H new ATOM 0 HB3 ASP A 3 23.773 -6.098 14.763 1.00 65.01 H new ATOM 43 N ASN A 4 23.523 -4.376 18.399 1.00 15.51 N ATOM 44 CA ASN A 4 23.572 -3.385 19.460 1.00 11.02 C ATOM 45 C ASN A 4 23.687 -1.979 18.887 1.00 64.53 C ATOM 46 O ASN A 4 24.590 -1.686 18.089 1.00 3.14 O ATOM 47 CB ASN A 4 24.745 -3.675 20.411 1.00 32.20 C ATOM 48 CG ASN A 4 24.787 -2.747 21.610 1.00 33.11 C ATOM 49 OD1 ASN A 4 24.168 -3.023 22.638 1.00 73.33 O ATOM 50 ND2 ASN A 4 25.518 -1.657 21.510 1.00 51.01 N ATOM 0 H ASN A 4 24.304 -5.032 18.409 1.00 15.51 H new ATOM 0 HA ASN A 4 22.642 -3.446 20.025 1.00 11.02 H new ATOM 0 HB2 ASN A 4 24.675 -4.705 20.760 1.00 32.20 H new ATOM 0 HB3 ASN A 4 25.681 -3.588 19.860 1.00 32.20 H new ATOM 0 HD21 ASN A 4 25.583 -1.013 22.298 1.00 51.01 H new ATOM 0 HD22 ASN A 4 26.019 -1.457 20.644 1.00 51.01 H new ATOM 57 N ASN A 5 22.771 -1.131 19.266 1.00 70.50 N ATOM 58 CA ASN A 5 22.761 0.240 18.818 1.00 14.23 C ATOM 59 C ASN A 5 23.282 1.158 19.909 1.00 13.43 C ATOM 60 O ASN A 5 22.549 1.576 20.807 1.00 23.14 O ATOM 61 CB ASN A 5 21.366 0.707 18.300 1.00 31.03 C ATOM 62 CG ASN A 5 20.209 0.593 19.308 1.00 50.42 C ATOM 63 OD1 ASN A 5 20.149 -0.337 20.143 1.00 25.02 O ATOM 64 ND2 ASN A 5 19.306 1.540 19.267 1.00 32.11 N ATOM 0 H ASN A 5 22.006 -1.370 19.897 1.00 70.50 H new ATOM 0 HA ASN A 5 23.431 0.297 17.960 1.00 14.23 H new ATOM 0 HB2 ASN A 5 21.446 1.747 17.982 1.00 31.03 H new ATOM 0 HB3 ASN A 5 21.113 0.122 17.416 1.00 31.03 H new ATOM 0 HD21 ASN A 5 18.528 1.532 19.927 1.00 32.11 H new ATOM 0 HD22 ASN A 5 19.380 2.286 18.575 1.00 32.11 H new ATOM 71 N GLY A 6 24.570 1.394 19.879 1.00 43.01 N ATOM 72 CA GLY A 6 25.169 2.292 20.828 1.00 12.34 C ATOM 73 C GLY A 6 25.175 3.706 20.304 1.00 1.15 C ATOM 74 O GLY A 6 24.783 4.647 20.997 1.00 63.40 O ATOM 0 H GLY A 6 25.219 0.978 19.211 1.00 43.01 H new ATOM 0 HA2 GLY A 6 24.620 2.251 21.769 1.00 12.34 H new ATOM 0 HA3 GLY A 6 26.190 1.975 21.040 1.00 12.34 H new ATOM 78 N THR A 7 25.589 3.862 19.071 1.00 12.30 N ATOM 79 CA THR A 7 25.651 5.164 18.466 1.00 63.25 C ATOM 80 C THR A 7 24.496 5.356 17.465 1.00 52.11 C ATOM 81 O THR A 7 24.449 4.682 16.423 1.00 4.14 O ATOM 82 CB THR A 7 27.009 5.364 17.739 1.00 3.21 C ATOM 83 OG1 THR A 7 28.086 5.104 18.657 1.00 53.45 O ATOM 84 CG2 THR A 7 27.147 6.787 17.201 1.00 52.00 C ATOM 0 H THR A 7 25.889 3.097 18.466 1.00 12.30 H new ATOM 0 HA THR A 7 25.558 5.906 19.259 1.00 63.25 H new ATOM 0 HB THR A 7 27.048 4.671 16.899 1.00 3.21 H new ATOM 0 HG1 THR A 7 28.943 5.228 18.199 1.00 53.45 H new ATOM 0 HG21 THR A 7 28.108 6.894 16.698 1.00 52.00 H new ATOM 0 HG22 THR A 7 26.343 6.988 16.493 1.00 52.00 H new ATOM 0 HG23 THR A 7 27.089 7.496 18.027 1.00 52.00 H new ATOM 92 N PRO A 8 23.512 6.214 17.794 1.00 30.42 N ATOM 93 CA PRO A 8 22.483 6.581 16.848 1.00 21.43 C ATOM 94 C PRO A 8 23.102 7.513 15.821 1.00 2.21 C ATOM 95 O PRO A 8 23.938 8.365 16.172 1.00 44.32 O ATOM 96 CB PRO A 8 21.438 7.323 17.695 1.00 24.55 C ATOM 97 CG PRO A 8 22.179 7.818 18.891 1.00 72.02 C ATOM 98 CD PRO A 8 23.331 6.871 19.107 1.00 74.11 C ATOM 0 HA PRO A 8 22.043 5.737 16.317 1.00 21.43 H new ATOM 0 HB2 PRO A 8 20.994 8.148 17.138 1.00 24.55 H new ATOM 0 HB3 PRO A 8 20.623 6.659 17.984 1.00 24.55 H new ATOM 0 HG2 PRO A 8 22.538 8.835 18.731 1.00 72.02 H new ATOM 0 HG3 PRO A 8 21.529 7.844 19.766 1.00 72.02 H new ATOM 0 HD2 PRO A 8 24.232 7.403 19.414 1.00 74.11 H new ATOM 0 HD3 PRO A 8 23.108 6.145 19.888 1.00 74.11 H new ATOM 106 N GLU A 9 22.741 7.365 14.581 1.00 44.33 N ATOM 107 CA GLU A 9 23.351 8.166 13.555 1.00 11.02 C ATOM 108 C GLU A 9 22.733 9.547 13.544 1.00 31.32 C ATOM 109 O GLU A 9 21.506 9.682 13.434 1.00 4.42 O ATOM 110 CB GLU A 9 23.242 7.493 12.200 1.00 54.41 C ATOM 111 CG GLU A 9 23.901 6.132 12.164 1.00 61.43 C ATOM 112 CD GLU A 9 23.887 5.534 10.801 1.00 62.03 C ATOM 113 OE1 GLU A 9 24.778 5.874 9.992 1.00 53.23 O ATOM 114 OE2 GLU A 9 23.005 4.704 10.509 1.00 34.42 O ATOM 0 H GLU A 9 22.035 6.705 14.255 1.00 44.33 H new ATOM 0 HA GLU A 9 24.414 8.270 13.774 1.00 11.02 H new ATOM 0 HB2 GLU A 9 22.190 7.389 11.935 1.00 54.41 H new ATOM 0 HB3 GLU A 9 23.699 8.132 11.445 1.00 54.41 H new ATOM 0 HG2 GLU A 9 24.931 6.220 12.509 1.00 61.43 H new ATOM 0 HG3 GLU A 9 23.389 5.464 12.857 1.00 61.43 H new ATOM 121 N PRO A 10 23.562 10.585 13.701 1.00 24.44 N ATOM 122 CA PRO A 10 23.093 11.950 13.783 1.00 30.05 C ATOM 123 C PRO A 10 22.538 12.460 12.466 1.00 32.11 C ATOM 124 O PRO A 10 23.279 12.706 11.491 1.00 24.24 O ATOM 125 CB PRO A 10 24.324 12.742 14.202 1.00 24.25 C ATOM 126 CG PRO A 10 25.471 11.940 13.701 1.00 31.42 C ATOM 127 CD PRO A 10 25.037 10.507 13.801 1.00 42.21 C ATOM 0 HA PRO A 10 22.264 12.045 14.485 1.00 30.05 H new ATOM 0 HB2 PRO A 10 24.319 13.742 13.768 1.00 24.25 H new ATOM 0 HB3 PRO A 10 24.368 12.864 15.284 1.00 24.25 H new ATOM 0 HG2 PRO A 10 25.714 12.205 12.672 1.00 31.42 H new ATOM 0 HG3 PRO A 10 26.366 12.121 14.297 1.00 31.42 H new ATOM 0 HD2 PRO A 10 25.462 9.902 13.000 1.00 42.21 H new ATOM 0 HD3 PRO A 10 25.352 10.057 14.742 1.00 42.21 H new ATOM 135 N GLN A 11 21.255 12.560 12.421 1.00 54.24 N ATOM 136 CA GLN A 11 20.562 13.073 11.296 1.00 31.14 C ATOM 137 C GLN A 11 19.243 13.566 11.762 1.00 14.31 C ATOM 138 O GLN A 11 18.547 12.875 12.528 1.00 23.14 O ATOM 139 CB GLN A 11 20.347 12.002 10.211 1.00 4.32 C ATOM 140 CG GLN A 11 19.697 12.558 8.946 1.00 3.41 C ATOM 141 CD GLN A 11 19.445 11.520 7.876 1.00 44.52 C ATOM 142 OE1 GLN A 11 20.307 11.252 7.043 1.00 75.24 O ATOM 143 NE2 GLN A 11 18.256 10.978 7.845 1.00 51.21 N ATOM 0 H GLN A 11 20.644 12.279 13.188 1.00 54.24 H new ATOM 0 HA GLN A 11 21.157 13.871 10.852 1.00 31.14 H new ATOM 0 HB2 GLN A 11 21.307 11.555 9.953 1.00 4.32 H new ATOM 0 HB3 GLN A 11 19.722 11.205 10.614 1.00 4.32 H new ATOM 0 HG2 GLN A 11 18.750 13.027 9.213 1.00 3.41 H new ATOM 0 HG3 GLN A 11 20.336 13.340 8.536 1.00 3.41 H new ATOM 0 HE21 GLN A 11 17.565 11.224 8.553 1.00 51.21 H new ATOM 0 HE22 GLN A 11 18.019 10.309 7.112 1.00 51.21 H new ATOM 152 N VAL A 12 18.907 14.746 11.361 1.00 63.42 N ATOM 153 CA VAL A 12 17.622 15.272 11.630 1.00 22.55 C ATOM 154 C VAL A 12 17.031 15.661 10.313 1.00 21.41 C ATOM 155 O VAL A 12 17.599 16.472 9.559 1.00 73.23 O ATOM 156 CB VAL A 12 17.666 16.509 12.568 1.00 11.54 C ATOM 157 CG1 VAL A 12 16.257 17.016 12.859 1.00 41.20 C ATOM 158 CG2 VAL A 12 18.384 16.186 13.868 1.00 54.43 C ATOM 0 H VAL A 12 19.521 15.370 10.837 1.00 63.42 H new ATOM 0 HA VAL A 12 17.026 14.518 12.144 1.00 22.55 H new ATOM 0 HB VAL A 12 18.222 17.294 12.055 1.00 11.54 H new ATOM 0 HG11 VAL A 12 16.311 17.883 13.518 1.00 41.20 H new ATOM 0 HG12 VAL A 12 15.772 17.300 11.925 1.00 41.20 H new ATOM 0 HG13 VAL A 12 15.679 16.228 13.343 1.00 41.20 H new ATOM 0 HG21 VAL A 12 18.399 17.071 14.505 1.00 54.43 H new ATOM 0 HG22 VAL A 12 17.862 15.379 14.381 1.00 54.43 H new ATOM 0 HG23 VAL A 12 19.407 15.877 13.652 1.00 54.43 H new ATOM 168 N GLU A 13 15.943 15.080 10.011 1.00 12.41 N ATOM 169 CA GLU A 13 15.264 15.374 8.821 1.00 22.34 C ATOM 170 C GLU A 13 14.026 16.159 9.133 1.00 34.43 C ATOM 171 O GLU A 13 13.258 15.813 10.043 1.00 45.10 O ATOM 172 CB GLU A 13 14.978 14.099 7.974 1.00 50.00 C ATOM 173 CG GLU A 13 14.293 12.926 8.696 1.00 35.42 C ATOM 174 CD GLU A 13 15.172 12.249 9.740 1.00 40.43 C ATOM 175 OE1 GLU A 13 15.932 11.312 9.394 1.00 51.15 O ATOM 176 OE2 GLU A 13 15.114 12.643 10.928 1.00 63.11 O ATOM 0 H GLU A 13 15.491 14.375 10.593 1.00 12.41 H new ATOM 0 HA GLU A 13 15.906 15.991 8.193 1.00 22.34 H new ATOM 0 HB2 GLU A 13 14.355 14.387 7.127 1.00 50.00 H new ATOM 0 HB3 GLU A 13 15.924 13.742 7.568 1.00 50.00 H new ATOM 0 HG2 GLU A 13 13.386 13.289 9.179 1.00 35.42 H new ATOM 0 HG3 GLU A 13 13.987 12.186 7.957 1.00 35.42 H new ATOM 183 N THR A 14 13.847 17.227 8.420 1.00 11.12 N ATOM 184 CA THR A 14 12.720 18.067 8.612 1.00 51.10 C ATOM 185 C THR A 14 11.499 17.438 7.968 1.00 12.43 C ATOM 186 O THR A 14 11.487 17.141 6.773 1.00 23.30 O ATOM 187 CB THR A 14 12.984 19.472 8.039 1.00 4.34 C ATOM 188 OG1 THR A 14 14.163 20.014 8.663 1.00 52.44 O ATOM 189 CG2 THR A 14 11.802 20.400 8.296 1.00 30.34 C ATOM 0 H THR A 14 14.485 17.537 7.687 1.00 11.12 H new ATOM 0 HA THR A 14 12.535 18.175 9.681 1.00 51.10 H new ATOM 0 HB THR A 14 13.125 19.391 6.961 1.00 4.34 H new ATOM 0 HG1 THR A 14 14.341 20.908 8.304 1.00 52.44 H new ATOM 0 HG21 THR A 14 12.016 21.385 7.881 1.00 30.34 H new ATOM 0 HG22 THR A 14 10.909 19.992 7.822 1.00 30.34 H new ATOM 0 HG23 THR A 14 11.635 20.487 9.370 1.00 30.34 H new HETATM 197 N TPO A 15 10.523 17.191 8.757 1.00 20.32 N HETATM 198 CA TPO A 15 9.319 16.615 8.290 1.00 72.10 C HETATM 199 CB TPO A 15 9.010 15.294 9.030 1.00 60.03 C HETATM 200 CG2 TPO A 15 8.399 14.331 8.059 1.00 42.41 C HETATM 201 OG1 TPO A 15 10.235 14.633 9.444 1.00 41.21 O HETATM 202 P TPO A 15 10.320 13.502 10.623 1.00 62.15 P HETATM 203 O1P TPO A 15 10.848 14.112 11.915 1.00 50.02 O HETATM 204 O2P TPO A 15 11.282 12.394 10.227 1.00 25.11 O HETATM 205 O3P TPO A 15 8.922 12.908 10.883 1.00 72.03 O HETATM 206 C TPO A 15 8.196 17.630 8.543 1.00 41.14 C HETATM 207 O TPO A 15 7.957 18.011 9.682 1.00 11.43 O HETATM 0 HG23 TPO A 15 7.478 14.754 7.657 1.00 42.41 H new HETATM 0 HG22 TPO A 15 9.098 14.144 7.244 1.00 42.41 H new HETATM 0 HG21 TPO A 15 8.176 13.393 8.568 1.00 42.41 H new HETATM 0 HB TPO A 15 8.370 15.539 9.878 1.00 60.03 H new HETATM 0 HA TPO A 15 9.406 16.382 7.229 1.00 72.10 H new ATOM 214 N SER A 16 7.550 18.092 7.503 1.00 23.14 N ATOM 215 CA SER A 16 6.508 19.093 7.638 1.00 44.43 C ATOM 216 C SER A 16 5.151 18.418 7.851 1.00 60.40 C ATOM 217 O SER A 16 4.685 17.670 7.001 1.00 63.35 O ATOM 218 CB SER A 16 6.491 19.998 6.391 1.00 61.00 C ATOM 219 OG SER A 16 5.495 21.011 6.480 1.00 44.23 O ATOM 0 H SER A 16 7.725 17.792 6.544 1.00 23.14 H new ATOM 0 HA SER A 16 6.713 19.714 8.510 1.00 44.43 H new ATOM 0 HB2 SER A 16 7.470 20.462 6.266 1.00 61.00 H new ATOM 0 HB3 SER A 16 6.311 19.390 5.504 1.00 61.00 H new ATOM 0 HG SER A 16 5.518 21.564 5.671 1.00 44.23 H new ATOM 225 N VAL A 17 4.541 18.676 8.997 1.00 33.33 N ATOM 226 CA VAL A 17 3.265 18.068 9.349 1.00 13.12 C ATOM 227 C VAL A 17 2.123 18.861 8.718 1.00 61.43 C ATOM 228 O VAL A 17 1.958 20.056 8.997 1.00 31.20 O ATOM 229 CB VAL A 17 3.067 18.022 10.896 1.00 63.34 C ATOM 230 CG1 VAL A 17 1.775 17.306 11.264 1.00 24.23 C ATOM 231 CG2 VAL A 17 4.258 17.367 11.587 1.00 11.03 C ATOM 0 H VAL A 17 4.912 19.308 9.706 1.00 33.33 H new ATOM 0 HA VAL A 17 3.264 17.046 8.970 1.00 13.12 H new ATOM 0 HB VAL A 17 2.997 19.052 11.247 1.00 63.34 H new ATOM 0 HG11 VAL A 17 1.664 17.290 12.348 1.00 24.23 H new ATOM 0 HG12 VAL A 17 0.929 17.831 10.821 1.00 24.23 H new ATOM 0 HG13 VAL A 17 1.805 16.284 10.887 1.00 24.23 H new ATOM 0 HG21 VAL A 17 4.090 17.350 12.664 1.00 11.03 H new ATOM 0 HG22 VAL A 17 4.374 16.347 11.222 1.00 11.03 H new ATOM 0 HG23 VAL A 17 5.162 17.935 11.370 1.00 11.03 H new ATOM 241 N PHE A 18 1.374 18.218 7.857 1.00 44.20 N ATOM 242 CA PHE A 18 0.265 18.849 7.167 1.00 22.11 C ATOM 243 C PHE A 18 -1.033 18.084 7.397 1.00 34.30 C ATOM 244 O PHE A 18 -1.038 16.848 7.445 1.00 15.33 O ATOM 245 CB PHE A 18 0.560 19.033 5.659 1.00 33.43 C ATOM 246 CG PHE A 18 0.916 17.769 4.925 1.00 31.51 C ATOM 247 CD1 PHE A 18 -0.066 16.991 4.337 1.00 31.24 C ATOM 248 CD2 PHE A 18 2.236 17.364 4.819 1.00 44.34 C ATOM 249 CE1 PHE A 18 0.261 15.839 3.666 1.00 21.15 C ATOM 250 CE2 PHE A 18 2.567 16.212 4.148 1.00 53.44 C ATOM 251 CZ PHE A 18 1.580 15.452 3.572 1.00 74.30 C ATOM 0 H PHE A 18 1.513 17.238 7.611 1.00 44.20 H new ATOM 0 HA PHE A 18 0.139 19.845 7.591 1.00 22.11 H new ATOM 0 HB2 PHE A 18 -0.315 19.478 5.184 1.00 33.43 H new ATOM 0 HB3 PHE A 18 1.379 19.744 5.548 1.00 33.43 H new ATOM 0 HD1 PHE A 18 -1.100 17.293 4.407 1.00 31.24 H new ATOM 0 HD2 PHE A 18 3.015 17.961 5.269 1.00 44.34 H new ATOM 0 HE1 PHE A 18 -0.513 15.238 3.213 1.00 21.15 H new ATOM 0 HE2 PHE A 18 3.600 15.906 4.074 1.00 53.44 H new ATOM 0 HZ PHE A 18 1.838 14.547 3.043 1.00 74.30 H new ATOM 261 N ARG A 19 -2.111 18.810 7.569 1.00 64.21 N ATOM 262 CA ARG A 19 -3.417 18.209 7.793 1.00 20.32 C ATOM 263 C ARG A 19 -4.196 18.067 6.479 1.00 24.21 C ATOM 264 O ARG A 19 -4.142 18.944 5.609 1.00 73.42 O ATOM 265 CB ARG A 19 -4.231 19.004 8.818 1.00 42.22 C ATOM 266 CG ARG A 19 -4.495 20.441 8.428 1.00 74.02 C ATOM 267 CD ARG A 19 -5.297 21.158 9.480 1.00 1.02 C ATOM 268 NE ARG A 19 -5.520 22.557 9.125 1.00 34.31 N ATOM 269 CZ ARG A 19 -5.973 23.495 9.962 1.00 3.22 C ATOM 270 NH1 ARG A 19 -6.295 23.175 11.217 1.00 23.15 N ATOM 271 NH2 ARG A 19 -6.122 24.749 9.538 1.00 21.21 N ATOM 0 H ARG A 19 -2.115 19.830 7.559 1.00 64.21 H new ATOM 0 HA ARG A 19 -3.249 17.211 8.198 1.00 20.32 H new ATOM 0 HB2 ARG A 19 -5.186 18.502 8.974 1.00 42.22 H new ATOM 0 HB3 ARG A 19 -3.704 18.990 9.772 1.00 42.22 H new ATOM 0 HG2 ARG A 19 -3.548 20.958 8.276 1.00 74.02 H new ATOM 0 HG3 ARG A 19 -5.030 20.469 7.479 1.00 74.02 H new ATOM 0 HD2 ARG A 19 -6.257 20.658 9.611 1.00 1.02 H new ATOM 0 HD3 ARG A 19 -4.776 21.103 10.436 1.00 1.02 H new ATOM 0 HE ARG A 19 -5.315 22.839 8.167 1.00 34.31 H new ATOM 0 HH11 ARG A 19 -6.196 22.212 11.539 1.00 23.15 H new ATOM 0 HH12 ARG A 19 -6.641 23.893 11.854 1.00 23.15 H new ATOM 0 HH21 ARG A 19 -5.890 24.993 8.575 1.00 21.21 H new ATOM 0 HH22 ARG A 19 -6.468 25.466 10.176 1.00 21.21 H new ATOM 285 N ALA A 20 -4.876 16.952 6.327 1.00 11.32 N ATOM 286 CA ALA A 20 -5.689 16.681 5.146 1.00 75.31 C ATOM 287 C ALA A 20 -7.095 16.265 5.593 1.00 34.12 C ATOM 288 O ALA A 20 -7.427 16.421 6.763 1.00 41.35 O ATOM 289 CB ALA A 20 -5.035 15.581 4.312 1.00 50.54 C ATOM 0 H ALA A 20 -4.885 16.201 7.017 1.00 11.32 H new ATOM 0 HA ALA A 20 -5.765 17.577 4.529 1.00 75.31 H new ATOM 0 HB1 ALA A 20 -5.645 15.381 3.431 1.00 50.54 H new ATOM 0 HB2 ALA A 20 -4.041 15.903 4.000 1.00 50.54 H new ATOM 0 HB3 ALA A 20 -4.951 14.673 4.909 1.00 50.54 H new ATOM 295 N ASP A 21 -7.892 15.665 4.685 1.00 41.14 N ATOM 296 CA ASP A 21 -9.300 15.225 4.987 1.00 41.20 C ATOM 297 C ASP A 21 -9.315 14.065 5.978 1.00 73.21 C ATOM 298 O ASP A 21 -10.361 13.614 6.433 1.00 3.42 O ATOM 299 CB ASP A 21 -10.037 14.793 3.711 1.00 4.40 C ATOM 300 CG ASP A 21 -9.446 13.550 3.060 1.00 4.01 C ATOM 301 OD1 ASP A 21 -8.385 13.666 2.426 1.00 50.43 O ATOM 302 OD2 ASP A 21 -10.058 12.447 3.150 1.00 72.33 O ATOM 0 H ASP A 21 -7.597 15.467 3.729 1.00 41.14 H new ATOM 0 HA ASP A 21 -9.810 16.083 5.425 1.00 41.20 H new ATOM 0 HB2 ASP A 21 -11.083 14.605 3.951 1.00 4.40 H new ATOM 0 HB3 ASP A 21 -10.017 15.614 2.994 1.00 4.40 H new ATOM 307 N LEU A 22 -8.139 13.636 6.319 1.00 21.03 N ATOM 308 CA LEU A 22 -7.867 12.578 7.247 1.00 1.01 C ATOM 309 C LEU A 22 -8.490 12.862 8.624 1.00 33.33 C ATOM 310 O LEU A 22 -8.952 11.945 9.299 1.00 53.14 O ATOM 311 CB LEU A 22 -6.354 12.494 7.388 1.00 34.34 C ATOM 312 CG LEU A 22 -5.574 12.075 6.143 1.00 53.33 C ATOM 313 CD1 LEU A 22 -4.095 12.341 6.326 1.00 73.02 C ATOM 314 CD2 LEU A 22 -5.786 10.607 5.883 1.00 42.24 C ATOM 0 H LEU A 22 -7.287 14.041 5.932 1.00 21.03 H new ATOM 0 HA LEU A 22 -8.296 11.645 6.881 1.00 1.01 H new ATOM 0 HB2 LEU A 22 -5.987 13.469 7.708 1.00 34.34 H new ATOM 0 HB3 LEU A 22 -6.125 11.789 8.187 1.00 34.34 H new ATOM 0 HG LEU A 22 -5.936 12.658 5.296 1.00 53.33 H new ATOM 0 HD11 LEU A 22 -3.557 12.036 5.429 1.00 73.02 H new ATOM 0 HD12 LEU A 22 -3.936 13.405 6.501 1.00 73.02 H new ATOM 0 HD13 LEU A 22 -3.726 11.774 7.181 1.00 73.02 H new ATOM 0 HD21 LEU A 22 -5.229 10.311 4.994 1.00 42.24 H new ATOM 0 HD22 LEU A 22 -5.436 10.031 6.740 1.00 42.24 H new ATOM 0 HD23 LEU A 22 -6.847 10.415 5.726 1.00 42.24 H new ATOM 326 N LEU A 23 -8.566 14.136 8.982 1.00 21.22 N ATOM 327 CA LEU A 23 -9.038 14.588 10.294 1.00 63.13 C ATOM 328 C LEU A 23 -10.545 14.357 10.569 1.00 15.40 C ATOM 329 O LEU A 23 -11.038 14.668 11.652 1.00 32.33 O ATOM 330 CB LEU A 23 -8.628 16.058 10.521 1.00 54.30 C ATOM 331 CG LEU A 23 -8.921 17.079 9.396 1.00 64.10 C ATOM 332 CD1 LEU A 23 -10.410 17.278 9.153 1.00 43.11 C ATOM 333 CD2 LEU A 23 -8.244 18.402 9.701 1.00 61.12 C ATOM 0 H LEU A 23 -8.298 14.901 8.363 1.00 21.22 H new ATOM 0 HA LEU A 23 -8.543 13.951 11.027 1.00 63.13 H new ATOM 0 HB2 LEU A 23 -9.126 16.407 11.426 1.00 54.30 H new ATOM 0 HB3 LEU A 23 -7.556 16.078 10.719 1.00 54.30 H new ATOM 0 HG LEU A 23 -8.510 16.668 8.474 1.00 64.10 H new ATOM 0 HD11 LEU A 23 -10.554 18.005 8.353 1.00 43.11 H new ATOM 0 HD12 LEU A 23 -10.862 16.328 8.866 1.00 43.11 H new ATOM 0 HD13 LEU A 23 -10.882 17.644 10.065 1.00 43.11 H new ATOM 0 HD21 LEU A 23 -8.457 19.112 8.902 1.00 61.12 H new ATOM 0 HD22 LEU A 23 -8.621 18.794 10.646 1.00 61.12 H new ATOM 0 HD23 LEU A 23 -7.167 18.251 9.774 1.00 61.12 H new ATOM 345 N LYS A 24 -11.263 13.812 9.610 1.00 71.32 N ATOM 346 CA LYS A 24 -12.684 13.544 9.794 1.00 44.22 C ATOM 347 C LYS A 24 -12.917 12.240 10.565 1.00 63.32 C ATOM 348 O LYS A 24 -14.057 11.903 10.899 1.00 1.42 O ATOM 349 CB LYS A 24 -13.452 13.547 8.464 1.00 23.42 C ATOM 350 CG LYS A 24 -13.032 12.477 7.473 1.00 21.42 C ATOM 351 CD LYS A 24 -13.859 12.572 6.207 1.00 53.13 C ATOM 352 CE LYS A 24 -13.448 11.525 5.194 1.00 10.11 C ATOM 353 NZ LYS A 24 -14.338 11.526 4.013 1.00 14.44 N ATOM 0 H LYS A 24 -10.894 13.545 8.697 1.00 71.32 H new ATOM 0 HA LYS A 24 -13.081 14.362 10.396 1.00 44.22 H new ATOM 0 HB2 LYS A 24 -14.514 13.426 8.676 1.00 23.42 H new ATOM 0 HB3 LYS A 24 -13.329 14.523 7.994 1.00 23.42 H new ATOM 0 HG2 LYS A 24 -11.975 12.590 7.233 1.00 21.42 H new ATOM 0 HG3 LYS A 24 -13.154 11.491 7.921 1.00 21.42 H new ATOM 0 HD2 LYS A 24 -14.914 12.449 6.451 1.00 53.13 H new ATOM 0 HD3 LYS A 24 -13.746 13.565 5.771 1.00 53.13 H new ATOM 0 HE2 LYS A 24 -12.422 11.709 4.876 1.00 10.11 H new ATOM 0 HE3 LYS A 24 -13.465 10.540 5.661 1.00 10.11 H new ATOM 0 HZ1 LYS A 24 -14.025 10.796 3.342 1.00 14.44 H new ATOM 0 HZ2 LYS A 24 -15.313 11.325 4.313 1.00 14.44 H new ATOM 0 HZ3 LYS A 24 -14.303 12.458 3.552 1.00 14.44 H new ATOM 367 N GLU A 25 -11.833 11.524 10.828 1.00 51.15 N ATOM 368 CA GLU A 25 -11.849 10.205 11.469 1.00 70.43 C ATOM 369 C GLU A 25 -12.706 10.080 12.735 1.00 23.45 C ATOM 370 O GLU A 25 -13.512 9.167 12.834 1.00 23.51 O ATOM 371 CB GLU A 25 -10.419 9.656 11.681 1.00 42.41 C ATOM 372 CG GLU A 25 -9.348 10.664 12.138 1.00 64.51 C ATOM 373 CD GLU A 25 -9.593 11.292 13.475 1.00 43.30 C ATOM 374 OE1 GLU A 25 -9.174 10.724 14.486 1.00 42.20 O ATOM 375 OE2 GLU A 25 -10.196 12.375 13.535 1.00 61.05 O ATOM 0 H GLU A 25 -10.893 11.847 10.598 1.00 51.15 H new ATOM 0 HA GLU A 25 -12.366 9.571 10.749 1.00 70.43 H new ATOM 0 HB2 GLU A 25 -10.469 8.855 12.419 1.00 42.41 H new ATOM 0 HB3 GLU A 25 -10.085 9.207 10.745 1.00 42.41 H new ATOM 0 HG2 GLU A 25 -8.383 10.158 12.163 1.00 64.51 H new ATOM 0 HG3 GLU A 25 -9.274 11.455 11.391 1.00 64.51 H new ATOM 382 N MET A 26 -12.555 10.997 13.664 1.00 62.24 N ATOM 383 CA MET A 26 -13.266 10.937 14.933 1.00 43.52 C ATOM 384 C MET A 26 -14.777 11.013 14.736 1.00 21.43 C ATOM 385 O MET A 26 -15.528 10.200 15.277 1.00 22.45 O ATOM 386 CB MET A 26 -12.801 12.050 15.872 1.00 34.12 C ATOM 387 CG MET A 26 -13.412 11.965 17.264 1.00 43.24 C ATOM 388 SD MET A 26 -12.958 13.352 18.331 1.00 60.02 S ATOM 389 CE MET A 26 -11.162 13.209 18.349 1.00 42.41 C ATOM 0 H MET A 26 -11.940 11.805 13.567 1.00 62.24 H new ATOM 0 HA MET A 26 -13.033 9.974 15.387 1.00 43.52 H new ATOM 0 HB2 MET A 26 -11.715 12.012 15.958 1.00 34.12 H new ATOM 0 HB3 MET A 26 -13.053 13.015 15.432 1.00 34.12 H new ATOM 0 HG2 MET A 26 -14.498 11.925 17.175 1.00 43.24 H new ATOM 0 HG3 MET A 26 -13.096 11.034 17.736 1.00 43.24 H new ATOM 0 HE1 MET A 26 -10.758 13.799 19.172 1.00 42.41 H new ATOM 0 HE2 MET A 26 -10.882 12.164 18.480 1.00 42.41 H new ATOM 0 HE3 MET A 26 -10.758 13.577 17.406 1.00 42.41 H new ATOM 399 N GLU A 27 -15.218 11.950 13.924 1.00 11.20 N ATOM 400 CA GLU A 27 -16.636 12.131 13.698 1.00 22.15 C ATOM 401 C GLU A 27 -17.178 11.014 12.802 1.00 3.11 C ATOM 402 O GLU A 27 -18.332 10.600 12.922 1.00 45.41 O ATOM 403 CB GLU A 27 -16.906 13.517 13.112 1.00 2.24 C ATOM 404 CG GLU A 27 -18.375 13.888 13.031 1.00 1.23 C ATOM 405 CD GLU A 27 -18.581 15.316 12.627 1.00 1.42 C ATOM 406 OE1 GLU A 27 -18.509 16.203 13.502 1.00 44.33 O ATOM 407 OE2 GLU A 27 -18.819 15.589 11.432 1.00 4.22 O ATOM 0 H GLU A 27 -14.618 12.596 13.411 1.00 11.20 H new ATOM 0 HA GLU A 27 -17.163 12.070 14.650 1.00 22.15 H new ATOM 0 HB2 GLU A 27 -16.389 14.261 13.718 1.00 2.24 H new ATOM 0 HB3 GLU A 27 -16.476 13.565 12.112 1.00 2.24 H new ATOM 0 HG2 GLU A 27 -18.873 13.235 12.314 1.00 1.23 H new ATOM 0 HG3 GLU A 27 -18.845 13.716 13.999 1.00 1.23 H new ATOM 414 N SER A 28 -16.321 10.481 11.959 1.00 44.42 N ATOM 415 CA SER A 28 -16.694 9.407 11.058 1.00 13.53 C ATOM 416 C SER A 28 -16.683 8.053 11.784 1.00 11.43 C ATOM 417 O SER A 28 -17.152 7.039 11.252 1.00 61.44 O ATOM 418 CB SER A 28 -15.768 9.390 9.850 1.00 55.04 C ATOM 419 OG SER A 28 -15.751 10.669 9.209 1.00 5.53 O ATOM 0 H SER A 28 -15.348 10.777 11.877 1.00 44.42 H new ATOM 0 HA SER A 28 -17.711 9.584 10.708 1.00 13.53 H new ATOM 0 HB2 SER A 28 -14.759 9.121 10.162 1.00 55.04 H new ATOM 0 HB3 SER A 28 -16.097 8.628 9.144 1.00 55.04 H new ATOM 0 HG SER A 28 -15.325 11.325 9.799 1.00 5.53 H new ATOM 425 N SER A 29 -16.121 8.044 12.991 1.00 31.42 N ATOM 426 CA SER A 29 -16.096 6.863 13.814 1.00 21.51 C ATOM 427 C SER A 29 -17.512 6.590 14.326 1.00 32.43 C ATOM 428 O SER A 29 -17.855 5.461 14.665 1.00 30.02 O ATOM 429 CB SER A 29 -15.093 7.036 14.970 1.00 54.54 C ATOM 430 OG SER A 29 -14.965 5.848 15.741 1.00 14.13 O ATOM 0 H SER A 29 -15.675 8.858 13.414 1.00 31.42 H new ATOM 0 HA SER A 29 -15.764 6.005 13.230 1.00 21.51 H new ATOM 0 HB2 SER A 29 -14.119 7.315 14.567 1.00 54.54 H new ATOM 0 HB3 SER A 29 -15.418 7.854 15.614 1.00 54.54 H new ATOM 0 HG SER A 29 -14.320 5.995 16.464 1.00 14.13 H new ATOM 436 N THR A 30 -18.325 7.640 14.386 1.00 20.22 N ATOM 437 CA THR A 30 -19.722 7.496 14.677 1.00 22.21 C ATOM 438 C THR A 30 -20.401 6.967 13.406 1.00 24.11 C ATOM 439 O THR A 30 -20.744 7.726 12.476 1.00 23.35 O ATOM 440 CB THR A 30 -20.319 8.843 15.148 1.00 54.21 C ATOM 441 OG1 THR A 30 -19.637 9.259 16.349 1.00 31.21 O ATOM 442 CG2 THR A 30 -21.815 8.739 15.418 1.00 72.31 C ATOM 0 H THR A 30 -18.024 8.602 14.233 1.00 20.22 H new ATOM 0 HA THR A 30 -19.886 6.792 15.493 1.00 22.21 H new ATOM 0 HB THR A 30 -20.180 9.576 14.353 1.00 54.21 H new ATOM 0 HG1 THR A 30 -20.006 10.113 16.656 1.00 31.21 H new ATOM 0 HG21 THR A 30 -22.194 9.707 15.746 1.00 72.31 H new ATOM 0 HG22 THR A 30 -22.329 8.439 14.505 1.00 72.31 H new ATOM 0 HG23 THR A 30 -21.994 7.997 16.196 1.00 72.31 H new ATOM 450 N GLY A 31 -20.518 5.670 13.357 1.00 23.32 N ATOM 451 CA GLY A 31 -20.929 4.982 12.168 1.00 2.55 C ATOM 452 C GLY A 31 -19.703 4.303 11.608 1.00 11.44 C ATOM 453 O GLY A 31 -19.353 4.457 10.430 1.00 51.32 O ATOM 0 H GLY A 31 -20.329 5.056 14.149 1.00 23.32 H new ATOM 0 HA2 GLY A 31 -21.706 4.251 12.394 1.00 2.55 H new ATOM 0 HA3 GLY A 31 -21.349 5.680 11.444 1.00 2.55 H new ATOM 457 N THR A 32 -19.041 3.591 12.488 1.00 13.33 N ATOM 458 CA THR A 32 -17.774 2.952 12.244 1.00 71.51 C ATOM 459 C THR A 32 -17.890 1.804 11.219 1.00 64.53 C ATOM 460 O THR A 32 -18.928 1.135 11.114 1.00 70.14 O ATOM 461 CB THR A 32 -17.190 2.433 13.607 1.00 5.32 C ATOM 462 OG1 THR A 32 -15.875 1.864 13.452 1.00 20.32 O ATOM 463 CG2 THR A 32 -18.117 1.399 14.241 1.00 53.21 C ATOM 0 H THR A 32 -19.388 3.436 13.435 1.00 13.33 H new ATOM 0 HA THR A 32 -17.095 3.686 11.810 1.00 71.51 H new ATOM 0 HB THR A 32 -17.112 3.301 14.262 1.00 5.32 H new ATOM 0 HG1 THR A 32 -15.548 1.555 14.323 1.00 20.32 H new ATOM 0 HG21 THR A 32 -17.689 1.056 15.183 1.00 53.21 H new ATOM 0 HG22 THR A 32 -19.092 1.850 14.428 1.00 53.21 H new ATOM 0 HG23 THR A 32 -18.233 0.552 13.565 1.00 53.21 H new ATOM 471 N ALA A 33 -16.834 1.600 10.467 1.00 42.12 N ATOM 472 CA ALA A 33 -16.771 0.534 9.491 1.00 51.01 C ATOM 473 C ALA A 33 -16.092 -0.680 10.139 1.00 0.31 C ATOM 474 O ALA A 33 -15.268 -0.500 11.043 1.00 42.35 O ATOM 475 CB ALA A 33 -15.995 0.998 8.259 1.00 24.33 C ATOM 0 H ALA A 33 -15.990 2.171 10.514 1.00 42.12 H new ATOM 0 HA ALA A 33 -17.775 0.258 9.169 1.00 51.01 H new ATOM 0 HB1 ALA A 33 -15.953 0.189 7.530 1.00 24.33 H new ATOM 0 HB2 ALA A 33 -16.496 1.859 7.817 1.00 24.33 H new ATOM 0 HB3 ALA A 33 -14.982 1.277 8.551 1.00 24.33 H new ATOM 481 N PRO A 34 -16.421 -1.919 9.726 1.00 74.13 N ATOM 482 CA PRO A 34 -15.854 -3.131 10.338 1.00 12.31 C ATOM 483 C PRO A 34 -14.329 -3.230 10.186 1.00 53.42 C ATOM 484 O PRO A 34 -13.745 -2.757 9.192 1.00 63.43 O ATOM 485 CB PRO A 34 -16.532 -4.284 9.579 1.00 34.45 C ATOM 486 CG PRO A 34 -17.730 -3.675 8.941 1.00 51.32 C ATOM 487 CD PRO A 34 -17.357 -2.254 8.637 1.00 53.03 C ATOM 0 HA PRO A 34 -16.032 -3.141 11.413 1.00 12.31 H new ATOM 0 HB2 PRO A 34 -15.863 -4.713 8.833 1.00 34.45 H new ATOM 0 HB3 PRO A 34 -16.813 -5.091 10.256 1.00 34.45 H new ATOM 0 HG2 PRO A 34 -18.003 -4.210 8.031 1.00 51.32 H new ATOM 0 HG3 PRO A 34 -18.592 -3.719 9.607 1.00 51.32 H new ATOM 0 HD2 PRO A 34 -16.888 -2.160 7.658 1.00 53.03 H new ATOM 0 HD3 PRO A 34 -18.228 -1.599 8.637 1.00 53.03 H new ATOM 495 N ALA A 35 -13.697 -3.798 11.176 1.00 11.23 N ATOM 496 CA ALA A 35 -12.278 -4.041 11.145 1.00 71.22 C ATOM 497 C ALA A 35 -12.038 -5.408 10.538 1.00 3.41 C ATOM 498 O ALA A 35 -12.948 -6.248 10.523 1.00 63.52 O ATOM 499 CB ALA A 35 -11.706 -3.981 12.552 1.00 21.15 C ATOM 0 H ALA A 35 -14.154 -4.108 12.034 1.00 11.23 H new ATOM 0 HA ALA A 35 -11.783 -3.278 10.544 1.00 71.22 H new ATOM 0 HB1 ALA A 35 -10.632 -4.166 12.517 1.00 21.15 H new ATOM 0 HB2 ALA A 35 -11.890 -2.995 12.978 1.00 21.15 H new ATOM 0 HB3 ALA A 35 -12.185 -4.739 13.172 1.00 21.15 H new ATOM 505 N SER A 36 -10.861 -5.637 10.050 1.00 14.02 N ATOM 506 CA SER A 36 -10.530 -6.891 9.444 1.00 60.23 C ATOM 507 C SER A 36 -9.776 -7.764 10.454 1.00 0.11 C ATOM 508 O SER A 36 -9.527 -7.348 11.594 1.00 53.35 O ATOM 509 CB SER A 36 -9.682 -6.646 8.169 1.00 73.04 C ATOM 510 OG SER A 36 -9.365 -7.866 7.485 1.00 2.24 O ATOM 0 H SER A 36 -10.099 -4.959 10.059 1.00 14.02 H new ATOM 0 HA SER A 36 -11.440 -7.415 9.151 1.00 60.23 H new ATOM 0 HB2 SER A 36 -10.226 -5.985 7.495 1.00 73.04 H new ATOM 0 HB3 SER A 36 -8.759 -6.134 8.442 1.00 73.04 H new ATOM 0 HG SER A 36 -9.115 -7.666 6.559 1.00 2.24 H new ATOM 516 N THR A 37 -9.450 -8.954 10.033 1.00 61.25 N ATOM 517 CA THR A 37 -8.688 -9.907 10.793 1.00 4.02 C ATOM 518 C THR A 37 -8.051 -10.846 9.765 1.00 71.11 C ATOM 519 O THR A 37 -7.810 -12.029 10.003 1.00 14.14 O ATOM 520 CB THR A 37 -9.609 -10.682 11.796 1.00 3.13 C ATOM 521 OG1 THR A 37 -8.829 -11.542 12.661 1.00 72.42 O ATOM 522 CG2 THR A 37 -10.666 -11.508 11.067 1.00 52.33 C ATOM 0 H THR A 37 -9.719 -9.301 9.112 1.00 61.25 H new ATOM 0 HA THR A 37 -7.925 -9.423 11.402 1.00 4.02 H new ATOM 0 HB THR A 37 -10.117 -9.933 12.404 1.00 3.13 H new ATOM 0 HG1 THR A 37 -8.177 -12.040 12.125 1.00 72.42 H new ATOM 0 HG21 THR A 37 -11.285 -12.031 11.796 1.00 52.33 H new ATOM 0 HG22 THR A 37 -11.292 -10.849 10.465 1.00 52.33 H new ATOM 0 HG23 THR A 37 -10.176 -12.235 10.419 1.00 52.33 H new ATOM 530 N GLY A 38 -7.724 -10.276 8.623 1.00 62.41 N ATOM 531 CA GLY A 38 -7.253 -11.054 7.530 1.00 4.23 C ATOM 532 C GLY A 38 -5.771 -10.957 7.336 1.00 5.42 C ATOM 533 O GLY A 38 -5.293 -10.928 6.207 1.00 1.35 O ATOM 0 H GLY A 38 -7.781 -9.274 8.442 1.00 62.41 H new ATOM 0 HA2 GLY A 38 -7.525 -12.097 7.690 1.00 4.23 H new ATOM 0 HA3 GLY A 38 -7.755 -10.730 6.618 1.00 4.23 H new ATOM 537 N ALA A 39 -5.034 -10.855 8.409 1.00 2.14 N ATOM 538 CA ALA A 39 -3.596 -10.873 8.286 1.00 60.42 C ATOM 539 C ALA A 39 -3.123 -12.310 8.406 1.00 33.22 C ATOM 540 O ALA A 39 -2.218 -12.756 7.710 1.00 63.04 O ATOM 541 CB ALA A 39 -2.927 -9.995 9.330 1.00 42.54 C ATOM 0 H ALA A 39 -5.392 -10.760 9.359 1.00 2.14 H new ATOM 0 HA ALA A 39 -3.317 -10.466 7.314 1.00 60.42 H new ATOM 0 HB1 ALA A 39 -1.845 -10.037 9.202 1.00 42.54 H new ATOM 0 HB2 ALA A 39 -3.267 -8.966 9.212 1.00 42.54 H new ATOM 0 HB3 ALA A 39 -3.188 -10.351 10.326 1.00 42.54 H new ATOM 547 N GLU A 40 -3.846 -13.045 9.232 1.00 44.11 N ATOM 548 CA GLU A 40 -3.578 -14.446 9.580 1.00 43.12 C ATOM 549 C GLU A 40 -3.989 -15.416 8.459 1.00 3.14 C ATOM 550 O GLU A 40 -4.044 -16.634 8.663 1.00 41.12 O ATOM 551 CB GLU A 40 -4.371 -14.760 10.847 1.00 71.21 C ATOM 552 CG GLU A 40 -5.879 -14.580 10.665 1.00 14.41 C ATOM 553 CD GLU A 40 -6.636 -14.525 11.959 1.00 3.34 C ATOM 554 OE1 GLU A 40 -6.658 -13.452 12.586 1.00 23.20 O ATOM 555 OE2 GLU A 40 -7.256 -15.542 12.359 1.00 24.12 O ATOM 0 H GLU A 40 -4.672 -12.675 9.703 1.00 44.11 H new ATOM 0 HA GLU A 40 -2.506 -14.577 9.731 1.00 43.12 H new ATOM 0 HB2 GLU A 40 -4.167 -15.786 11.152 1.00 71.21 H new ATOM 0 HB3 GLU A 40 -4.028 -14.113 11.654 1.00 71.21 H new ATOM 0 HG2 GLU A 40 -6.062 -13.662 10.107 1.00 14.41 H new ATOM 0 HG3 GLU A 40 -6.265 -15.402 10.062 1.00 14.41 H new ATOM 562 N ASN A 41 -4.262 -14.888 7.297 1.00 3.44 N ATOM 563 CA ASN A 41 -4.707 -15.712 6.186 1.00 2.44 C ATOM 564 C ASN A 41 -3.532 -16.387 5.536 1.00 32.34 C ATOM 565 O ASN A 41 -3.597 -17.574 5.232 1.00 64.41 O ATOM 566 CB ASN A 41 -5.498 -14.894 5.143 1.00 4.50 C ATOM 567 CG ASN A 41 -6.849 -14.404 5.649 1.00 44.04 C ATOM 568 OD1 ASN A 41 -7.044 -14.175 6.842 1.00 72.40 O ATOM 569 ND2 ASN A 41 -7.775 -14.206 4.752 1.00 21.11 N ATOM 0 H ASN A 41 -4.187 -13.893 7.086 1.00 3.44 H new ATOM 0 HA ASN A 41 -5.380 -16.469 6.588 1.00 2.44 H new ATOM 0 HB2 ASN A 41 -4.900 -14.035 4.838 1.00 4.50 H new ATOM 0 HB3 ASN A 41 -5.652 -15.506 4.255 1.00 4.50 H new ATOM 0 HD21 ASN A 41 -8.690 -13.852 5.033 1.00 21.11 H new ATOM 0 HD22 ASN A 41 -7.585 -14.405 3.770 1.00 21.11 H new ATOM 576 N LEU A 42 -2.445 -15.614 5.377 1.00 55.12 N ATOM 577 CA LEU A 42 -1.173 -16.060 4.767 1.00 22.41 C ATOM 578 C LEU A 42 -1.344 -17.052 3.604 1.00 25.43 C ATOM 579 O LEU A 42 -1.158 -18.254 3.779 1.00 65.44 O ATOM 580 CB LEU A 42 -0.204 -16.628 5.814 1.00 62.10 C ATOM 581 CG LEU A 42 0.272 -15.665 6.901 1.00 22.32 C ATOM 582 CD1 LEU A 42 1.185 -16.390 7.869 1.00 14.40 C ATOM 583 CD2 LEU A 42 0.995 -14.473 6.286 1.00 74.53 C ATOM 0 H LEU A 42 -2.422 -14.639 5.675 1.00 55.12 H new ATOM 0 HA LEU A 42 -0.742 -15.155 4.338 1.00 22.41 H new ATOM 0 HB2 LEU A 42 -0.686 -17.477 6.299 1.00 62.10 H new ATOM 0 HB3 LEU A 42 0.672 -17.014 5.293 1.00 62.10 H new ATOM 0 HG LEU A 42 -0.598 -15.294 7.442 1.00 22.32 H new ATOM 0 HD11 LEU A 42 1.520 -15.697 8.641 1.00 14.40 H new ATOM 0 HD12 LEU A 42 0.643 -17.215 8.332 1.00 14.40 H new ATOM 0 HD13 LEU A 42 2.049 -16.780 7.331 1.00 14.40 H new ATOM 0 HD21 LEU A 42 1.325 -13.800 7.077 1.00 74.53 H new ATOM 0 HD22 LEU A 42 1.860 -14.823 5.723 1.00 74.53 H new ATOM 0 HD23 LEU A 42 0.317 -13.942 5.617 1.00 74.53 H new ATOM 595 N PRO A 43 -1.744 -16.581 2.416 1.00 12.11 N ATOM 596 CA PRO A 43 -1.918 -17.459 1.273 1.00 41.42 C ATOM 597 C PRO A 43 -0.566 -17.847 0.664 1.00 24.11 C ATOM 598 O PRO A 43 -0.095 -18.975 0.830 1.00 3.03 O ATOM 599 CB PRO A 43 -2.758 -16.633 0.283 1.00 44.10 C ATOM 600 CG PRO A 43 -3.082 -15.348 0.991 1.00 3.14 C ATOM 601 CD PRO A 43 -2.083 -15.196 2.096 1.00 21.53 C ATOM 0 HA PRO A 43 -2.400 -18.399 1.541 1.00 41.42 H new ATOM 0 HB2 PRO A 43 -2.204 -16.444 -0.636 1.00 44.10 H new ATOM 0 HB3 PRO A 43 -3.667 -17.165 0.003 1.00 44.10 H new ATOM 0 HG2 PRO A 43 -3.028 -14.504 0.303 1.00 3.14 H new ATOM 0 HG3 PRO A 43 -4.097 -15.371 1.388 1.00 3.14 H new ATOM 0 HD2 PRO A 43 -1.209 -14.629 1.776 1.00 21.53 H new ATOM 0 HD3 PRO A 43 -2.505 -14.674 2.955 1.00 21.53 H new ATOM 609 N ALA A 44 0.072 -16.905 0.002 1.00 31.11 N ATOM 610 CA ALA A 44 1.374 -17.151 -0.592 1.00 24.44 C ATOM 611 C ALA A 44 2.478 -16.534 0.246 1.00 64.33 C ATOM 612 O ALA A 44 3.660 -16.730 -0.018 1.00 34.12 O ATOM 613 CB ALA A 44 1.415 -16.587 -1.985 1.00 13.31 C ATOM 0 H ALA A 44 -0.288 -15.961 -0.140 1.00 31.11 H new ATOM 0 HA ALA A 44 1.534 -18.228 -0.631 1.00 24.44 H new ATOM 0 HB1 ALA A 44 2.394 -16.775 -2.425 1.00 13.31 H new ATOM 0 HB2 ALA A 44 0.646 -17.064 -2.593 1.00 13.31 H new ATOM 0 HB3 ALA A 44 1.234 -15.513 -1.948 1.00 13.31 H new ATOM 619 N GLY A 45 2.089 -15.756 1.236 1.00 72.13 N ATOM 620 CA GLY A 45 3.070 -15.102 2.087 1.00 53.42 C ATOM 621 C GLY A 45 3.435 -13.725 1.574 1.00 24.24 C ATOM 622 O GLY A 45 4.137 -12.973 2.223 1.00 75.44 O ATOM 0 H GLY A 45 1.116 -15.561 1.471 1.00 72.13 H new ATOM 0 HA2 GLY A 45 2.674 -15.019 3.099 1.00 53.42 H new ATOM 0 HA3 GLY A 45 3.968 -15.717 2.145 1.00 53.42 H new ATOM 626 N SER A 46 2.936 -13.398 0.427 1.00 35.35 N ATOM 627 CA SER A 46 3.167 -12.117 -0.170 1.00 11.44 C ATOM 628 C SER A 46 1.813 -11.426 -0.213 1.00 64.04 C ATOM 629 O SER A 46 0.782 -12.096 -0.015 1.00 41.33 O ATOM 630 CB SER A 46 3.709 -12.319 -1.588 1.00 71.40 C ATOM 631 OG SER A 46 4.742 -13.318 -1.611 1.00 22.52 O ATOM 0 H SER A 46 2.349 -14.018 -0.131 1.00 35.35 H new ATOM 0 HA SER A 46 3.891 -11.523 0.388 1.00 11.44 H new ATOM 0 HB2 SER A 46 2.897 -12.616 -2.252 1.00 71.40 H new ATOM 0 HB3 SER A 46 4.102 -11.376 -1.968 1.00 71.40 H new ATOM 0 HG SER A 46 5.618 -12.882 -1.669 1.00 22.52 H new ATOM 637 N ALA A 47 1.787 -10.127 -0.391 1.00 60.30 N ATOM 638 CA ALA A 47 0.534 -9.393 -0.412 1.00 54.11 C ATOM 639 C ALA A 47 0.670 -8.137 -1.241 1.00 34.11 C ATOM 640 O ALA A 47 1.776 -7.664 -1.432 1.00 71.34 O ATOM 641 CB ALA A 47 0.117 -9.071 0.991 1.00 73.52 C ATOM 0 H ALA A 47 2.618 -9.551 -0.524 1.00 60.30 H new ATOM 0 HA ALA A 47 -0.237 -10.011 -0.872 1.00 54.11 H new ATOM 0 HB1 ALA A 47 -0.823 -8.520 0.974 1.00 73.52 H new ATOM 0 HB2 ALA A 47 -0.014 -9.996 1.553 1.00 73.52 H new ATOM 0 HB3 ALA A 47 0.885 -8.463 1.468 1.00 73.52 H new ATOM 647 N LEU A 48 -0.426 -7.605 -1.746 1.00 33.31 N ATOM 648 CA LEU A 48 -0.368 -6.418 -2.574 1.00 52.33 C ATOM 649 C LEU A 48 -1.456 -5.408 -2.210 1.00 42.31 C ATOM 650 O LEU A 48 -2.568 -5.781 -1.852 1.00 45.25 O ATOM 651 CB LEU A 48 -0.375 -6.773 -4.109 1.00 11.43 C ATOM 652 CG LEU A 48 -1.617 -7.483 -4.768 1.00 52.33 C ATOM 653 CD1 LEU A 48 -2.039 -8.767 -4.080 1.00 4.11 C ATOM 654 CD2 LEU A 48 -2.799 -6.546 -4.996 1.00 74.14 C ATOM 0 H LEU A 48 -1.365 -7.975 -1.598 1.00 33.31 H new ATOM 0 HA LEU A 48 0.586 -5.933 -2.367 1.00 52.33 H new ATOM 0 HB2 LEU A 48 -0.212 -5.843 -4.653 1.00 11.43 H new ATOM 0 HB3 LEU A 48 0.492 -7.407 -4.295 1.00 11.43 H new ATOM 0 HG LEU A 48 -1.256 -7.781 -5.753 1.00 52.33 H new ATOM 0 HD11 LEU A 48 -2.900 -9.191 -4.597 1.00 4.11 H new ATOM 0 HD12 LEU A 48 -1.215 -9.480 -4.103 1.00 4.11 H new ATOM 0 HD13 LEU A 48 -2.306 -8.554 -3.045 1.00 4.11 H new ATOM 0 HD21 LEU A 48 -3.620 -7.100 -5.452 1.00 74.14 H new ATOM 0 HD22 LEU A 48 -3.126 -6.134 -4.041 1.00 74.14 H new ATOM 0 HD23 LEU A 48 -2.497 -5.734 -5.657 1.00 74.14 H new ATOM 666 N LEU A 49 -1.128 -4.143 -2.289 1.00 71.14 N ATOM 667 CA LEU A 49 -2.104 -3.099 -2.037 1.00 61.51 C ATOM 668 C LEU A 49 -2.311 -2.293 -3.294 1.00 61.41 C ATOM 669 O LEU A 49 -1.349 -2.004 -4.018 1.00 53.34 O ATOM 670 CB LEU A 49 -1.760 -2.179 -0.821 1.00 22.14 C ATOM 671 CG LEU A 49 -0.568 -1.194 -0.911 1.00 61.24 C ATOM 672 CD1 LEU A 49 -0.502 -0.359 0.356 1.00 21.53 C ATOM 673 CD2 LEU A 49 0.749 -1.909 -1.104 1.00 3.22 C ATOM 0 H LEU A 49 -0.195 -3.806 -2.525 1.00 71.14 H new ATOM 0 HA LEU A 49 -3.032 -3.595 -1.755 1.00 61.51 H new ATOM 0 HB2 LEU A 49 -2.650 -1.592 -0.596 1.00 22.14 H new ATOM 0 HB3 LEU A 49 -1.581 -2.828 0.037 1.00 22.14 H new ATOM 0 HG LEU A 49 -0.734 -0.558 -1.780 1.00 61.24 H new ATOM 0 HD11 LEU A 49 0.337 0.334 0.292 1.00 21.53 H new ATOM 0 HD12 LEU A 49 -1.429 0.203 0.470 1.00 21.53 H new ATOM 0 HD13 LEU A 49 -0.367 -1.014 1.217 1.00 21.53 H new ATOM 0 HD21 LEU A 49 1.555 -1.178 -1.162 1.00 3.22 H new ATOM 0 HD22 LEU A 49 0.926 -2.579 -0.263 1.00 3.22 H new ATOM 0 HD23 LEU A 49 0.717 -2.487 -2.027 1.00 3.22 H new ATOM 685 N VAL A 50 -3.544 -1.964 -3.565 1.00 72.22 N ATOM 686 CA VAL A 50 -3.916 -1.254 -4.769 1.00 42.31 C ATOM 687 C VAL A 50 -4.335 0.160 -4.416 1.00 54.42 C ATOM 688 O VAL A 50 -5.120 0.366 -3.476 1.00 51.20 O ATOM 689 CB VAL A 50 -5.110 -1.960 -5.486 1.00 72.33 C ATOM 690 CG1 VAL A 50 -5.464 -1.266 -6.799 1.00 63.22 C ATOM 691 CG2 VAL A 50 -4.820 -3.435 -5.724 1.00 45.53 C ATOM 0 H VAL A 50 -4.331 -2.181 -2.953 1.00 72.22 H new ATOM 0 HA VAL A 50 -3.054 -1.242 -5.436 1.00 42.31 H new ATOM 0 HB VAL A 50 -5.971 -1.886 -4.822 1.00 72.33 H new ATOM 0 HG11 VAL A 50 -6.299 -1.784 -7.271 1.00 63.22 H new ATOM 0 HG12 VAL A 50 -5.745 -0.232 -6.600 1.00 63.22 H new ATOM 0 HG13 VAL A 50 -4.602 -1.286 -7.465 1.00 63.22 H new ATOM 0 HG21 VAL A 50 -5.671 -3.897 -6.225 1.00 45.53 H new ATOM 0 HG22 VAL A 50 -3.933 -3.535 -6.349 1.00 45.53 H new ATOM 0 HG23 VAL A 50 -4.648 -3.931 -4.769 1.00 45.53 H new ATOM 701 N VAL A 51 -3.820 1.126 -5.139 1.00 33.31 N ATOM 702 CA VAL A 51 -4.212 2.500 -4.936 1.00 15.53 C ATOM 703 C VAL A 51 -5.508 2.696 -5.681 1.00 63.34 C ATOM 704 O VAL A 51 -5.561 2.534 -6.903 1.00 34.44 O ATOM 705 CB VAL A 51 -3.154 3.491 -5.478 1.00 53.20 C ATOM 706 CG1 VAL A 51 -3.460 4.918 -5.030 1.00 3.24 C ATOM 707 CG2 VAL A 51 -1.743 3.081 -5.073 1.00 40.02 C ATOM 0 H VAL A 51 -3.127 0.985 -5.874 1.00 33.31 H new ATOM 0 HA VAL A 51 -4.316 2.697 -3.869 1.00 15.53 H new ATOM 0 HB VAL A 51 -3.204 3.461 -6.566 1.00 53.20 H new ATOM 0 HG11 VAL A 51 -2.701 5.594 -5.425 1.00 3.24 H new ATOM 0 HG12 VAL A 51 -4.440 5.215 -5.404 1.00 3.24 H new ATOM 0 HG13 VAL A 51 -3.458 4.966 -3.941 1.00 3.24 H new ATOM 0 HG21 VAL A 51 -1.027 3.800 -5.471 1.00 40.02 H new ATOM 0 HG22 VAL A 51 -1.669 3.059 -3.986 1.00 40.02 H new ATOM 0 HG23 VAL A 51 -1.523 2.091 -5.472 1.00 40.02 H new ATOM 717 N LYS A 52 -6.537 3.025 -4.956 1.00 51.24 N ATOM 718 CA LYS A 52 -7.859 3.154 -5.524 1.00 0.31 C ATOM 719 C LYS A 52 -8.045 4.525 -6.107 1.00 53.41 C ATOM 720 O LYS A 52 -8.628 4.693 -7.178 1.00 40.33 O ATOM 721 CB LYS A 52 -8.915 2.918 -4.443 1.00 73.04 C ATOM 722 CG LYS A 52 -8.849 1.552 -3.776 1.00 51.01 C ATOM 723 CD LYS A 52 -9.121 0.410 -4.750 1.00 54.31 C ATOM 724 CE LYS A 52 -10.530 0.480 -5.327 1.00 22.33 C ATOM 725 NZ LYS A 52 -10.796 -0.646 -6.228 1.00 21.42 N ATOM 0 H LYS A 52 -6.490 3.213 -3.955 1.00 51.24 H new ATOM 0 HA LYS A 52 -7.971 2.411 -6.314 1.00 0.31 H new ATOM 0 HB2 LYS A 52 -8.809 3.686 -3.677 1.00 73.04 H new ATOM 0 HB3 LYS A 52 -9.903 3.043 -4.886 1.00 73.04 H new ATOM 0 HG2 LYS A 52 -7.864 1.417 -3.330 1.00 51.01 H new ATOM 0 HG3 LYS A 52 -9.575 1.513 -2.964 1.00 51.01 H new ATOM 0 HD2 LYS A 52 -8.394 0.444 -5.562 1.00 54.31 H new ATOM 0 HD3 LYS A 52 -8.985 -0.543 -4.239 1.00 54.31 H new ATOM 0 HE2 LYS A 52 -11.258 0.478 -4.515 1.00 22.33 H new ATOM 0 HE3 LYS A 52 -10.657 1.418 -5.867 1.00 22.33 H new ATOM 0 HZ1 LYS A 52 -11.763 -0.569 -6.604 1.00 21.42 H new ATOM 0 HZ2 LYS A 52 -10.116 -0.629 -7.015 1.00 21.42 H new ATOM 0 HZ3 LYS A 52 -10.698 -1.540 -5.705 1.00 21.42 H new ATOM 739 N ARG A 53 -7.521 5.492 -5.423 1.00 25.50 N ATOM 740 CA ARG A 53 -7.713 6.866 -5.806 1.00 51.43 C ATOM 741 C ARG A 53 -6.473 7.614 -5.421 1.00 51.44 C ATOM 742 O ARG A 53 -5.893 7.324 -4.376 1.00 14.10 O ATOM 743 CB ARG A 53 -8.923 7.437 -5.053 1.00 65.02 C ATOM 744 CG ARG A 53 -9.451 8.794 -5.537 1.00 10.41 C ATOM 745 CD ARG A 53 -10.122 8.710 -6.917 1.00 31.00 C ATOM 746 NE ARG A 53 -9.165 8.607 -8.017 1.00 64.34 N ATOM 747 CZ ARG A 53 -9.251 7.782 -9.065 1.00 54.44 C ATOM 748 NH1 ARG A 53 -10.258 6.914 -9.171 1.00 3.30 N ATOM 749 NH2 ARG A 53 -8.335 7.847 -10.015 1.00 11.21 N ATOM 0 H ARG A 53 -6.951 5.359 -4.588 1.00 25.50 H new ATOM 0 HA ARG A 53 -7.896 6.954 -6.877 1.00 51.43 H new ATOM 0 HB2 ARG A 53 -9.736 6.713 -5.114 1.00 65.02 H new ATOM 0 HB3 ARG A 53 -8.657 7.530 -4.000 1.00 65.02 H new ATOM 0 HG2 ARG A 53 -10.167 9.180 -4.812 1.00 10.41 H new ATOM 0 HG3 ARG A 53 -8.627 9.506 -5.581 1.00 10.41 H new ATOM 0 HD2 ARG A 53 -10.786 7.846 -6.939 1.00 31.00 H new ATOM 0 HD3 ARG A 53 -10.743 9.593 -7.066 1.00 31.00 H new ATOM 0 HE ARG A 53 -8.354 9.224 -7.981 1.00 64.34 H new ATOM 0 HH11 ARG A 53 -10.975 6.874 -8.447 1.00 3.30 H new ATOM 0 HH12 ARG A 53 -10.311 6.290 -9.976 1.00 3.30 H new ATOM 0 HH21 ARG A 53 -7.573 8.521 -9.944 1.00 11.21 H new ATOM 0 HH22 ARG A 53 -8.390 7.223 -10.820 1.00 11.21 H new ATOM 763 N GLY A 54 -6.049 8.527 -6.254 1.00 41.34 N ATOM 764 CA GLY A 54 -4.871 9.291 -5.981 1.00 53.24 C ATOM 765 C GLY A 54 -3.963 9.352 -7.181 1.00 73.34 C ATOM 766 O GLY A 54 -4.299 8.805 -8.228 1.00 73.35 O ATOM 0 H GLY A 54 -6.510 8.758 -7.134 1.00 41.34 H new ATOM 0 HA2 GLY A 54 -5.152 10.301 -5.684 1.00 53.24 H new ATOM 0 HA3 GLY A 54 -4.336 8.849 -5.140 1.00 53.24 H new ATOM 770 N PRO A 55 -2.791 9.984 -7.063 1.00 61.44 N ATOM 771 CA PRO A 55 -1.833 10.102 -8.176 1.00 4.44 C ATOM 772 C PRO A 55 -1.369 8.734 -8.675 1.00 53.35 C ATOM 773 O PRO A 55 -1.178 8.521 -9.867 1.00 2.21 O ATOM 774 CB PRO A 55 -0.653 10.849 -7.547 1.00 62.01 C ATOM 775 CG PRO A 55 -1.232 11.559 -6.377 1.00 23.41 C ATOM 776 CD PRO A 55 -2.309 10.670 -5.851 1.00 52.41 C ATOM 0 HA PRO A 55 -2.269 10.604 -9.040 1.00 4.44 H new ATOM 0 HB2 PRO A 55 0.134 10.159 -7.241 1.00 62.01 H new ATOM 0 HB3 PRO A 55 -0.207 11.549 -8.253 1.00 62.01 H new ATOM 0 HG2 PRO A 55 -0.473 11.744 -5.617 1.00 23.41 H new ATOM 0 HG3 PRO A 55 -1.634 12.529 -6.669 1.00 23.41 H new ATOM 0 HD2 PRO A 55 -1.926 9.965 -5.113 1.00 52.41 H new ATOM 0 HD3 PRO A 55 -3.102 11.239 -5.367 1.00 52.41 H new ATOM 784 N ASN A 56 -1.205 7.812 -7.750 1.00 22.45 N ATOM 785 CA ASN A 56 -0.732 6.473 -8.051 1.00 31.24 C ATOM 786 C ASN A 56 -1.907 5.496 -8.270 1.00 64.35 C ATOM 787 O ASN A 56 -1.710 4.284 -8.287 1.00 22.12 O ATOM 788 CB ASN A 56 0.123 5.986 -6.868 1.00 24.41 C ATOM 789 CG ASN A 56 1.204 6.981 -6.472 1.00 11.44 C ATOM 790 OD1 ASN A 56 0.971 7.882 -5.652 1.00 54.11 O ATOM 791 ND2 ASN A 56 2.367 6.847 -7.028 1.00 70.24 N ATOM 0 H ASN A 56 -1.397 7.969 -6.761 1.00 22.45 H new ATOM 0 HA ASN A 56 -0.147 6.503 -8.970 1.00 31.24 H new ATOM 0 HB2 ASN A 56 -0.524 5.799 -6.011 1.00 24.41 H new ATOM 0 HB3 ASN A 56 0.589 5.036 -7.129 1.00 24.41 H new ATOM 0 HD21 ASN A 56 3.121 7.493 -6.795 1.00 70.24 H new ATOM 0 HD22 ASN A 56 2.528 6.096 -7.699 1.00 70.24 H new ATOM 798 N ALA A 57 -3.120 6.029 -8.456 1.00 42.14 N ATOM 799 CA ALA A 57 -4.336 5.201 -8.593 1.00 61.12 C ATOM 800 C ALA A 57 -4.254 4.224 -9.751 1.00 41.45 C ATOM 801 O ALA A 57 -3.842 4.581 -10.860 1.00 14.20 O ATOM 802 CB ALA A 57 -5.573 6.060 -8.744 1.00 2.44 C ATOM 0 H ALA A 57 -3.292 7.033 -8.516 1.00 42.14 H new ATOM 0 HA ALA A 57 -4.407 4.622 -7.672 1.00 61.12 H new ATOM 0 HB1 ALA A 57 -6.450 5.421 -8.843 1.00 2.44 H new ATOM 0 HB2 ALA A 57 -5.684 6.696 -7.865 1.00 2.44 H new ATOM 0 HB3 ALA A 57 -5.477 6.683 -9.633 1.00 2.44 H new ATOM 808 N GLY A 58 -4.641 3.003 -9.493 1.00 64.44 N ATOM 809 CA GLY A 58 -4.630 1.984 -10.506 1.00 43.04 C ATOM 810 C GLY A 58 -3.439 1.071 -10.371 1.00 40.14 C ATOM 811 O GLY A 58 -3.453 -0.059 -10.869 1.00 25.41 O ATOM 0 H GLY A 58 -4.971 2.689 -8.580 1.00 64.44 H new ATOM 0 HA2 GLY A 58 -5.546 1.397 -10.441 1.00 43.04 H new ATOM 0 HA3 GLY A 58 -4.620 2.451 -11.491 1.00 43.04 H new ATOM 815 N ALA A 59 -2.415 1.546 -9.698 1.00 2.22 N ATOM 816 CA ALA A 59 -1.214 0.774 -9.514 1.00 41.45 C ATOM 817 C ALA A 59 -1.303 -0.052 -8.242 1.00 73.04 C ATOM 818 O ALA A 59 -2.054 0.293 -7.309 1.00 1.41 O ATOM 819 CB ALA A 59 0.008 1.680 -9.480 1.00 12.44 C ATOM 0 H ALA A 59 -2.394 2.470 -9.268 1.00 2.22 H new ATOM 0 HA ALA A 59 -1.110 0.094 -10.360 1.00 41.45 H new ATOM 0 HB1 ALA A 59 0.905 1.076 -9.340 1.00 12.44 H new ATOM 0 HB2 ALA A 59 0.082 2.227 -10.420 1.00 12.44 H new ATOM 0 HB3 ALA A 59 -0.086 2.387 -8.655 1.00 12.44 H new ATOM 825 N ARG A 60 -0.565 -1.133 -8.205 1.00 24.34 N ATOM 826 CA ARG A 60 -0.532 -1.978 -7.037 1.00 33.15 C ATOM 827 C ARG A 60 0.907 -2.245 -6.664 1.00 72.41 C ATOM 828 O ARG A 60 1.771 -2.346 -7.541 1.00 21.44 O ATOM 829 CB ARG A 60 -1.313 -3.321 -7.217 1.00 3.31 C ATOM 830 CG ARG A 60 -0.668 -4.395 -8.121 1.00 75.31 C ATOM 831 CD ARG A 60 -0.621 -3.997 -9.589 1.00 40.13 C ATOM 832 NE ARG A 60 -1.965 -3.787 -10.146 1.00 44.24 N ATOM 833 CZ ARG A 60 -2.234 -3.559 -11.437 1.00 62.21 C ATOM 834 NH1 ARG A 60 -1.256 -3.516 -12.326 1.00 60.12 N ATOM 835 NH2 ARG A 60 -3.488 -3.378 -11.828 1.00 0.34 N ATOM 0 H ARG A 60 0.024 -1.450 -8.975 1.00 24.34 H new ATOM 0 HA ARG A 60 -1.042 -1.446 -6.234 1.00 33.15 H new ATOM 0 HB2 ARG A 60 -1.467 -3.758 -6.230 1.00 3.31 H new ATOM 0 HB3 ARG A 60 -2.299 -3.088 -7.620 1.00 3.31 H new ATOM 0 HG2 ARG A 60 0.346 -4.592 -7.773 1.00 75.31 H new ATOM 0 HG3 ARG A 60 -1.226 -5.326 -8.022 1.00 75.31 H new ATOM 0 HD2 ARG A 60 -0.036 -3.084 -9.698 1.00 40.13 H new ATOM 0 HD3 ARG A 60 -0.110 -4.773 -10.159 1.00 40.13 H new ATOM 0 HE ARG A 60 -2.753 -3.817 -9.499 1.00 44.24 H new ATOM 0 HH11 ARG A 60 -0.290 -3.657 -12.029 1.00 60.12 H new ATOM 0 HH12 ARG A 60 -1.467 -3.342 -13.309 1.00 60.12 H new ATOM 0 HH21 ARG A 60 -4.245 -3.413 -11.145 1.00 0.34 H new ATOM 0 HH22 ARG A 60 -3.696 -3.204 -12.811 1.00 0.34 H new ATOM 849 N PHE A 61 1.170 -2.330 -5.398 1.00 63.22 N ATOM 850 CA PHE A 61 2.505 -2.593 -4.912 1.00 22.24 C ATOM 851 C PHE A 61 2.484 -3.897 -4.161 1.00 43.33 C ATOM 852 O PHE A 61 1.535 -4.157 -3.416 1.00 3.44 O ATOM 853 CB PHE A 61 2.978 -1.464 -4.001 1.00 44.54 C ATOM 854 CG PHE A 61 2.989 -0.107 -4.648 1.00 40.30 C ATOM 855 CD1 PHE A 61 4.068 0.303 -5.413 1.00 12.42 C ATOM 856 CD2 PHE A 61 1.917 0.758 -4.488 1.00 15.31 C ATOM 857 CE1 PHE A 61 4.077 1.548 -6.004 1.00 14.14 C ATOM 858 CE2 PHE A 61 1.924 2.003 -5.076 1.00 2.03 C ATOM 859 CZ PHE A 61 3.003 2.397 -5.834 1.00 41.15 C ATOM 0 H PHE A 61 0.470 -2.220 -4.664 1.00 63.22 H new ATOM 0 HA PHE A 61 3.198 -2.654 -5.751 1.00 22.24 H new ATOM 0 HB2 PHE A 61 2.334 -1.429 -3.122 1.00 44.54 H new ATOM 0 HB3 PHE A 61 3.984 -1.694 -3.650 1.00 44.54 H new ATOM 0 HD1 PHE A 61 4.910 -0.359 -5.548 1.00 12.42 H new ATOM 0 HD2 PHE A 61 1.067 0.452 -3.896 1.00 15.31 H new ATOM 0 HE1 PHE A 61 4.923 1.858 -6.599 1.00 14.14 H new ATOM 0 HE2 PHE A 61 1.084 2.669 -4.943 1.00 2.03 H new ATOM 0 HZ PHE A 61 3.009 3.373 -6.297 1.00 41.15 H new ATOM 869 N LEU A 62 3.487 -4.710 -4.347 1.00 51.45 N ATOM 870 CA LEU A 62 3.509 -6.016 -3.746 1.00 74.55 C ATOM 871 C LEU A 62 4.620 -6.112 -2.692 1.00 40.11 C ATOM 872 O LEU A 62 5.797 -5.801 -2.947 1.00 15.24 O ATOM 873 CB LEU A 62 3.615 -7.097 -4.862 1.00 41.11 C ATOM 874 CG LEU A 62 3.444 -8.588 -4.472 1.00 53.22 C ATOM 875 CD1 LEU A 62 3.103 -9.401 -5.708 1.00 1.04 C ATOM 876 CD2 LEU A 62 4.716 -9.153 -3.862 1.00 1.53 C ATOM 0 H LEU A 62 4.306 -4.489 -4.914 1.00 51.45 H new ATOM 0 HA LEU A 62 2.578 -6.198 -3.209 1.00 74.55 H new ATOM 0 HB2 LEU A 62 2.866 -6.865 -5.619 1.00 41.11 H new ATOM 0 HB3 LEU A 62 4.591 -6.989 -5.336 1.00 41.11 H new ATOM 0 HG LEU A 62 2.643 -8.648 -3.736 1.00 53.22 H new ATOM 0 HD11 LEU A 62 2.983 -10.449 -5.433 1.00 1.04 H new ATOM 0 HD12 LEU A 62 2.174 -9.031 -6.142 1.00 1.04 H new ATOM 0 HD13 LEU A 62 3.907 -9.308 -6.438 1.00 1.04 H new ATOM 0 HD21 LEU A 62 4.560 -10.200 -3.601 1.00 1.53 H new ATOM 0 HD22 LEU A 62 5.530 -9.076 -4.582 1.00 1.53 H new ATOM 0 HD23 LEU A 62 4.971 -8.589 -2.965 1.00 1.53 H new ATOM 888 N LEU A 63 4.227 -6.527 -1.517 1.00 33.42 N ATOM 889 CA LEU A 63 5.111 -6.704 -0.398 1.00 54.11 C ATOM 890 C LEU A 63 5.534 -8.153 -0.348 1.00 41.01 C ATOM 891 O LEU A 63 4.690 -9.047 -0.177 1.00 4.42 O ATOM 892 CB LEU A 63 4.425 -6.352 0.947 1.00 60.24 C ATOM 893 CG LEU A 63 3.863 -4.927 1.153 1.00 63.11 C ATOM 894 CD1 LEU A 63 4.877 -3.857 0.808 1.00 45.24 C ATOM 895 CD2 LEU A 63 2.550 -4.712 0.421 1.00 73.52 C ATOM 0 H LEU A 63 3.256 -6.757 -1.307 1.00 33.42 H new ATOM 0 HA LEU A 63 5.963 -6.037 -0.532 1.00 54.11 H new ATOM 0 HB2 LEU A 63 3.603 -7.053 1.090 1.00 60.24 H new ATOM 0 HB3 LEU A 63 5.146 -6.539 1.743 1.00 60.24 H new ATOM 0 HG LEU A 63 3.650 -4.834 2.218 1.00 63.11 H new ATOM 0 HD11 LEU A 63 4.436 -2.873 0.968 1.00 45.24 H new ATOM 0 HD12 LEU A 63 5.755 -3.969 1.444 1.00 45.24 H new ATOM 0 HD13 LEU A 63 5.170 -3.957 -0.237 1.00 45.24 H new ATOM 0 HD21 LEU A 63 2.197 -3.696 0.598 1.00 73.52 H new ATOM 0 HD22 LEU A 63 2.700 -4.863 -0.648 1.00 73.52 H new ATOM 0 HD23 LEU A 63 1.809 -5.422 0.787 1.00 73.52 H new ATOM 907 N ASP A 64 6.797 -8.389 -0.554 1.00 3.23 N ATOM 908 CA ASP A 64 7.354 -9.734 -0.487 1.00 12.12 C ATOM 909 C ASP A 64 8.650 -9.702 0.327 1.00 15.13 C ATOM 910 O ASP A 64 9.335 -10.707 0.512 1.00 12.04 O ATOM 911 CB ASP A 64 7.602 -10.253 -1.918 1.00 1.10 C ATOM 912 CG ASP A 64 8.205 -11.633 -1.979 1.00 74.35 C ATOM 913 OD1 ASP A 64 7.476 -12.640 -1.768 1.00 32.11 O ATOM 914 OD2 ASP A 64 9.422 -11.745 -2.241 1.00 1.33 O ATOM 0 H ASP A 64 7.480 -7.664 -0.774 1.00 3.23 H new ATOM 0 HA ASP A 64 6.657 -10.411 0.006 1.00 12.12 H new ATOM 0 HB2 ASP A 64 6.656 -10.258 -2.460 1.00 1.10 H new ATOM 0 HB3 ASP A 64 8.262 -9.557 -2.436 1.00 1.10 H new ATOM 919 N GLN A 65 8.940 -8.548 0.853 1.00 4.43 N ATOM 920 CA GLN A 65 10.168 -8.314 1.559 1.00 14.02 C ATOM 921 C GLN A 65 9.892 -7.863 2.982 1.00 3.54 C ATOM 922 O GLN A 65 8.924 -7.127 3.220 1.00 2.42 O ATOM 923 CB GLN A 65 11.089 -7.304 0.815 1.00 24.51 C ATOM 924 CG GLN A 65 10.460 -5.961 0.407 1.00 53.42 C ATOM 925 CD GLN A 65 9.428 -6.066 -0.719 1.00 42.31 C ATOM 926 OE1 GLN A 65 9.512 -6.935 -1.592 1.00 2.45 O ATOM 927 NE2 GLN A 65 8.432 -5.226 -0.676 1.00 72.30 N ATOM 0 H GLN A 65 8.326 -7.735 0.804 1.00 4.43 H new ATOM 0 HA GLN A 65 10.706 -9.261 1.598 1.00 14.02 H new ATOM 0 HB2 GLN A 65 11.949 -7.097 1.451 1.00 24.51 H new ATOM 0 HB3 GLN A 65 11.468 -7.789 -0.085 1.00 24.51 H new ATOM 0 HG2 GLN A 65 9.984 -5.516 1.280 1.00 53.42 H new ATOM 0 HG3 GLN A 65 11.253 -5.281 0.095 1.00 53.42 H new ATOM 0 HE21 GLN A 65 8.392 -4.519 0.059 1.00 72.30 H new ATOM 0 HE22 GLN A 65 7.693 -5.275 -1.377 1.00 72.30 H new ATOM 936 N PRO A 66 10.736 -8.306 3.949 1.00 3.43 N ATOM 937 CA PRO A 66 10.583 -7.985 5.379 1.00 75.42 C ATOM 938 C PRO A 66 10.516 -6.489 5.695 1.00 12.55 C ATOM 939 O PRO A 66 9.987 -6.096 6.740 1.00 5.33 O ATOM 940 CB PRO A 66 11.830 -8.598 6.029 1.00 25.32 C ATOM 941 CG PRO A 66 12.226 -9.691 5.111 1.00 40.44 C ATOM 942 CD PRO A 66 11.903 -9.200 3.729 1.00 60.42 C ATOM 0 HA PRO A 66 9.635 -8.376 5.749 1.00 75.42 H new ATOM 0 HB2 PRO A 66 12.626 -7.861 6.135 1.00 25.32 H new ATOM 0 HB3 PRO A 66 11.612 -8.977 7.027 1.00 25.32 H new ATOM 0 HG2 PRO A 66 13.288 -9.918 5.207 1.00 40.44 H new ATOM 0 HG3 PRO A 66 11.682 -10.608 5.337 1.00 40.44 H new ATOM 0 HD2 PRO A 66 12.742 -8.664 3.286 1.00 60.42 H new ATOM 0 HD3 PRO A 66 11.659 -10.022 3.057 1.00 60.42 H new ATOM 950 N THR A 67 11.064 -5.649 4.845 1.00 45.34 N ATOM 951 CA THR A 67 11.023 -4.225 5.092 1.00 35.53 C ATOM 952 C THR A 67 10.865 -3.449 3.775 1.00 1.10 C ATOM 953 O THR A 67 11.663 -3.575 2.860 1.00 44.03 O ATOM 954 CB THR A 67 12.289 -3.779 5.872 1.00 52.21 C ATOM 955 OG1 THR A 67 12.375 -4.547 7.103 1.00 60.15 O ATOM 956 CG2 THR A 67 12.234 -2.291 6.214 1.00 63.21 C ATOM 0 H THR A 67 11.539 -5.923 3.985 1.00 45.34 H new ATOM 0 HA THR A 67 10.153 -3.999 5.709 1.00 35.53 H new ATOM 0 HB THR A 67 13.163 -3.954 5.245 1.00 52.21 H new ATOM 0 HG1 THR A 67 13.172 -4.275 7.603 1.00 60.15 H new ATOM 0 HG21 THR A 67 13.135 -2.010 6.760 1.00 63.21 H new ATOM 0 HG22 THR A 67 12.170 -1.709 5.295 1.00 63.21 H new ATOM 0 HG23 THR A 67 11.358 -2.092 6.832 1.00 63.21 H new ATOM 964 N THR A 68 9.817 -2.677 3.691 1.00 3.42 N ATOM 965 CA THR A 68 9.506 -1.910 2.512 1.00 73.15 C ATOM 966 C THR A 68 9.239 -0.453 2.922 1.00 63.41 C ATOM 967 O THR A 68 8.343 -0.203 3.701 1.00 10.40 O ATOM 968 CB THR A 68 8.228 -2.498 1.885 1.00 1.21 C ATOM 969 OG1 THR A 68 8.353 -3.926 1.796 1.00 0.31 O ATOM 970 CG2 THR A 68 8.006 -1.952 0.505 1.00 74.04 C ATOM 0 H THR A 68 9.144 -2.560 4.449 1.00 3.42 H new ATOM 0 HA THR A 68 10.332 -1.945 1.801 1.00 73.15 H new ATOM 0 HB THR A 68 7.383 -2.225 2.517 1.00 1.21 H new ATOM 0 HG1 THR A 68 7.744 -4.348 2.437 1.00 0.31 H new ATOM 0 HG21 THR A 68 7.097 -2.383 0.085 1.00 74.04 H new ATOM 0 HG22 THR A 68 7.904 -0.868 0.555 1.00 74.04 H new ATOM 0 HG23 THR A 68 8.855 -2.208 -0.128 1.00 74.04 H new ATOM 978 N THR A 69 10.002 0.487 2.422 1.00 73.21 N ATOM 979 CA THR A 69 9.818 1.874 2.814 1.00 41.41 C ATOM 980 C THR A 69 8.776 2.567 1.932 1.00 53.21 C ATOM 981 O THR A 69 8.718 2.323 0.720 1.00 23.15 O ATOM 982 CB THR A 69 11.154 2.662 2.771 1.00 2.52 C ATOM 983 OG1 THR A 69 11.739 2.609 1.450 1.00 64.20 O ATOM 984 CG2 THR A 69 12.141 2.099 3.780 1.00 2.34 C ATOM 0 H THR A 69 10.751 0.326 1.749 1.00 73.21 H new ATOM 0 HA THR A 69 9.457 1.867 3.842 1.00 41.41 H new ATOM 0 HB THR A 69 10.935 3.700 3.023 1.00 2.52 H new ATOM 0 HG1 THR A 69 11.948 1.679 1.222 1.00 64.20 H new ATOM 0 HG21 THR A 69 13.071 2.665 3.734 1.00 2.34 H new ATOM 0 HG22 THR A 69 11.719 2.174 4.782 1.00 2.34 H new ATOM 0 HG23 THR A 69 12.341 1.053 3.548 1.00 2.34 H new ATOM 992 N ALA A 70 7.948 3.393 2.527 1.00 31.24 N ATOM 993 CA ALA A 70 6.956 4.129 1.790 1.00 71.34 C ATOM 994 C ALA A 70 7.169 5.604 1.994 1.00 63.22 C ATOM 995 O ALA A 70 7.430 6.061 3.138 1.00 22.31 O ATOM 996 CB ALA A 70 5.562 3.734 2.223 1.00 22.02 C ATOM 0 H ALA A 70 7.945 3.571 3.531 1.00 31.24 H new ATOM 0 HA ALA A 70 7.059 3.894 0.731 1.00 71.34 H new ATOM 0 HB1 ALA A 70 4.829 4.303 1.652 1.00 22.02 H new ATOM 0 HB2 ALA A 70 5.414 2.669 2.044 1.00 22.02 H new ATOM 0 HB3 ALA A 70 5.438 3.944 3.285 1.00 22.02 H new ATOM 1002 N GLY A 71 7.093 6.341 0.917 1.00 42.13 N ATOM 1003 CA GLY A 71 7.289 7.747 0.977 1.00 41.52 C ATOM 1004 C GLY A 71 7.091 8.385 -0.367 1.00 31.13 C ATOM 1005 O GLY A 71 6.499 7.782 -1.278 1.00 0.32 O ATOM 0 H GLY A 71 6.895 5.977 -0.015 1.00 42.13 H new ATOM 0 HA2 GLY A 71 6.593 8.183 1.694 1.00 41.52 H new ATOM 0 HA3 GLY A 71 8.295 7.961 1.338 1.00 41.52 H new ATOM 1009 N ARG A 72 7.602 9.571 -0.508 1.00 44.03 N ATOM 1010 CA ARG A 72 7.454 10.333 -1.714 1.00 5.22 C ATOM 1011 C ARG A 72 8.779 10.257 -2.455 1.00 41.51 C ATOM 1012 O ARG A 72 9.838 10.267 -1.816 1.00 10.30 O ATOM 1013 CB ARG A 72 7.094 11.779 -1.331 1.00 70.22 C ATOM 1014 CG ARG A 72 6.269 12.585 -2.344 1.00 73.14 C ATOM 1015 CD ARG A 72 7.027 13.012 -3.585 1.00 74.24 C ATOM 1016 NE ARG A 72 6.211 13.901 -4.426 1.00 72.42 N ATOM 1017 CZ ARG A 72 6.413 15.224 -4.571 1.00 74.22 C ATOM 1018 NH1 ARG A 72 7.519 15.802 -4.092 1.00 50.54 N ATOM 1019 NH2 ARG A 72 5.535 15.940 -5.256 1.00 12.20 N ATOM 0 H ARG A 72 8.140 10.043 0.219 1.00 44.03 H new ATOM 0 HA ARG A 72 6.662 9.950 -2.358 1.00 5.22 H new ATOM 0 HB2 ARG A 72 6.544 11.753 -0.391 1.00 70.22 H new ATOM 0 HB3 ARG A 72 8.021 12.320 -1.143 1.00 70.22 H new ATOM 0 HG2 ARG A 72 5.409 11.988 -2.648 1.00 73.14 H new ATOM 0 HG3 ARG A 72 5.880 13.475 -1.849 1.00 73.14 H new ATOM 0 HD2 ARG A 72 7.946 13.522 -3.296 1.00 74.24 H new ATOM 0 HD3 ARG A 72 7.318 12.131 -4.158 1.00 74.24 H new ATOM 0 HE ARG A 72 5.434 13.484 -4.938 1.00 72.42 H new ATOM 0 HH11 ARG A 72 8.221 15.240 -3.611 1.00 50.54 H new ATOM 0 HH12 ARG A 72 7.661 16.805 -4.208 1.00 50.54 H new ATOM 0 HH21 ARG A 72 4.718 15.488 -5.666 1.00 12.20 H new ATOM 0 HH22 ARG A 72 5.676 16.943 -5.373 1.00 12.20 H new ATOM 1033 N HIS A 73 8.701 10.166 -3.783 1.00 3.14 N ATOM 1034 CA HIS A 73 9.854 9.997 -4.703 1.00 72.33 C ATOM 1035 C HIS A 73 10.284 8.534 -4.741 1.00 61.24 C ATOM 1036 O HIS A 73 10.191 7.836 -3.732 1.00 74.11 O ATOM 1037 CB HIS A 73 11.071 10.929 -4.413 1.00 74.40 C ATOM 1038 CG HIS A 73 10.790 12.390 -4.555 1.00 74.34 C ATOM 1039 ND1 HIS A 73 10.945 13.106 -5.726 1.00 64.31 N ATOM 1040 CD2 HIS A 73 10.351 13.274 -3.636 1.00 62.22 C ATOM 1041 CE1 HIS A 73 10.597 14.374 -5.478 1.00 13.33 C ATOM 1042 NE2 HIS A 73 10.226 14.525 -4.217 1.00 0.32 N ATOM 0 H HIS A 73 7.809 10.208 -4.276 1.00 3.14 H new ATOM 0 HA HIS A 73 9.495 10.309 -5.684 1.00 72.33 H new ATOM 0 HB2 HIS A 73 11.423 10.738 -3.399 1.00 74.40 H new ATOM 0 HB3 HIS A 73 11.884 10.662 -5.089 1.00 74.40 H new ATOM 0 HD1 HIS A 73 11.267 12.735 -6.620 1.00 64.31 H new ATOM 0 HD2 HIS A 73 10.131 13.042 -2.605 1.00 62.22 H new ATOM 0 HE1 HIS A 73 10.616 15.168 -6.210 1.00 13.33 H new ATOM 1050 N PRO A 74 10.758 8.032 -5.907 1.00 15.41 N ATOM 1051 CA PRO A 74 11.175 6.611 -6.085 1.00 51.11 C ATOM 1052 C PRO A 74 12.423 6.207 -5.270 1.00 42.54 C ATOM 1053 O PRO A 74 13.053 5.174 -5.539 1.00 23.04 O ATOM 1054 CB PRO A 74 11.478 6.521 -7.587 1.00 42.20 C ATOM 1055 CG PRO A 74 10.766 7.678 -8.182 1.00 13.02 C ATOM 1056 CD PRO A 74 10.891 8.770 -7.176 1.00 24.21 C ATOM 0 HA PRO A 74 10.398 5.934 -5.730 1.00 51.11 H new ATOM 0 HB2 PRO A 74 12.550 6.573 -7.779 1.00 42.20 H new ATOM 0 HB3 PRO A 74 11.125 5.579 -8.007 1.00 42.20 H new ATOM 0 HG2 PRO A 74 11.210 7.967 -9.135 1.00 13.02 H new ATOM 0 HG3 PRO A 74 9.720 7.440 -8.377 1.00 13.02 H new ATOM 0 HD2 PRO A 74 11.848 9.286 -7.250 1.00 24.21 H new ATOM 0 HD3 PRO A 74 10.113 9.524 -7.293 1.00 24.21 H new ATOM 1064 N GLU A 75 12.756 6.998 -4.279 1.00 52.35 N ATOM 1065 CA GLU A 75 13.861 6.713 -3.401 1.00 52.45 C ATOM 1066 C GLU A 75 13.399 5.643 -2.425 1.00 34.52 C ATOM 1067 O GLU A 75 14.183 4.833 -1.942 1.00 43.13 O ATOM 1068 CB GLU A 75 14.273 7.973 -2.631 1.00 2.32 C ATOM 1069 CG GLU A 75 14.505 9.201 -3.507 1.00 44.54 C ATOM 1070 CD GLU A 75 15.518 8.969 -4.599 1.00 40.10 C ATOM 1071 OE1 GLU A 75 16.737 9.094 -4.342 1.00 12.11 O ATOM 1072 OE2 GLU A 75 15.117 8.678 -5.734 1.00 65.42 O ATOM 0 H GLU A 75 12.263 7.864 -4.059 1.00 52.35 H new ATOM 0 HA GLU A 75 14.723 6.374 -3.975 1.00 52.45 H new ATOM 0 HB2 GLU A 75 13.500 8.205 -1.899 1.00 2.32 H new ATOM 0 HB3 GLU A 75 15.186 7.761 -2.074 1.00 2.32 H new ATOM 0 HG2 GLU A 75 13.559 9.503 -3.956 1.00 44.54 H new ATOM 0 HG3 GLU A 75 14.839 10.028 -2.881 1.00 44.54 H new ATOM 1079 N SER A 76 12.110 5.648 -2.167 1.00 61.41 N ATOM 1080 CA SER A 76 11.480 4.689 -1.313 1.00 40.34 C ATOM 1081 C SER A 76 10.889 3.558 -2.157 1.00 14.41 C ATOM 1082 O SER A 76 10.583 3.760 -3.346 1.00 25.31 O ATOM 1083 CB SER A 76 10.414 5.391 -0.477 1.00 50.33 C ATOM 1084 OG SER A 76 11.013 6.452 0.267 1.00 30.05 O ATOM 0 H SER A 76 11.465 6.336 -2.557 1.00 61.41 H new ATOM 0 HA SER A 76 12.209 4.247 -0.634 1.00 40.34 H new ATOM 0 HB2 SER A 76 9.630 5.784 -1.124 1.00 50.33 H new ATOM 0 HB3 SER A 76 9.941 4.680 0.200 1.00 50.33 H new ATOM 0 HG SER A 76 10.328 6.904 0.802 1.00 30.05 H new ATOM 1090 N ASP A 77 10.780 2.374 -1.553 1.00 64.40 N ATOM 1091 CA ASP A 77 10.271 1.157 -2.224 1.00 53.14 C ATOM 1092 C ASP A 77 8.890 1.405 -2.794 1.00 61.42 C ATOM 1093 O ASP A 77 8.598 1.052 -3.938 1.00 14.13 O ATOM 1094 CB ASP A 77 10.154 -0.014 -1.242 1.00 11.35 C ATOM 1095 CG ASP A 77 11.432 -0.429 -0.568 1.00 33.12 C ATOM 1096 OD1 ASP A 77 11.835 0.228 0.423 1.00 60.42 O ATOM 1097 OD2 ASP A 77 12.021 -1.450 -0.956 1.00 23.21 O ATOM 0 H ASP A 77 11.041 2.222 -0.579 1.00 64.40 H new ATOM 0 HA ASP A 77 10.981 0.912 -3.014 1.00 53.14 H new ATOM 0 HB2 ASP A 77 9.429 0.252 -0.473 1.00 11.35 H new ATOM 0 HB3 ASP A 77 9.751 -0.874 -1.777 1.00 11.35 H new ATOM 1102 N ILE A 78 8.040 1.988 -1.988 1.00 61.32 N ATOM 1103 CA ILE A 78 6.701 2.320 -2.405 1.00 31.14 C ATOM 1104 C ILE A 78 6.677 3.792 -2.781 1.00 63.03 C ATOM 1105 O ILE A 78 6.823 4.661 -1.910 1.00 14.13 O ATOM 1106 CB ILE A 78 5.657 2.081 -1.267 1.00 54.10 C ATOM 1107 CG1 ILE A 78 5.763 0.661 -0.688 1.00 20.51 C ATOM 1108 CG2 ILE A 78 4.238 2.331 -1.772 1.00 74.03 C ATOM 1109 CD1 ILE A 78 5.504 -0.451 -1.683 1.00 22.30 C ATOM 0 H ILE A 78 8.256 2.246 -1.025 1.00 61.32 H new ATOM 0 HA ILE A 78 6.433 1.681 -3.246 1.00 31.14 H new ATOM 0 HB ILE A 78 5.882 2.790 -0.470 1.00 54.10 H new ATOM 0 HG12 ILE A 78 6.760 0.529 -0.268 1.00 20.51 H new ATOM 0 HG13 ILE A 78 5.055 0.565 0.135 1.00 20.51 H new ATOM 0 HG21 ILE A 78 3.528 2.159 -0.963 1.00 74.03 H new ATOM 0 HG22 ILE A 78 4.151 3.361 -2.118 1.00 74.03 H new ATOM 0 HG23 ILE A 78 4.020 1.652 -2.596 1.00 74.03 H new ATOM 0 HD11 ILE A 78 5.601 -1.415 -1.184 1.00 22.30 H new ATOM 0 HD12 ILE A 78 4.496 -0.351 -2.087 1.00 22.30 H new ATOM 0 HD13 ILE A 78 6.228 -0.388 -2.495 1.00 22.30 H new ATOM 1121 N PHE A 79 6.549 4.068 -4.057 1.00 52.12 N ATOM 1122 CA PHE A 79 6.462 5.424 -4.526 1.00 43.31 C ATOM 1123 C PHE A 79 5.031 5.898 -4.514 1.00 70.24 C ATOM 1124 O PHE A 79 4.181 5.373 -5.233 1.00 42.13 O ATOM 1125 CB PHE A 79 7.066 5.600 -5.934 1.00 74.24 C ATOM 1126 CG PHE A 79 6.730 6.939 -6.565 1.00 14.13 C ATOM 1127 CD1 PHE A 79 7.199 8.113 -6.020 1.00 51.13 C ATOM 1128 CD2 PHE A 79 5.906 7.010 -7.677 1.00 74.42 C ATOM 1129 CE1 PHE A 79 6.865 9.333 -6.570 1.00 4.12 C ATOM 1130 CE2 PHE A 79 5.566 8.230 -8.226 1.00 21.33 C ATOM 1131 CZ PHE A 79 6.047 9.390 -7.674 1.00 64.34 C ATOM 0 H PHE A 79 6.503 3.362 -4.792 1.00 52.12 H new ATOM 0 HA PHE A 79 7.051 6.034 -3.841 1.00 43.31 H new ATOM 0 HB2 PHE A 79 8.149 5.496 -5.873 1.00 74.24 H new ATOM 0 HB3 PHE A 79 6.704 4.800 -6.580 1.00 74.24 H new ATOM 0 HD1 PHE A 79 7.837 8.078 -5.150 1.00 51.13 H new ATOM 0 HD2 PHE A 79 5.526 6.101 -8.119 1.00 74.42 H new ATOM 0 HE1 PHE A 79 7.246 10.244 -6.133 1.00 4.12 H new ATOM 0 HE2 PHE A 79 4.921 8.271 -9.091 1.00 21.33 H new ATOM 0 HZ PHE A 79 5.784 10.345 -8.105 1.00 64.34 H new ATOM 1141 N LEU A 80 4.783 6.870 -3.699 1.00 72.15 N ATOM 1142 CA LEU A 80 3.506 7.506 -3.591 1.00 72.43 C ATOM 1143 C LEU A 80 3.749 8.989 -3.763 1.00 12.12 C ATOM 1144 O LEU A 80 4.779 9.510 -3.312 1.00 3.53 O ATOM 1145 CB LEU A 80 2.923 7.223 -2.210 1.00 41.51 C ATOM 1146 CG LEU A 80 2.763 5.745 -1.829 1.00 15.22 C ATOM 1147 CD1 LEU A 80 2.322 5.608 -0.379 1.00 61.01 C ATOM 1148 CD2 LEU A 80 1.773 5.043 -2.758 1.00 70.05 C ATOM 0 H LEU A 80 5.485 7.258 -3.068 1.00 72.15 H new ATOM 0 HA LEU A 80 2.804 7.139 -4.340 1.00 72.43 H new ATOM 0 HB2 LEU A 80 3.559 7.701 -1.465 1.00 41.51 H new ATOM 0 HB3 LEU A 80 1.945 7.700 -2.147 1.00 41.51 H new ATOM 0 HG LEU A 80 3.734 5.263 -1.942 1.00 15.22 H new ATOM 0 HD11 LEU A 80 2.215 4.552 -0.130 1.00 61.01 H new ATOM 0 HD12 LEU A 80 3.069 6.061 0.273 1.00 61.01 H new ATOM 0 HD13 LEU A 80 1.366 6.113 -0.240 1.00 61.01 H new ATOM 0 HD21 LEU A 80 1.679 3.997 -2.466 1.00 70.05 H new ATOM 0 HD22 LEU A 80 0.800 5.529 -2.687 1.00 70.05 H new ATOM 0 HD23 LEU A 80 2.134 5.101 -3.785 1.00 70.05 H new ATOM 1160 N ASP A 81 2.882 9.665 -4.456 1.00 13.31 N ATOM 1161 CA ASP A 81 3.087 11.088 -4.654 1.00 11.21 C ATOM 1162 C ASP A 81 2.295 11.859 -3.637 1.00 55.33 C ATOM 1163 O ASP A 81 1.067 11.842 -3.652 1.00 74.53 O ATOM 1164 CB ASP A 81 2.737 11.532 -6.069 1.00 24.03 C ATOM 1165 CG ASP A 81 2.985 13.007 -6.269 1.00 43.50 C ATOM 1166 OD1 ASP A 81 4.137 13.447 -6.103 1.00 73.15 O ATOM 1167 OD2 ASP A 81 2.034 13.757 -6.580 1.00 1.32 O ATOM 0 H ASP A 81 2.043 9.277 -4.888 1.00 13.31 H new ATOM 0 HA ASP A 81 4.148 11.296 -4.518 1.00 11.21 H new ATOM 0 HB2 ASP A 81 3.329 10.963 -6.786 1.00 24.03 H new ATOM 0 HB3 ASP A 81 1.690 11.308 -6.272 1.00 24.03 H new ATOM 1172 N ASP A 82 2.988 12.579 -2.810 1.00 23.25 N ATOM 1173 CA ASP A 82 2.394 13.234 -1.666 1.00 70.11 C ATOM 1174 C ASP A 82 2.551 14.750 -1.811 1.00 51.50 C ATOM 1175 O ASP A 82 3.103 15.218 -2.818 1.00 4.24 O ATOM 1176 CB ASP A 82 3.072 12.694 -0.380 1.00 4.02 C ATOM 1177 CG ASP A 82 2.359 13.057 0.909 1.00 21.44 C ATOM 1178 OD1 ASP A 82 1.215 13.574 0.843 1.00 1.52 O ATOM 1179 OD2 ASP A 82 2.920 12.806 1.997 1.00 4.51 O ATOM 0 H ASP A 82 3.992 12.735 -2.903 1.00 23.25 H new ATOM 0 HA ASP A 82 1.327 13.022 -1.602 1.00 70.11 H new ATOM 0 HB2 ASP A 82 3.140 11.608 -0.449 1.00 4.02 H new ATOM 0 HB3 ASP A 82 4.092 13.075 -0.335 1.00 4.02 H new ATOM 1184 N VAL A 83 2.060 15.497 -0.841 1.00 11.03 N ATOM 1185 CA VAL A 83 2.068 16.960 -0.858 1.00 62.32 C ATOM 1186 C VAL A 83 3.496 17.519 -0.868 1.00 40.21 C ATOM 1187 O VAL A 83 3.826 18.406 -1.664 1.00 54.23 O ATOM 1188 CB VAL A 83 1.288 17.537 0.361 1.00 41.21 C ATOM 1189 CG1 VAL A 83 1.268 19.064 0.339 1.00 3.11 C ATOM 1190 CG2 VAL A 83 -0.130 16.990 0.395 1.00 74.44 C ATOM 0 H VAL A 83 1.635 15.104 -0.001 1.00 11.03 H new ATOM 0 HA VAL A 83 1.572 17.270 -1.778 1.00 62.32 H new ATOM 0 HB VAL A 83 1.808 17.222 1.266 1.00 41.21 H new ATOM 0 HG11 VAL A 83 0.716 19.433 1.203 1.00 3.11 H new ATOM 0 HG12 VAL A 83 2.290 19.442 0.373 1.00 3.11 H new ATOM 0 HG13 VAL A 83 0.784 19.408 -0.575 1.00 3.11 H new ATOM 0 HG21 VAL A 83 -0.659 17.404 1.253 1.00 74.44 H new ATOM 0 HG22 VAL A 83 -0.650 17.269 -0.521 1.00 74.44 H new ATOM 0 HG23 VAL A 83 -0.099 15.904 0.478 1.00 74.44 H new ATOM 1200 N THR A 84 4.333 16.993 -0.019 1.00 60.14 N ATOM 1201 CA THR A 84 5.687 17.459 0.079 1.00 63.04 C ATOM 1202 C THR A 84 6.625 16.251 -0.026 1.00 3.20 C ATOM 1203 O THR A 84 6.168 15.137 -0.327 1.00 12.23 O ATOM 1204 CB THR A 84 5.911 18.268 1.412 1.00 53.42 C ATOM 1205 OG1 THR A 84 7.214 18.907 1.438 1.00 34.02 O ATOM 1206 CG2 THR A 84 5.755 17.379 2.642 1.00 72.21 C ATOM 0 H THR A 84 4.098 16.234 0.621 1.00 60.14 H new ATOM 0 HA THR A 84 5.905 18.148 -0.737 1.00 63.04 H new ATOM 0 HB THR A 84 5.142 19.040 1.438 1.00 53.42 H new ATOM 0 HG1 THR A 84 7.319 19.401 2.278 1.00 34.02 H new ATOM 0 HG21 THR A 84 5.917 17.972 3.542 1.00 72.21 H new ATOM 0 HG22 THR A 84 4.750 16.957 2.661 1.00 72.21 H new ATOM 0 HG23 THR A 84 6.487 16.572 2.603 1.00 72.21 H new ATOM 1214 N VAL A 85 7.907 16.450 0.180 1.00 32.54 N ATOM 1215 CA VAL A 85 8.836 15.360 0.114 1.00 54.42 C ATOM 1216 C VAL A 85 8.770 14.578 1.420 1.00 22.42 C ATOM 1217 O VAL A 85 9.351 14.970 2.439 1.00 20.51 O ATOM 1218 CB VAL A 85 10.295 15.847 -0.152 1.00 14.31 C ATOM 1219 CG1 VAL A 85 11.276 14.674 -0.193 1.00 12.12 C ATOM 1220 CG2 VAL A 85 10.366 16.637 -1.451 1.00 42.14 C ATOM 0 H VAL A 85 8.323 17.356 0.394 1.00 32.54 H new ATOM 0 HA VAL A 85 8.558 14.721 -0.724 1.00 54.42 H new ATOM 0 HB VAL A 85 10.582 16.498 0.674 1.00 14.31 H new ATOM 0 HG11 VAL A 85 12.283 15.048 -0.380 1.00 12.12 H new ATOM 0 HG12 VAL A 85 11.256 14.149 0.762 1.00 12.12 H new ATOM 0 HG13 VAL A 85 10.990 13.988 -0.990 1.00 12.12 H new ATOM 0 HG21 VAL A 85 11.391 16.968 -1.620 1.00 42.14 H new ATOM 0 HG22 VAL A 85 10.048 16.004 -2.280 1.00 42.14 H new ATOM 0 HG23 VAL A 85 9.710 17.505 -1.385 1.00 42.14 H new ATOM 1230 N SER A 86 8.027 13.521 1.397 1.00 34.32 N ATOM 1231 CA SER A 86 7.909 12.657 2.517 1.00 2.12 C ATOM 1232 C SER A 86 8.996 11.586 2.421 1.00 31.41 C ATOM 1233 O SER A 86 8.820 10.539 1.809 1.00 55.21 O ATOM 1234 CB SER A 86 6.488 12.084 2.575 1.00 4.42 C ATOM 1235 OG SER A 86 5.547 13.161 2.521 1.00 23.31 O ATOM 0 H SER A 86 7.479 13.232 0.587 1.00 34.32 H new ATOM 0 HA SER A 86 8.062 13.193 3.454 1.00 2.12 H new ATOM 0 HB2 SER A 86 6.324 11.399 1.743 1.00 4.42 H new ATOM 0 HB3 SER A 86 6.351 11.510 3.492 1.00 4.42 H new ATOM 0 HG SER A 86 4.686 12.827 2.192 1.00 23.31 H new ATOM 1241 N ARG A 87 10.157 11.957 2.916 1.00 22.14 N ATOM 1242 CA ARG A 87 11.356 11.112 2.919 1.00 1.21 C ATOM 1243 C ARG A 87 11.247 9.969 3.914 1.00 75.12 C ATOM 1244 O ARG A 87 11.709 8.853 3.656 1.00 1.01 O ATOM 1245 CB ARG A 87 12.618 11.973 3.173 1.00 73.32 C ATOM 1246 CG ARG A 87 12.420 13.076 4.219 1.00 24.24 C ATOM 1247 CD ARG A 87 13.660 13.921 4.412 1.00 30.21 C ATOM 1248 NE ARG A 87 13.348 15.237 5.031 1.00 3.23 N ATOM 1249 CZ ARG A 87 14.164 16.305 4.947 1.00 1.53 C ATOM 1250 NH1 ARG A 87 15.447 16.141 4.645 1.00 5.44 N ATOM 1251 NH2 ARG A 87 13.711 17.517 5.239 1.00 14.01 N ATOM 0 H ARG A 87 10.308 12.873 3.339 1.00 22.14 H new ATOM 0 HA ARG A 87 11.446 10.654 1.934 1.00 1.21 H new ATOM 0 HB2 ARG A 87 13.430 11.322 3.496 1.00 73.32 H new ATOM 0 HB3 ARG A 87 12.929 12.429 2.233 1.00 73.32 H new ATOM 0 HG2 ARG A 87 11.592 13.716 3.915 1.00 24.24 H new ATOM 0 HG3 ARG A 87 12.141 12.624 5.171 1.00 24.24 H new ATOM 0 HD2 ARG A 87 14.370 13.384 5.041 1.00 30.21 H new ATOM 0 HD3 ARG A 87 14.144 14.080 3.448 1.00 30.21 H new ATOM 0 HE ARG A 87 12.472 15.335 5.545 1.00 3.23 H new ATOM 0 HH11 ARG A 87 15.816 15.205 4.476 1.00 5.44 H new ATOM 0 HH12 ARG A 87 16.064 16.951 4.582 1.00 5.44 H new ATOM 0 HH21 ARG A 87 12.741 17.643 5.529 1.00 14.01 H new ATOM 0 HH22 ARG A 87 14.333 18.323 5.174 1.00 14.01 H new ATOM 1265 N ARG A 88 10.638 10.244 5.035 1.00 20.41 N ATOM 1266 CA ARG A 88 10.437 9.259 6.066 1.00 71.13 C ATOM 1267 C ARG A 88 9.011 9.350 6.532 1.00 12.54 C ATOM 1268 O ARG A 88 8.706 10.150 7.398 1.00 62.51 O ATOM 1269 CB ARG A 88 11.403 9.472 7.259 1.00 32.23 C ATOM 1270 CG ARG A 88 12.884 9.255 6.940 1.00 0.22 C ATOM 1271 CD ARG A 88 13.171 7.805 6.564 1.00 71.32 C ATOM 1272 NE ARG A 88 12.883 6.882 7.673 1.00 24.21 N ATOM 1273 CZ ARG A 88 12.627 5.568 7.557 1.00 53.01 C ATOM 1274 NH1 ARG A 88 12.537 4.995 6.357 1.00 31.23 N ATOM 1275 NH2 ARG A 88 12.432 4.840 8.655 1.00 32.51 N ATOM 0 H ARG A 88 10.264 11.165 5.262 1.00 20.41 H new ATOM 0 HA ARG A 88 10.645 8.270 5.658 1.00 71.13 H new ATOM 0 HB2 ARG A 88 11.273 10.487 7.635 1.00 32.23 H new ATOM 0 HB3 ARG A 88 11.117 8.794 8.064 1.00 32.23 H new ATOM 0 HG2 ARG A 88 13.180 9.909 6.120 1.00 0.22 H new ATOM 0 HG3 ARG A 88 13.487 9.534 7.804 1.00 0.22 H new ATOM 0 HD2 ARG A 88 12.570 7.529 5.697 1.00 71.32 H new ATOM 0 HD3 ARG A 88 14.216 7.706 6.272 1.00 71.32 H new ATOM 0 HE ARG A 88 12.877 7.275 8.614 1.00 24.21 H new ATOM 0 HH11 ARG A 88 12.663 5.555 5.514 1.00 31.23 H new ATOM 0 HH12 ARG A 88 12.342 3.997 6.282 1.00 31.23 H new ATOM 0 HH21 ARG A 88 12.478 5.281 9.574 1.00 32.51 H new ATOM 0 HH22 ARG A 88 12.237 3.842 8.577 1.00 32.51 H new ATOM 1289 N HIS A 89 8.124 8.666 5.851 1.00 14.51 N ATOM 1290 CA HIS A 89 6.734 8.661 6.263 1.00 5.04 C ATOM 1291 C HIS A 89 6.389 7.372 7.004 1.00 61.42 C ATOM 1292 O HIS A 89 5.992 7.402 8.178 1.00 10.52 O ATOM 1293 CB HIS A 89 5.814 8.850 5.031 1.00 35.32 C ATOM 1294 CG HIS A 89 4.334 8.700 5.310 1.00 24.43 C ATOM 1295 ND1 HIS A 89 3.639 7.614 4.846 1.00 23.25 N ATOM 1296 CD2 HIS A 89 3.487 9.513 5.987 1.00 4.12 C ATOM 1297 CE1 HIS A 89 2.395 7.782 5.247 1.00 14.41 C ATOM 1298 NE2 HIS A 89 2.249 8.915 5.939 1.00 20.14 N ATOM 0 H HIS A 89 8.331 8.112 5.020 1.00 14.51 H new ATOM 0 HA HIS A 89 6.573 9.492 6.950 1.00 5.04 H new ATOM 0 HB2 HIS A 89 5.991 9.841 4.613 1.00 35.32 H new ATOM 0 HB3 HIS A 89 6.100 8.126 4.268 1.00 35.32 H new ATOM 0 HD2 HIS A 89 3.735 10.447 6.469 1.00 4.12 H new ATOM 0 HE1 HIS A 89 1.593 7.089 5.041 1.00 14.41 H new ATOM 0 HE2 HIS A 89 1.386 9.269 6.352 1.00 20.14 H new ATOM 1306 N ALA A 90 6.635 6.240 6.363 1.00 0.41 N ATOM 1307 CA ALA A 90 6.282 4.970 6.950 1.00 24.31 C ATOM 1308 C ALA A 90 7.044 3.847 6.305 1.00 61.35 C ATOM 1309 O ALA A 90 7.636 4.011 5.231 1.00 21.32 O ATOM 1310 CB ALA A 90 4.778 4.716 6.815 1.00 62.41 C ATOM 0 H ALA A 90 7.074 6.181 5.444 1.00 0.41 H new ATOM 0 HA ALA A 90 6.546 5.008 8.007 1.00 24.31 H new ATOM 0 HB1 ALA A 90 4.530 3.754 7.263 1.00 62.41 H new ATOM 0 HB2 ALA A 90 4.228 5.507 7.326 1.00 62.41 H new ATOM 0 HB3 ALA A 90 4.504 4.706 5.760 1.00 62.41 H new ATOM 1316 N GLU A 91 7.043 2.723 6.946 1.00 65.04 N ATOM 1317 CA GLU A 91 7.604 1.537 6.384 1.00 23.21 C ATOM 1318 C GLU A 91 6.723 0.336 6.706 1.00 34.34 C ATOM 1319 O GLU A 91 6.147 0.233 7.796 1.00 75.05 O ATOM 1320 CB GLU A 91 9.092 1.332 6.776 1.00 5.21 C ATOM 1321 CG GLU A 91 9.385 1.302 8.263 1.00 34.01 C ATOM 1322 CD GLU A 91 10.866 1.183 8.561 1.00 61.22 C ATOM 1323 OE1 GLU A 91 11.561 2.236 8.671 1.00 13.41 O ATOM 1324 OE2 GLU A 91 11.382 0.048 8.688 1.00 44.55 O ATOM 0 H GLU A 91 6.651 2.601 7.880 1.00 65.04 H new ATOM 0 HA GLU A 91 7.620 1.650 5.300 1.00 23.21 H new ATOM 0 HB2 GLU A 91 9.438 0.396 6.338 1.00 5.21 H new ATOM 0 HB3 GLU A 91 9.680 2.131 6.325 1.00 5.21 H new ATOM 0 HG2 GLU A 91 8.997 2.210 8.725 1.00 34.01 H new ATOM 0 HG3 GLU A 91 8.858 0.463 8.717 1.00 34.01 H new ATOM 1331 N PHE A 92 6.603 -0.537 5.751 1.00 24.02 N ATOM 1332 CA PHE A 92 5.791 -1.717 5.853 1.00 61.33 C ATOM 1333 C PHE A 92 6.723 -2.865 6.062 1.00 3.01 C ATOM 1334 O PHE A 92 7.593 -3.142 5.230 1.00 2.13 O ATOM 1335 CB PHE A 92 4.982 -1.959 4.561 1.00 44.02 C ATOM 1336 CG PHE A 92 3.961 -0.895 4.210 1.00 32.22 C ATOM 1337 CD1 PHE A 92 4.345 0.368 3.789 1.00 31.41 C ATOM 1338 CD2 PHE A 92 2.614 -1.177 4.281 1.00 55.41 C ATOM 1339 CE1 PHE A 92 3.398 1.320 3.458 1.00 14.21 C ATOM 1340 CE2 PHE A 92 1.666 -0.228 3.952 1.00 43.11 C ATOM 1341 CZ PHE A 92 2.059 1.020 3.541 1.00 63.12 C ATOM 0 H PHE A 92 7.080 -0.447 4.854 1.00 24.02 H new ATOM 0 HA PHE A 92 5.081 -1.606 6.673 1.00 61.33 H new ATOM 0 HB2 PHE A 92 5.681 -2.053 3.730 1.00 44.02 H new ATOM 0 HB3 PHE A 92 4.466 -2.915 4.652 1.00 44.02 H new ATOM 0 HD1 PHE A 92 5.395 0.612 3.719 1.00 31.41 H new ATOM 0 HD2 PHE A 92 2.294 -2.158 4.600 1.00 55.41 H new ATOM 0 HE1 PHE A 92 3.711 2.301 3.134 1.00 14.21 H new ATOM 0 HE2 PHE A 92 0.615 -0.469 4.018 1.00 43.11 H new ATOM 0 HZ PHE A 92 1.320 1.764 3.284 1.00 63.12 H new ATOM 1351 N ARG A 93 6.588 -3.485 7.165 1.00 2.25 N ATOM 1352 CA ARG A 93 7.454 -4.531 7.556 1.00 61.24 C ATOM 1353 C ARG A 93 6.664 -5.808 7.686 1.00 11.33 C ATOM 1354 O ARG A 93 5.620 -5.838 8.310 1.00 53.31 O ATOM 1355 CB ARG A 93 8.129 -4.142 8.871 1.00 23.44 C ATOM 1356 CG ARG A 93 8.912 -2.841 8.752 1.00 13.33 C ATOM 1357 CD ARG A 93 9.424 -2.338 10.079 1.00 64.15 C ATOM 1358 NE ARG A 93 10.344 -3.271 10.717 1.00 12.22 N ATOM 1359 CZ ARG A 93 11.629 -3.017 10.945 1.00 53.24 C ATOM 1360 NH1 ARG A 93 12.211 -1.949 10.397 1.00 74.04 N ATOM 1361 NH2 ARG A 93 12.349 -3.860 11.678 1.00 12.30 N ATOM 0 H ARG A 93 5.854 -3.277 7.842 1.00 2.25 H new ATOM 0 HA ARG A 93 8.230 -4.696 6.808 1.00 61.24 H new ATOM 0 HB2 ARG A 93 7.373 -4.039 9.649 1.00 23.44 H new ATOM 0 HB3 ARG A 93 8.801 -4.941 9.183 1.00 23.44 H new ATOM 0 HG2 ARG A 93 9.755 -2.991 8.077 1.00 13.33 H new ATOM 0 HG3 ARG A 93 8.275 -2.080 8.302 1.00 13.33 H new ATOM 0 HD2 ARG A 93 9.927 -1.382 9.931 1.00 64.15 H new ATOM 0 HD3 ARG A 93 8.580 -2.155 10.744 1.00 64.15 H new ATOM 0 HE ARG A 93 9.978 -4.178 11.007 1.00 12.22 H new ATOM 0 HH11 ARG A 93 11.670 -1.323 9.800 1.00 74.04 H new ATOM 0 HH12 ARG A 93 13.197 -1.758 10.575 1.00 74.04 H new ATOM 0 HH21 ARG A 93 11.916 -4.699 12.064 1.00 12.30 H new ATOM 0 HH22 ARG A 93 13.335 -3.668 11.855 1.00 12.30 H new ATOM 1375 N ILE A 94 7.124 -6.827 7.058 1.00 52.32 N ATOM 1376 CA ILE A 94 6.462 -8.095 7.102 1.00 2.44 C ATOM 1377 C ILE A 94 7.405 -9.025 7.789 1.00 5.11 C ATOM 1378 O ILE A 94 8.475 -9.326 7.264 1.00 41.11 O ATOM 1379 CB ILE A 94 6.110 -8.653 5.666 1.00 40.24 C ATOM 1380 CG1 ILE A 94 5.183 -7.699 4.864 1.00 63.03 C ATOM 1381 CG2 ILE A 94 5.458 -10.026 5.769 1.00 63.11 C ATOM 1382 CD1 ILE A 94 5.837 -6.441 4.313 1.00 40.33 C ATOM 0 H ILE A 94 7.974 -6.814 6.494 1.00 52.32 H new ATOM 0 HA ILE A 94 5.511 -7.996 7.625 1.00 2.44 H new ATOM 0 HB ILE A 94 7.053 -8.731 5.125 1.00 40.24 H new ATOM 0 HG12 ILE A 94 4.754 -8.256 4.031 1.00 63.03 H new ATOM 0 HG13 ILE A 94 4.355 -7.402 5.508 1.00 63.03 H new ATOM 0 HG21 ILE A 94 5.223 -10.393 4.770 1.00 63.11 H new ATOM 0 HG22 ILE A 94 6.143 -10.718 6.258 1.00 63.11 H new ATOM 0 HG23 ILE A 94 4.541 -9.950 6.353 1.00 63.11 H new ATOM 0 HD11 ILE A 94 5.096 -5.852 3.772 1.00 40.33 H new ATOM 0 HD12 ILE A 94 6.240 -5.850 5.136 1.00 40.33 H new ATOM 0 HD13 ILE A 94 6.645 -6.718 3.635 1.00 40.33 H new ATOM 1394 N ASN A 95 7.047 -9.454 8.958 1.00 10.23 N ATOM 1395 CA ASN A 95 7.931 -10.277 9.748 1.00 31.22 C ATOM 1396 C ASN A 95 7.189 -11.385 10.410 1.00 11.02 C ATOM 1397 O ASN A 95 6.177 -11.144 11.087 1.00 10.42 O ATOM 1398 CB ASN A 95 8.713 -9.465 10.809 1.00 24.10 C ATOM 1399 CG ASN A 95 9.746 -8.508 10.222 1.00 52.24 C ATOM 1400 OD1 ASN A 95 10.895 -8.871 9.998 1.00 51.10 O ATOM 1401 ND2 ASN A 95 9.360 -7.281 9.998 1.00 70.42 N ATOM 0 H ASN A 95 6.148 -9.252 9.395 1.00 10.23 H new ATOM 0 HA ASN A 95 8.656 -10.697 9.051 1.00 31.22 H new ATOM 0 HB2 ASN A 95 8.004 -8.894 11.409 1.00 24.10 H new ATOM 0 HB3 ASN A 95 9.217 -10.158 11.483 1.00 24.10 H new ATOM 0 HD21 ASN A 95 10.021 -6.598 9.628 1.00 70.42 H new ATOM 0 HD22 ASN A 95 8.398 -7.005 10.193 1.00 70.42 H new ATOM 1408 N GLU A 96 7.668 -12.591 10.168 1.00 64.30 N ATOM 1409 CA GLU A 96 7.194 -13.815 10.799 1.00 33.31 C ATOM 1410 C GLU A 96 5.670 -14.012 10.722 1.00 11.13 C ATOM 1411 O GLU A 96 4.992 -14.222 11.731 1.00 51.10 O ATOM 1412 CB GLU A 96 7.773 -13.957 12.215 1.00 71.04 C ATOM 1413 CG GLU A 96 9.305 -13.960 12.201 1.00 31.11 C ATOM 1414 CD GLU A 96 9.940 -14.097 13.561 1.00 72.00 C ATOM 1415 OE1 GLU A 96 9.996 -13.092 14.311 1.00 24.24 O ATOM 1416 OE2 GLU A 96 10.431 -15.195 13.894 1.00 62.34 O ATOM 0 H GLU A 96 8.425 -12.754 9.504 1.00 64.30 H new ATOM 0 HA GLU A 96 7.581 -14.647 10.211 1.00 33.31 H new ATOM 0 HB2 GLU A 96 7.416 -13.137 12.838 1.00 71.04 H new ATOM 0 HB3 GLU A 96 7.411 -14.881 12.666 1.00 71.04 H new ATOM 0 HG2 GLU A 96 9.649 -14.779 11.569 1.00 31.11 H new ATOM 0 HG3 GLU A 96 9.654 -13.035 11.742 1.00 31.11 H new ATOM 1423 N GLY A 97 5.151 -13.864 9.517 1.00 21.15 N ATOM 1424 CA GLY A 97 3.761 -14.155 9.245 1.00 43.41 C ATOM 1425 C GLY A 97 2.796 -13.017 9.507 1.00 42.31 C ATOM 1426 O GLY A 97 1.586 -13.189 9.334 1.00 73.51 O ATOM 0 H GLY A 97 5.679 -13.541 8.706 1.00 21.15 H new ATOM 0 HA2 GLY A 97 3.668 -14.455 8.201 1.00 43.41 H new ATOM 0 HA3 GLY A 97 3.461 -15.010 9.851 1.00 43.41 H new ATOM 1430 N GLU A 98 3.283 -11.874 9.940 1.00 61.21 N ATOM 1431 CA GLU A 98 2.401 -10.756 10.159 1.00 54.44 C ATOM 1432 C GLU A 98 2.898 -9.523 9.437 1.00 34.12 C ATOM 1433 O GLU A 98 4.115 -9.310 9.288 1.00 5.41 O ATOM 1434 CB GLU A 98 2.154 -10.497 11.654 1.00 12.15 C ATOM 1435 CG GLU A 98 1.684 -11.747 12.378 1.00 24.32 C ATOM 1436 CD GLU A 98 0.974 -11.488 13.679 1.00 53.24 C ATOM 1437 OE1 GLU A 98 1.633 -11.369 14.723 1.00 63.33 O ATOM 1438 OE2 GLU A 98 -0.283 -11.463 13.689 1.00 74.23 O ATOM 0 H GLU A 98 4.267 -11.699 10.143 1.00 61.21 H new ATOM 0 HA GLU A 98 1.432 -11.014 9.732 1.00 54.44 H new ATOM 0 HB2 GLU A 98 3.072 -10.134 12.116 1.00 12.15 H new ATOM 0 HB3 GLU A 98 1.408 -9.710 11.767 1.00 12.15 H new ATOM 0 HG2 GLU A 98 1.017 -12.303 11.720 1.00 24.32 H new ATOM 0 HG3 GLU A 98 2.546 -12.385 12.571 1.00 24.32 H new ATOM 1445 N PHE A 99 1.962 -8.722 8.994 1.00 52.25 N ATOM 1446 CA PHE A 99 2.235 -7.533 8.224 1.00 73.11 C ATOM 1447 C PHE A 99 2.051 -6.346 9.141 1.00 42.12 C ATOM 1448 O PHE A 99 0.963 -6.136 9.666 1.00 40.44 O ATOM 1449 CB PHE A 99 1.223 -7.415 7.062 1.00 54.15 C ATOM 1450 CG PHE A 99 1.099 -8.633 6.174 1.00 70.32 C ATOM 1451 CD1 PHE A 99 0.194 -9.643 6.481 1.00 13.41 C ATOM 1452 CD2 PHE A 99 1.869 -8.761 5.035 1.00 60.33 C ATOM 1453 CE1 PHE A 99 0.069 -10.753 5.671 1.00 25.51 C ATOM 1454 CE2 PHE A 99 1.751 -9.871 4.220 1.00 72.23 C ATOM 1455 CZ PHE A 99 0.849 -10.867 4.538 1.00 75.50 C ATOM 0 H PHE A 99 0.968 -8.881 9.162 1.00 52.25 H new ATOM 0 HA PHE A 99 3.246 -7.572 7.817 1.00 73.11 H new ATOM 0 HB2 PHE A 99 0.242 -7.192 7.481 1.00 54.15 H new ATOM 0 HB3 PHE A 99 1.506 -6.564 6.443 1.00 54.15 H new ATOM 0 HD1 PHE A 99 -0.420 -9.557 7.366 1.00 13.41 H new ATOM 0 HD2 PHE A 99 2.573 -7.983 4.778 1.00 60.33 H new ATOM 0 HE1 PHE A 99 -0.637 -11.530 5.923 1.00 25.51 H new ATOM 0 HE2 PHE A 99 2.364 -9.959 3.335 1.00 72.23 H new ATOM 0 HZ PHE A 99 0.754 -11.734 3.901 1.00 75.50 H new ATOM 1465 N GLU A 100 3.075 -5.581 9.337 1.00 70.55 N ATOM 1466 CA GLU A 100 3.007 -4.472 10.244 1.00 5.14 C ATOM 1467 C GLU A 100 3.512 -3.195 9.595 1.00 44.12 C ATOM 1468 O GLU A 100 4.582 -3.159 8.999 1.00 4.41 O ATOM 1469 CB GLU A 100 3.740 -4.794 11.559 1.00 2.02 C ATOM 1470 CG GLU A 100 5.162 -5.299 11.383 1.00 23.34 C ATOM 1471 CD GLU A 100 5.830 -5.635 12.683 1.00 63.20 C ATOM 1472 OE1 GLU A 100 5.740 -6.797 13.138 1.00 64.22 O ATOM 1473 OE2 GLU A 100 6.489 -4.745 13.281 1.00 63.34 O ATOM 0 H GLU A 100 3.978 -5.702 8.879 1.00 70.55 H new ATOM 0 HA GLU A 100 1.961 -4.299 10.495 1.00 5.14 H new ATOM 0 HB2 GLU A 100 3.761 -3.896 12.177 1.00 2.02 H new ATOM 0 HB3 GLU A 100 3.167 -5.544 12.105 1.00 2.02 H new ATOM 0 HG2 GLU A 100 5.151 -6.184 10.747 1.00 23.34 H new ATOM 0 HG3 GLU A 100 5.749 -4.541 10.864 1.00 23.34 H new ATOM 1480 N VAL A 101 2.720 -2.177 9.680 1.00 22.20 N ATOM 1481 CA VAL A 101 3.047 -0.897 9.124 1.00 12.24 C ATOM 1482 C VAL A 101 3.451 -0.005 10.255 1.00 50.30 C ATOM 1483 O VAL A 101 2.703 0.133 11.233 1.00 63.32 O ATOM 1484 CB VAL A 101 1.821 -0.252 8.424 1.00 1.35 C ATOM 1485 CG1 VAL A 101 2.202 1.040 7.707 1.00 35.31 C ATOM 1486 CG2 VAL A 101 1.164 -1.227 7.473 1.00 61.12 C ATOM 0 H VAL A 101 1.812 -2.208 10.144 1.00 22.20 H new ATOM 0 HA VAL A 101 3.841 -1.023 8.388 1.00 12.24 H new ATOM 0 HB VAL A 101 1.098 0.003 9.198 1.00 1.35 H new ATOM 0 HG11 VAL A 101 1.319 1.464 7.228 1.00 35.31 H new ATOM 0 HG12 VAL A 101 2.601 1.753 8.429 1.00 35.31 H new ATOM 0 HG13 VAL A 101 2.958 0.827 6.951 1.00 35.31 H new ATOM 0 HG21 VAL A 101 0.308 -0.749 6.996 1.00 61.12 H new ATOM 0 HG22 VAL A 101 1.881 -1.531 6.711 1.00 61.12 H new ATOM 0 HG23 VAL A 101 0.828 -2.104 8.026 1.00 61.12 H new ATOM 1496 N VAL A 102 4.612 0.555 10.169 1.00 13.10 N ATOM 1497 CA VAL A 102 5.053 1.470 11.162 1.00 64.44 C ATOM 1498 C VAL A 102 5.302 2.842 10.560 1.00 61.22 C ATOM 1499 O VAL A 102 6.046 2.996 9.581 1.00 63.44 O ATOM 1500 CB VAL A 102 6.284 0.968 11.986 1.00 71.14 C ATOM 1501 CG1 VAL A 102 5.907 -0.224 12.849 1.00 51.11 C ATOM 1502 CG2 VAL A 102 7.449 0.603 11.087 1.00 35.53 C ATOM 0 H VAL A 102 5.276 0.391 9.412 1.00 13.10 H new ATOM 0 HA VAL A 102 4.240 1.548 11.884 1.00 64.44 H new ATOM 0 HB VAL A 102 6.595 1.790 12.630 1.00 71.14 H new ATOM 0 HG11 VAL A 102 6.779 -0.555 13.413 1.00 51.11 H new ATOM 0 HG12 VAL A 102 5.115 0.064 13.541 1.00 51.11 H new ATOM 0 HG13 VAL A 102 5.556 -1.037 12.213 1.00 51.11 H new ATOM 0 HG21 VAL A 102 8.285 0.259 11.696 1.00 35.53 H new ATOM 0 HG22 VAL A 102 7.147 -0.191 10.404 1.00 35.53 H new ATOM 0 HG23 VAL A 102 7.754 1.478 10.514 1.00 35.53 H new ATOM 1512 N ASP A 103 4.635 3.803 11.109 1.00 53.01 N ATOM 1513 CA ASP A 103 4.755 5.191 10.724 1.00 14.50 C ATOM 1514 C ASP A 103 6.016 5.711 11.382 1.00 71.43 C ATOM 1515 O ASP A 103 6.146 5.656 12.614 1.00 54.41 O ATOM 1516 CB ASP A 103 3.525 5.955 11.250 1.00 35.21 C ATOM 1517 CG ASP A 103 3.465 7.431 10.893 1.00 2.24 C ATOM 1518 OD1 ASP A 103 4.348 8.189 11.311 1.00 73.21 O ATOM 1519 OD2 ASP A 103 2.447 7.861 10.278 1.00 11.14 O ATOM 0 H ASP A 103 3.966 3.650 11.864 1.00 53.01 H new ATOM 0 HA ASP A 103 4.806 5.317 9.642 1.00 14.50 H new ATOM 0 HB2 ASP A 103 2.627 5.470 10.866 1.00 35.21 H new ATOM 0 HB3 ASP A 103 3.499 5.861 12.336 1.00 35.21 H new ATOM 1524 N VAL A 104 6.930 6.193 10.597 1.00 55.41 N ATOM 1525 CA VAL A 104 8.225 6.617 11.111 1.00 32.44 C ATOM 1526 C VAL A 104 8.392 8.117 11.013 1.00 51.03 C ATOM 1527 O VAL A 104 9.354 8.693 11.547 1.00 72.53 O ATOM 1528 CB VAL A 104 9.397 5.909 10.382 1.00 42.14 C ATOM 1529 CG1 VAL A 104 9.365 4.413 10.652 1.00 23.04 C ATOM 1530 CG2 VAL A 104 9.345 6.174 8.881 1.00 65.12 C ATOM 0 H VAL A 104 6.816 6.309 9.590 1.00 55.41 H new ATOM 0 HA VAL A 104 8.253 6.328 12.162 1.00 32.44 H new ATOM 0 HB VAL A 104 10.331 6.316 10.770 1.00 42.14 H new ATOM 0 HG11 VAL A 104 10.194 3.932 10.133 1.00 23.04 H new ATOM 0 HG12 VAL A 104 9.455 4.235 11.724 1.00 23.04 H new ATOM 0 HG13 VAL A 104 8.423 3.999 10.293 1.00 23.04 H new ATOM 0 HG21 VAL A 104 10.177 5.667 8.393 1.00 65.12 H new ATOM 0 HG22 VAL A 104 8.404 5.799 8.478 1.00 65.12 H new ATOM 0 HG23 VAL A 104 9.416 7.246 8.698 1.00 65.12 H new ATOM 1540 N GLY A 105 7.472 8.732 10.350 1.00 44.44 N ATOM 1541 CA GLY A 105 7.497 10.130 10.165 1.00 51.20 C ATOM 1542 C GLY A 105 6.112 10.638 10.122 1.00 33.40 C ATOM 1543 O GLY A 105 5.481 10.694 9.059 1.00 2.04 O ATOM 0 H GLY A 105 6.674 8.265 9.919 1.00 44.44 H new ATOM 0 HA2 GLY A 105 8.047 10.607 10.977 1.00 51.20 H new ATOM 0 HA3 GLY A 105 8.017 10.377 9.239 1.00 51.20 H new ATOM 1547 N SER A 106 5.614 11.001 11.256 1.00 21.21 N ATOM 1548 CA SER A 106 4.268 11.433 11.367 1.00 55.23 C ATOM 1549 C SER A 106 4.117 12.889 10.900 1.00 1.03 C ATOM 1550 O SER A 106 4.075 13.824 11.704 1.00 43.02 O ATOM 1551 CB SER A 106 3.779 11.222 12.801 1.00 4.22 C ATOM 1552 OG SER A 106 4.046 9.878 13.218 1.00 71.13 O ATOM 0 H SER A 106 6.134 11.005 12.134 1.00 21.21 H new ATOM 0 HA SER A 106 3.638 10.834 10.709 1.00 55.23 H new ATOM 0 HB2 SER A 106 4.276 11.924 13.470 1.00 4.22 H new ATOM 0 HB3 SER A 106 2.710 11.425 12.863 1.00 4.22 H new ATOM 0 HG SER A 106 4.256 9.328 12.435 1.00 71.13 H new ATOM 1558 N LEU A 107 4.177 13.073 9.589 1.00 62.21 N ATOM 1559 CA LEU A 107 3.948 14.373 8.988 1.00 14.13 C ATOM 1560 C LEU A 107 2.588 14.381 8.359 1.00 42.22 C ATOM 1561 O LEU A 107 1.817 15.319 8.503 1.00 4.32 O ATOM 1562 CB LEU A 107 5.013 14.752 7.920 1.00 75.20 C ATOM 1563 CG LEU A 107 4.978 14.048 6.518 1.00 61.21 C ATOM 1564 CD1 LEU A 107 5.805 14.820 5.497 1.00 22.12 C ATOM 1565 CD2 LEU A 107 5.492 12.618 6.588 1.00 22.31 C ATOM 0 H LEU A 107 4.384 12.331 8.920 1.00 62.21 H new ATOM 0 HA LEU A 107 4.022 15.116 9.782 1.00 14.13 H new ATOM 0 HB2 LEU A 107 4.938 15.826 7.749 1.00 75.20 H new ATOM 0 HB3 LEU A 107 5.995 14.566 8.356 1.00 75.20 H new ATOM 0 HG LEU A 107 3.934 14.030 6.206 1.00 61.21 H new ATOM 0 HD11 LEU A 107 5.763 14.310 4.535 1.00 22.12 H new ATOM 0 HD12 LEU A 107 5.404 15.828 5.391 1.00 22.12 H new ATOM 0 HD13 LEU A 107 6.840 14.875 5.834 1.00 22.12 H new ATOM 0 HD21 LEU A 107 5.451 12.168 5.596 1.00 22.31 H new ATOM 0 HD22 LEU A 107 6.522 12.619 6.944 1.00 22.31 H new ATOM 0 HD23 LEU A 107 4.872 12.042 7.274 1.00 22.31 H new ATOM 1577 N ASN A 108 2.306 13.313 7.672 1.00 2.22 N ATOM 1578 CA ASN A 108 1.065 13.150 6.989 1.00 62.14 C ATOM 1579 C ASN A 108 0.182 12.247 7.834 1.00 31.13 C ATOM 1580 O ASN A 108 -1.032 12.372 7.828 1.00 11.05 O ATOM 1581 CB ASN A 108 1.406 12.480 5.639 1.00 41.13 C ATOM 1582 CG ASN A 108 0.250 12.275 4.688 1.00 14.20 C ATOM 1583 OD1 ASN A 108 -0.885 12.088 5.076 1.00 71.51 O ATOM 1584 ND2 ASN A 108 0.544 12.308 3.420 1.00 51.34 N ATOM 0 H ASN A 108 2.943 12.523 7.572 1.00 2.22 H new ATOM 0 HA ASN A 108 0.540 14.091 6.823 1.00 62.14 H new ATOM 0 HB2 ASN A 108 2.160 13.085 5.136 1.00 41.13 H new ATOM 0 HB3 ASN A 108 1.859 11.510 5.842 1.00 41.13 H new ATOM 0 HD21 ASN A 108 -0.189 12.175 2.723 1.00 51.34 H new ATOM 0 HD22 ASN A 108 1.507 12.467 3.124 1.00 51.34 H new ATOM 1591 N GLY A 109 0.827 11.471 8.702 1.00 40.44 N ATOM 1592 CA GLY A 109 0.117 10.522 9.524 1.00 73.41 C ATOM 1593 C GLY A 109 -0.417 9.357 8.707 1.00 5.13 C ATOM 1594 O GLY A 109 -1.209 9.540 7.789 1.00 53.43 O ATOM 0 H GLY A 109 1.837 11.488 8.847 1.00 40.44 H new ATOM 0 HA2 GLY A 109 0.781 10.146 10.302 1.00 73.41 H new ATOM 0 HA3 GLY A 109 -0.710 11.023 10.026 1.00 73.41 H new ATOM 1598 N THR A 110 0.054 8.186 8.977 1.00 71.54 N ATOM 1599 CA THR A 110 -0.460 7.034 8.301 1.00 52.12 C ATOM 1600 C THR A 110 -1.841 6.683 8.896 1.00 52.33 C ATOM 1601 O THR A 110 -1.992 6.574 10.129 1.00 14.11 O ATOM 1602 CB THR A 110 0.513 5.853 8.493 1.00 3.14 C ATOM 1603 OG1 THR A 110 1.838 6.280 8.134 1.00 43.41 O ATOM 1604 CG2 THR A 110 0.119 4.668 7.617 1.00 53.40 C ATOM 0 H THR A 110 0.791 7.998 9.657 1.00 71.54 H new ATOM 0 HA THR A 110 -0.564 7.238 7.235 1.00 52.12 H new ATOM 0 HB THR A 110 0.477 5.539 9.536 1.00 3.14 H new ATOM 0 HG1 THR A 110 2.191 6.871 8.831 1.00 43.41 H new ATOM 0 HG21 THR A 110 0.823 3.850 7.773 1.00 53.40 H new ATOM 0 HG22 THR A 110 -0.886 4.338 7.882 1.00 53.40 H new ATOM 0 HG23 THR A 110 0.138 4.968 6.569 1.00 53.40 H new ATOM 1612 N TYR A 111 -2.839 6.526 8.041 1.00 61.31 N ATOM 1613 CA TYR A 111 -4.170 6.161 8.489 1.00 14.14 C ATOM 1614 C TYR A 111 -4.528 4.806 7.953 1.00 62.21 C ATOM 1615 O TYR A 111 -4.454 4.579 6.756 1.00 51.51 O ATOM 1616 CB TYR A 111 -5.223 7.194 8.031 1.00 43.52 C ATOM 1617 CG TYR A 111 -5.217 8.524 8.777 1.00 1.42 C ATOM 1618 CD1 TYR A 111 -4.089 9.329 8.826 1.00 2.21 C ATOM 1619 CD2 TYR A 111 -6.359 8.971 9.425 1.00 10.21 C ATOM 1620 CE1 TYR A 111 -4.093 10.537 9.500 1.00 61.14 C ATOM 1621 CE2 TYR A 111 -6.372 10.177 10.096 1.00 71.14 C ATOM 1622 CZ TYR A 111 -5.239 10.954 10.133 1.00 25.24 C ATOM 1623 OH TYR A 111 -5.258 12.166 10.801 1.00 22.31 O ATOM 0 H TYR A 111 -2.751 6.646 7.032 1.00 61.31 H new ATOM 0 HA TYR A 111 -4.167 6.141 9.579 1.00 14.14 H new ATOM 0 HB2 TYR A 111 -5.071 7.393 6.970 1.00 43.52 H new ATOM 0 HB3 TYR A 111 -6.212 6.746 8.133 1.00 43.52 H new ATOM 0 HD1 TYR A 111 -3.187 9.006 8.327 1.00 2.21 H new ATOM 0 HD2 TYR A 111 -7.253 8.365 9.404 1.00 10.21 H new ATOM 0 HE1 TYR A 111 -3.203 11.147 9.528 1.00 61.14 H new ATOM 0 HE2 TYR A 111 -7.272 10.510 10.592 1.00 71.14 H new ATOM 0 HH TYR A 111 -6.145 12.310 11.192 1.00 22.31 H new ATOM 1633 N VAL A 112 -4.914 3.920 8.835 1.00 1.22 N ATOM 1634 CA VAL A 112 -5.306 2.569 8.482 1.00 11.40 C ATOM 1635 C VAL A 112 -6.637 2.290 9.160 1.00 24.11 C ATOM 1636 O VAL A 112 -6.760 2.516 10.377 1.00 41.44 O ATOM 1637 CB VAL A 112 -4.264 1.510 8.974 1.00 30.43 C ATOM 1638 CG1 VAL A 112 -4.654 0.104 8.525 1.00 52.13 C ATOM 1639 CG2 VAL A 112 -2.849 1.848 8.508 1.00 75.20 C ATOM 0 H VAL A 112 -4.967 4.114 9.835 1.00 1.22 H new ATOM 0 HA VAL A 112 -5.371 2.492 7.397 1.00 11.40 H new ATOM 0 HB VAL A 112 -4.270 1.538 10.064 1.00 30.43 H new ATOM 0 HG11 VAL A 112 -3.912 -0.611 8.881 1.00 52.13 H new ATOM 0 HG12 VAL A 112 -5.631 -0.152 8.936 1.00 52.13 H new ATOM 0 HG13 VAL A 112 -4.698 0.069 7.436 1.00 52.13 H new ATOM 0 HG21 VAL A 112 -2.156 1.089 8.870 1.00 75.20 H new ATOM 0 HG22 VAL A 112 -2.821 1.875 7.419 1.00 75.20 H new ATOM 0 HG23 VAL A 112 -2.559 2.822 8.902 1.00 75.20 H new ATOM 1649 N ASN A 113 -7.625 1.836 8.382 1.00 45.02 N ATOM 1650 CA ASN A 113 -8.994 1.532 8.882 1.00 72.12 C ATOM 1651 C ASN A 113 -9.562 2.798 9.538 1.00 32.11 C ATOM 1652 O ASN A 113 -10.116 2.785 10.641 1.00 31.34 O ATOM 1653 CB ASN A 113 -8.965 0.326 9.875 1.00 61.51 C ATOM 1654 CG ASN A 113 -10.352 -0.249 10.212 1.00 31.32 C ATOM 1655 OD1 ASN A 113 -11.012 0.162 11.170 1.00 61.43 O ATOM 1656 ND2 ASN A 113 -10.775 -1.243 9.466 1.00 20.50 N ATOM 0 H ASN A 113 -7.510 1.664 7.383 1.00 45.02 H new ATOM 0 HA ASN A 113 -9.640 1.239 8.055 1.00 72.12 H new ATOM 0 HB2 ASN A 113 -8.350 -0.466 9.448 1.00 61.51 H new ATOM 0 HB3 ASN A 113 -8.481 0.643 10.799 1.00 61.51 H new ATOM 0 HD21 ASN A 113 -11.667 -1.693 9.673 1.00 20.50 H new ATOM 0 HD22 ASN A 113 -10.212 -1.566 8.679 1.00 20.50 H new ATOM 1663 N ARG A 114 -9.389 3.900 8.807 1.00 31.34 N ATOM 1664 CA ARG A 114 -9.790 5.257 9.203 1.00 70.43 C ATOM 1665 C ARG A 114 -9.077 5.792 10.459 1.00 11.50 C ATOM 1666 O ARG A 114 -9.415 6.864 10.932 1.00 53.21 O ATOM 1667 CB ARG A 114 -11.310 5.361 9.392 1.00 3.14 C ATOM 1668 CG ARG A 114 -12.154 5.154 8.138 1.00 24.52 C ATOM 1669 CD ARG A 114 -11.932 6.245 7.091 1.00 2.23 C ATOM 1670 NE ARG A 114 -10.691 6.079 6.310 1.00 30.12 N ATOM 1671 CZ ARG A 114 -10.099 7.047 5.603 1.00 52.12 C ATOM 1672 NH1 ARG A 114 -10.388 8.329 5.817 1.00 75.00 N ATOM 1673 NH2 ARG A 114 -9.191 6.736 4.714 1.00 31.51 N ATOM 0 H ARG A 114 -8.949 3.874 7.887 1.00 31.34 H new ATOM 0 HA ARG A 114 -9.474 5.888 8.372 1.00 70.43 H new ATOM 0 HB2 ARG A 114 -11.615 4.626 10.137 1.00 3.14 H new ATOM 0 HB3 ARG A 114 -11.539 6.345 9.802 1.00 3.14 H new ATOM 0 HG2 ARG A 114 -11.917 4.184 7.702 1.00 24.52 H new ATOM 0 HG3 ARG A 114 -13.208 5.130 8.414 1.00 24.52 H new ATOM 0 HD2 ARG A 114 -12.781 6.258 6.408 1.00 2.23 H new ATOM 0 HD3 ARG A 114 -11.909 7.214 7.589 1.00 2.23 H new ATOM 0 HE ARG A 114 -10.253 5.158 6.310 1.00 30.12 H new ATOM 0 HH11 ARG A 114 -11.071 8.586 6.530 1.00 75.00 H new ATOM 0 HH12 ARG A 114 -9.927 9.054 5.268 1.00 75.00 H new ATOM 0 HH21 ARG A 114 -8.938 5.759 4.563 1.00 31.51 H new ATOM 0 HH22 ARG A 114 -8.736 7.470 4.172 1.00 31.51 H new ATOM 1687 N GLU A 115 -8.080 5.100 10.959 1.00 25.23 N ATOM 1688 CA GLU A 115 -7.399 5.563 12.155 1.00 2.21 C ATOM 1689 C GLU A 115 -5.943 5.881 11.925 1.00 40.12 C ATOM 1690 O GLU A 115 -5.217 5.095 11.310 1.00 42.44 O ATOM 1691 CB GLU A 115 -7.519 4.570 13.303 1.00 21.13 C ATOM 1692 CG GLU A 115 -8.867 4.555 13.974 1.00 1.41 C ATOM 1693 CD GLU A 115 -8.914 3.570 15.102 1.00 15.32 C ATOM 1694 OE1 GLU A 115 -8.093 3.679 16.048 1.00 42.11 O ATOM 1695 OE2 GLU A 115 -9.748 2.644 15.066 1.00 64.22 O ATOM 0 H GLU A 115 -7.724 4.228 10.567 1.00 25.23 H new ATOM 0 HA GLU A 115 -7.908 6.488 12.425 1.00 2.21 H new ATOM 0 HB2 GLU A 115 -7.303 3.570 12.927 1.00 21.13 H new ATOM 0 HB3 GLU A 115 -6.758 4.801 14.048 1.00 21.13 H new ATOM 0 HG2 GLU A 115 -9.097 5.551 14.351 1.00 1.41 H new ATOM 0 HG3 GLU A 115 -9.635 4.307 13.242 1.00 1.41 H new ATOM 1702 N PRO A 116 -5.492 7.041 12.409 1.00 13.11 N ATOM 1703 CA PRO A 116 -4.090 7.391 12.377 1.00 4.44 C ATOM 1704 C PRO A 116 -3.390 6.655 13.495 1.00 10.51 C ATOM 1705 O PRO A 116 -3.767 6.778 14.665 1.00 43.03 O ATOM 1706 CB PRO A 116 -4.079 8.894 12.659 1.00 52.25 C ATOM 1707 CG PRO A 116 -5.334 9.165 13.425 1.00 73.13 C ATOM 1708 CD PRO A 116 -6.323 8.092 13.044 1.00 1.13 C ATOM 0 HA PRO A 116 -3.595 7.140 11.439 1.00 4.44 H new ATOM 0 HB2 PRO A 116 -3.198 9.179 13.235 1.00 52.25 H new ATOM 0 HB3 PRO A 116 -4.053 9.467 11.732 1.00 52.25 H new ATOM 0 HG2 PRO A 116 -5.142 9.149 14.498 1.00 73.13 H new ATOM 0 HG3 PRO A 116 -5.726 10.154 13.186 1.00 73.13 H new ATOM 0 HD2 PRO A 116 -6.851 7.709 13.917 1.00 1.13 H new ATOM 0 HD3 PRO A 116 -7.078 8.472 12.356 1.00 1.13 H new ATOM 1716 N ARG A 117 -2.408 5.898 13.174 1.00 20.15 N ATOM 1717 CA ARG A 117 -1.746 5.124 14.173 1.00 14.34 C ATOM 1718 C ARG A 117 -0.311 4.945 13.754 1.00 20.51 C ATOM 1719 O ARG A 117 -0.002 5.098 12.570 1.00 10.14 O ATOM 1720 CB ARG A 117 -2.480 3.786 14.344 1.00 4.43 C ATOM 1721 CG ARG A 117 -2.051 2.993 15.552 1.00 71.24 C ATOM 1722 CD ARG A 117 -2.889 1.751 15.732 1.00 41.43 C ATOM 1723 NE ARG A 117 -4.315 2.056 15.950 1.00 52.01 N ATOM 1724 CZ ARG A 117 -5.261 1.134 16.189 1.00 14.12 C ATOM 1725 NH1 ARG A 117 -4.942 -0.144 16.255 1.00 24.23 N ATOM 1726 NH2 ARG A 117 -6.524 1.491 16.349 1.00 33.53 N ATOM 0 H ARG A 117 -2.039 5.793 12.229 1.00 20.15 H new ATOM 0 HA ARG A 117 -1.758 5.624 15.142 1.00 14.34 H new ATOM 0 HB2 ARG A 117 -3.551 3.978 14.412 1.00 4.43 H new ATOM 0 HB3 ARG A 117 -2.321 3.181 13.451 1.00 4.43 H new ATOM 0 HG2 ARG A 117 -1.003 2.713 15.450 1.00 71.24 H new ATOM 0 HG3 ARG A 117 -2.129 3.616 16.443 1.00 71.24 H new ATOM 0 HD2 ARG A 117 -2.787 1.118 14.851 1.00 41.43 H new ATOM 0 HD3 ARG A 117 -2.509 1.181 16.580 1.00 41.43 H new ATOM 0 HE ARG A 117 -4.602 3.034 15.917 1.00 52.01 H new ATOM 0 HH11 ARG A 117 -3.973 -0.435 16.124 1.00 24.23 H new ATOM 0 HH12 ARG A 117 -5.664 -0.841 16.437 1.00 24.23 H new ATOM 0 HH21 ARG A 117 -6.787 2.475 16.291 1.00 33.53 H new ATOM 0 HH22 ARG A 117 -7.235 0.783 16.530 1.00 33.53 H new ATOM 1740 N ASN A 118 0.566 4.663 14.691 1.00 34.21 N ATOM 1741 CA ASN A 118 1.974 4.550 14.357 1.00 0.23 C ATOM 1742 C ASN A 118 2.384 3.145 14.043 1.00 11.11 C ATOM 1743 O ASN A 118 3.133 2.922 13.124 1.00 12.21 O ATOM 1744 CB ASN A 118 2.896 5.220 15.380 1.00 52.31 C ATOM 1745 CG ASN A 118 2.835 6.735 15.284 1.00 72.43 C ATOM 1746 OD1 ASN A 118 2.021 7.386 15.942 1.00 2.33 O ATOM 1747 ND2 ASN A 118 3.678 7.310 14.465 1.00 41.43 N ATOM 0 H ASN A 118 0.339 4.510 15.674 1.00 34.21 H new ATOM 0 HA ASN A 118 2.100 5.117 13.435 1.00 0.23 H new ATOM 0 HB2 ASN A 118 2.613 4.907 16.385 1.00 52.31 H new ATOM 0 HB3 ASN A 118 3.921 4.886 15.220 1.00 52.31 H new ATOM 0 HD21 ASN A 118 3.673 8.324 14.358 1.00 41.43 H new ATOM 0 HD22 ASN A 118 4.340 6.744 13.934 1.00 41.43 H new ATOM 1754 N ALA A 119 1.898 2.198 14.779 1.00 62.20 N ATOM 1755 CA ALA A 119 2.154 0.827 14.450 1.00 51.10 C ATOM 1756 C ALA A 119 0.828 0.168 14.237 1.00 32.31 C ATOM 1757 O ALA A 119 -0.090 0.362 15.037 1.00 12.40 O ATOM 1758 CB ALA A 119 2.920 0.143 15.574 1.00 30.41 C ATOM 0 H ALA A 119 1.324 2.344 15.609 1.00 62.20 H new ATOM 0 HA ALA A 119 2.766 0.754 13.551 1.00 51.10 H new ATOM 0 HB1 ALA A 119 3.106 -0.897 15.307 1.00 30.41 H new ATOM 0 HB2 ALA A 119 3.871 0.653 15.729 1.00 30.41 H new ATOM 0 HB3 ALA A 119 2.333 0.183 16.491 1.00 30.41 H new ATOM 1764 N GLN A 120 0.706 -0.595 13.195 1.00 1.21 N ATOM 1765 CA GLN A 120 -0.548 -1.244 12.896 1.00 30.01 C ATOM 1766 C GLN A 120 -0.332 -2.533 12.135 1.00 72.50 C ATOM 1767 O GLN A 120 0.586 -2.639 11.331 1.00 42.12 O ATOM 1768 CB GLN A 120 -1.469 -0.293 12.089 1.00 32.23 C ATOM 1769 CG GLN A 120 -2.811 -0.908 11.694 1.00 44.51 C ATOM 1770 CD GLN A 120 -3.595 -1.406 12.894 1.00 40.22 C ATOM 1771 OE1 GLN A 120 -3.503 -0.856 13.971 1.00 23.34 O ATOM 1772 NE2 GLN A 120 -4.307 -2.480 12.725 1.00 74.43 N ATOM 0 H GLN A 120 1.457 -0.788 12.532 1.00 1.21 H new ATOM 0 HA GLN A 120 -1.032 -1.488 13.842 1.00 30.01 H new ATOM 0 HB2 GLN A 120 -1.653 0.604 12.680 1.00 32.23 H new ATOM 0 HB3 GLN A 120 -0.946 0.021 11.186 1.00 32.23 H new ATOM 0 HG2 GLN A 120 -3.404 -0.166 11.159 1.00 44.51 H new ATOM 0 HG3 GLN A 120 -2.640 -1.736 11.006 1.00 44.51 H new ATOM 0 HE21 GLN A 120 -4.362 -2.916 11.805 1.00 74.43 H new ATOM 0 HE22 GLN A 120 -4.811 -2.887 13.513 1.00 74.43 H new ATOM 1781 N VAL A 121 -1.146 -3.514 12.427 1.00 32.43 N ATOM 1782 CA VAL A 121 -1.150 -4.749 11.694 1.00 33.10 C ATOM 1783 C VAL A 121 -1.991 -4.526 10.442 1.00 34.30 C ATOM 1784 O VAL A 121 -3.141 -4.078 10.527 1.00 11.44 O ATOM 1785 CB VAL A 121 -1.752 -5.911 12.533 1.00 61.01 C ATOM 1786 CG1 VAL A 121 -1.703 -7.229 11.763 1.00 51.34 C ATOM 1787 CG2 VAL A 121 -1.021 -6.046 13.860 1.00 30.13 C ATOM 0 H VAL A 121 -1.828 -3.476 13.185 1.00 32.43 H new ATOM 0 HA VAL A 121 -0.127 -5.032 11.444 1.00 33.10 H new ATOM 0 HB VAL A 121 -2.797 -5.674 12.732 1.00 61.01 H new ATOM 0 HG11 VAL A 121 -2.131 -8.024 12.374 1.00 51.34 H new ATOM 0 HG12 VAL A 121 -2.275 -7.133 10.840 1.00 51.34 H new ATOM 0 HG13 VAL A 121 -0.668 -7.472 11.524 1.00 51.34 H new ATOM 0 HG21 VAL A 121 -1.456 -6.864 14.434 1.00 30.13 H new ATOM 0 HG22 VAL A 121 0.033 -6.253 13.675 1.00 30.13 H new ATOM 0 HG23 VAL A 121 -1.115 -5.118 14.423 1.00 30.13 H new ATOM 1797 N MET A 122 -1.412 -4.782 9.308 1.00 2.15 N ATOM 1798 CA MET A 122 -2.074 -4.575 8.044 1.00 31.24 C ATOM 1799 C MET A 122 -2.749 -5.873 7.640 1.00 22.30 C ATOM 1800 O MET A 122 -2.123 -6.929 7.646 1.00 43.42 O ATOM 1801 CB MET A 122 -1.030 -4.133 7.023 1.00 22.03 C ATOM 1802 CG MET A 122 -1.543 -3.875 5.630 1.00 62.42 C ATOM 1803 SD MET A 122 -0.260 -3.207 4.541 1.00 3.15 S ATOM 1804 CE MET A 122 1.021 -4.462 4.665 1.00 44.41 C ATOM 0 H MET A 122 -0.461 -5.143 9.227 1.00 2.15 H new ATOM 0 HA MET A 122 -2.838 -3.800 8.108 1.00 31.24 H new ATOM 0 HB2 MET A 122 -0.554 -3.223 7.389 1.00 22.03 H new ATOM 0 HB3 MET A 122 -0.256 -4.898 6.969 1.00 22.03 H new ATOM 0 HG2 MET A 122 -1.927 -4.804 5.208 1.00 62.42 H new ATOM 0 HG3 MET A 122 -2.378 -3.176 5.676 1.00 62.42 H new ATOM 0 HE1 MET A 122 1.683 -4.393 3.802 1.00 44.41 H new ATOM 0 HE2 MET A 122 1.597 -4.305 5.577 1.00 44.41 H new ATOM 0 HE3 MET A 122 0.561 -5.450 4.692 1.00 44.41 H new ATOM 1814 N GLN A 123 -4.017 -5.795 7.300 1.00 21.11 N ATOM 1815 CA GLN A 123 -4.808 -6.982 7.046 1.00 15.45 C ATOM 1816 C GLN A 123 -5.522 -6.828 5.718 1.00 52.31 C ATOM 1817 O GLN A 123 -5.818 -5.699 5.310 1.00 12.01 O ATOM 1818 CB GLN A 123 -5.836 -7.133 8.164 1.00 35.52 C ATOM 1819 CG GLN A 123 -5.265 -6.849 9.548 1.00 12.34 C ATOM 1820 CD GLN A 123 -6.276 -6.953 10.632 1.00 22.14 C ATOM 1821 OE1 GLN A 123 -6.439 -8.002 11.239 1.00 61.03 O ATOM 1822 NE2 GLN A 123 -7.008 -5.902 10.842 1.00 23.20 N ATOM 0 H GLN A 123 -4.526 -4.917 7.192 1.00 21.11 H new ATOM 0 HA GLN A 123 -4.167 -7.863 7.012 1.00 15.45 H new ATOM 0 HB2 GLN A 123 -6.669 -6.456 7.976 1.00 35.52 H new ATOM 0 HB3 GLN A 123 -6.238 -8.146 8.145 1.00 35.52 H new ATOM 0 HG2 GLN A 123 -4.453 -7.548 9.749 1.00 12.34 H new ATOM 0 HG3 GLN A 123 -4.834 -5.848 9.557 1.00 12.34 H new ATOM 0 HE21 GLN A 123 -6.837 -5.047 10.312 1.00 23.20 H new ATOM 0 HE22 GLN A 123 -7.754 -5.931 11.537 1.00 23.20 H new ATOM 1831 N THR A 124 -5.791 -7.935 5.041 1.00 63.21 N ATOM 1832 CA THR A 124 -6.475 -7.891 3.759 1.00 13.12 C ATOM 1833 C THR A 124 -7.892 -7.297 3.934 1.00 3.15 C ATOM 1834 O THR A 124 -8.627 -7.634 4.890 1.00 34.12 O ATOM 1835 CB THR A 124 -6.517 -9.310 3.077 1.00 52.15 C ATOM 1836 OG1 THR A 124 -7.055 -9.238 1.749 1.00 10.30 O ATOM 1837 CG2 THR A 124 -7.330 -10.304 3.891 1.00 23.54 C ATOM 0 H THR A 124 -5.546 -8.873 5.358 1.00 63.21 H new ATOM 0 HA THR A 124 -5.913 -7.240 3.090 1.00 13.12 H new ATOM 0 HB THR A 124 -5.485 -9.658 3.027 1.00 52.15 H new ATOM 0 HG1 THR A 124 -7.216 -10.144 1.412 1.00 10.30 H new ATOM 0 HG21 THR A 124 -7.334 -11.270 3.386 1.00 23.54 H new ATOM 0 HG22 THR A 124 -6.886 -10.413 4.880 1.00 23.54 H new ATOM 0 HG23 THR A 124 -8.353 -9.942 3.990 1.00 23.54 H new ATOM 1845 N GLY A 125 -8.231 -6.372 3.074 1.00 72.50 N ATOM 1846 CA GLY A 125 -9.519 -5.738 3.124 1.00 71.13 C ATOM 1847 C GLY A 125 -9.476 -4.386 3.807 1.00 65.12 C ATOM 1848 O GLY A 125 -10.449 -3.617 3.732 1.00 64.33 O ATOM 0 H GLY A 125 -7.625 -6.040 2.324 1.00 72.50 H new ATOM 0 HA2 GLY A 125 -9.900 -5.617 2.110 1.00 71.13 H new ATOM 0 HA3 GLY A 125 -10.219 -6.386 3.652 1.00 71.13 H new ATOM 1852 N ASP A 126 -8.369 -4.084 4.467 1.00 54.34 N ATOM 1853 CA ASP A 126 -8.211 -2.798 5.139 1.00 62.42 C ATOM 1854 C ASP A 126 -7.772 -1.727 4.193 1.00 55.53 C ATOM 1855 O ASP A 126 -7.102 -2.001 3.179 1.00 34.30 O ATOM 1856 CB ASP A 126 -7.273 -2.843 6.355 1.00 61.23 C ATOM 1857 CG ASP A 126 -7.988 -3.201 7.631 1.00 74.24 C ATOM 1858 OD1 ASP A 126 -8.950 -2.492 7.992 1.00 35.44 O ATOM 1859 OD2 ASP A 126 -7.574 -4.159 8.335 1.00 35.22 O ATOM 0 H ASP A 126 -7.567 -4.708 4.553 1.00 54.34 H new ATOM 0 HA ASP A 126 -9.205 -2.556 5.516 1.00 62.42 H new ATOM 0 HB2 ASP A 126 -6.482 -3.570 6.171 1.00 61.23 H new ATOM 0 HB3 ASP A 126 -6.792 -1.872 6.473 1.00 61.23 H new ATOM 1864 N GLU A 127 -8.140 -0.511 4.512 1.00 74.54 N ATOM 1865 CA GLU A 127 -7.811 0.618 3.699 1.00 53.03 C ATOM 1866 C GLU A 127 -6.828 1.508 4.433 1.00 33.24 C ATOM 1867 O GLU A 127 -6.860 1.605 5.671 1.00 42.22 O ATOM 1868 CB GLU A 127 -9.094 1.365 3.238 1.00 72.11 C ATOM 1869 CG GLU A 127 -9.978 1.996 4.337 1.00 73.24 C ATOM 1870 CD GLU A 127 -9.491 3.357 4.806 1.00 0.20 C ATOM 1871 OE1 GLU A 127 -9.284 4.237 3.948 1.00 53.55 O ATOM 1872 OE2 GLU A 127 -9.390 3.598 6.027 1.00 23.51 O ATOM 0 H GLU A 127 -8.678 -0.283 5.348 1.00 74.54 H new ATOM 0 HA GLU A 127 -7.320 0.282 2.786 1.00 53.03 H new ATOM 0 HB2 GLU A 127 -8.795 2.156 2.550 1.00 72.11 H new ATOM 0 HB3 GLU A 127 -9.708 0.664 2.672 1.00 72.11 H new ATOM 0 HG2 GLU A 127 -10.996 2.094 3.960 1.00 73.24 H new ATOM 0 HG3 GLU A 127 -10.018 1.320 5.191 1.00 73.24 H new ATOM 1879 N ILE A 128 -5.938 2.088 3.689 1.00 24.41 N ATOM 1880 CA ILE A 128 -4.903 2.937 4.209 1.00 70.31 C ATOM 1881 C ILE A 128 -4.917 4.237 3.415 1.00 41.43 C ATOM 1882 O ILE A 128 -4.972 4.207 2.185 1.00 23.34 O ATOM 1883 CB ILE A 128 -3.497 2.261 4.047 1.00 21.12 C ATOM 1884 CG1 ILE A 128 -3.486 0.860 4.690 1.00 61.33 C ATOM 1885 CG2 ILE A 128 -2.399 3.135 4.660 1.00 44.04 C ATOM 1886 CD1 ILE A 128 -2.184 0.102 4.513 1.00 12.30 C ATOM 0 H ILE A 128 -5.908 1.983 2.675 1.00 24.41 H new ATOM 0 HA ILE A 128 -5.082 3.118 5.269 1.00 70.31 H new ATOM 0 HB ILE A 128 -3.297 2.153 2.981 1.00 21.12 H new ATOM 0 HG12 ILE A 128 -3.692 0.961 5.756 1.00 61.33 H new ATOM 0 HG13 ILE A 128 -4.297 0.270 4.262 1.00 61.33 H new ATOM 0 HG21 ILE A 128 -1.433 2.646 4.536 1.00 44.04 H new ATOM 0 HG22 ILE A 128 -2.383 4.103 4.159 1.00 44.04 H new ATOM 0 HG23 ILE A 128 -2.599 3.279 5.722 1.00 44.04 H new ATOM 0 HD11 ILE A 128 -2.262 -0.873 4.995 1.00 12.30 H new ATOM 0 HD12 ILE A 128 -1.984 -0.034 3.450 1.00 12.30 H new ATOM 0 HD13 ILE A 128 -1.370 0.667 4.966 1.00 12.30 H new ATOM 1898 N GLN A 129 -4.899 5.354 4.088 1.00 4.41 N ATOM 1899 CA GLN A 129 -4.868 6.615 3.403 1.00 14.20 C ATOM 1900 C GLN A 129 -3.598 7.357 3.737 1.00 22.11 C ATOM 1901 O GLN A 129 -3.203 7.453 4.917 1.00 53.25 O ATOM 1902 CB GLN A 129 -6.104 7.487 3.702 1.00 12.33 C ATOM 1903 CG GLN A 129 -6.168 8.780 2.860 1.00 52.22 C ATOM 1904 CD GLN A 129 -7.434 9.603 3.083 1.00 20.35 C ATOM 1905 OE1 GLN A 129 -8.487 9.061 3.412 1.00 25.32 O ATOM 1906 NE2 GLN A 129 -7.349 10.893 2.894 1.00 63.21 N ATOM 0 H GLN A 129 -4.905 5.417 5.106 1.00 4.41 H new ATOM 0 HA GLN A 129 -4.891 6.401 2.334 1.00 14.20 H new ATOM 0 HB2 GLN A 129 -7.004 6.900 3.520 1.00 12.33 H new ATOM 0 HB3 GLN A 129 -6.104 7.752 4.759 1.00 12.33 H new ATOM 0 HG2 GLN A 129 -5.300 9.397 3.093 1.00 52.22 H new ATOM 0 HG3 GLN A 129 -6.098 8.518 1.804 1.00 52.22 H new ATOM 0 HE21 GLN A 129 -6.459 11.311 2.621 1.00 63.21 H new ATOM 0 HE22 GLN A 129 -8.172 11.482 3.019 1.00 63.21 H new ATOM 1915 N ILE A 130 -2.943 7.819 2.703 1.00 24.21 N ATOM 1916 CA ILE A 130 -1.771 8.633 2.817 1.00 54.30 C ATOM 1917 C ILE A 130 -2.109 9.956 2.169 1.00 34.34 C ATOM 1918 O ILE A 130 -2.278 10.030 0.947 1.00 2.12 O ATOM 1919 CB ILE A 130 -0.483 8.028 2.120 1.00 14.54 C ATOM 1920 CG1 ILE A 130 -0.041 6.680 2.732 1.00 34.03 C ATOM 1921 CG2 ILE A 130 0.682 9.015 2.162 1.00 12.52 C ATOM 1922 CD1 ILE A 130 -0.861 5.483 2.316 1.00 72.45 C ATOM 0 H ILE A 130 -3.220 7.633 1.739 1.00 24.21 H new ATOM 0 HA ILE A 130 -1.515 8.717 3.873 1.00 54.30 H new ATOM 0 HB ILE A 130 -0.766 7.841 1.084 1.00 14.54 H new ATOM 0 HG12 ILE A 130 0.999 6.500 2.460 1.00 34.03 H new ATOM 0 HG13 ILE A 130 -0.076 6.764 3.818 1.00 34.03 H new ATOM 0 HG21 ILE A 130 1.552 8.572 1.676 1.00 12.52 H new ATOM 0 HG22 ILE A 130 0.402 9.931 1.641 1.00 12.52 H new ATOM 0 HG23 ILE A 130 0.925 9.248 3.199 1.00 12.52 H new ATOM 0 HD11 ILE A 130 -0.470 4.588 2.800 1.00 72.45 H new ATOM 0 HD12 ILE A 130 -1.899 5.632 2.613 1.00 72.45 H new ATOM 0 HD13 ILE A 130 -0.807 5.363 1.234 1.00 72.45 H new ATOM 1934 N GLY A 131 -2.272 10.962 2.974 1.00 43.04 N ATOM 1935 CA GLY A 131 -2.594 12.277 2.491 1.00 70.55 C ATOM 1936 C GLY A 131 -3.921 12.348 1.809 1.00 15.52 C ATOM 1937 O GLY A 131 -4.961 12.232 2.445 1.00 12.02 O ATOM 0 H GLY A 131 -2.186 10.897 3.988 1.00 43.04 H new ATOM 0 HA2 GLY A 131 -2.585 12.976 3.327 1.00 70.55 H new ATOM 0 HA3 GLY A 131 -1.819 12.601 1.797 1.00 70.55 H new ATOM 1941 N LYS A 132 -3.885 12.501 0.515 1.00 45.02 N ATOM 1942 CA LYS A 132 -5.087 12.691 -0.258 1.00 75.01 C ATOM 1943 C LYS A 132 -5.503 11.407 -0.970 1.00 71.10 C ATOM 1944 O LYS A 132 -6.523 11.388 -1.666 1.00 53.01 O ATOM 1945 CB LYS A 132 -4.859 13.771 -1.320 1.00 12.54 C ATOM 1946 CG LYS A 132 -4.253 15.075 -0.820 1.00 33.21 C ATOM 1947 CD LYS A 132 -5.053 15.700 0.298 1.00 42.20 C ATOM 1948 CE LYS A 132 -4.510 17.068 0.645 1.00 62.50 C ATOM 1949 NZ LYS A 132 -4.732 18.043 -0.453 1.00 23.01 N ATOM 0 H LYS A 132 -3.026 12.498 -0.035 1.00 45.02 H new ATOM 0 HA LYS A 132 -5.875 12.989 0.434 1.00 75.01 H new ATOM 0 HB2 LYS A 132 -4.208 13.362 -2.092 1.00 12.54 H new ATOM 0 HB3 LYS A 132 -5.815 13.995 -1.794 1.00 12.54 H new ATOM 0 HG2 LYS A 132 -3.236 14.889 -0.473 1.00 33.21 H new ATOM 0 HG3 LYS A 132 -4.183 15.779 -1.649 1.00 33.21 H new ATOM 0 HD2 LYS A 132 -6.098 15.783 0.001 1.00 42.20 H new ATOM 0 HD3 LYS A 132 -5.022 15.057 1.178 1.00 42.20 H new ATOM 0 HE2 LYS A 132 -4.989 17.429 1.555 1.00 62.50 H new ATOM 0 HE3 LYS A 132 -3.443 16.993 0.855 1.00 62.50 H new ATOM 0 HZ1 LYS A 132 -4.635 19.010 -0.083 1.00 23.01 H new ATOM 0 HZ2 LYS A 132 -4.029 17.887 -1.203 1.00 23.01 H new ATOM 0 HZ3 LYS A 132 -5.688 17.915 -0.843 1.00 23.01 H new ATOM 1963 N PHE A 133 -4.741 10.347 -0.820 1.00 0.41 N ATOM 1964 CA PHE A 133 -5.014 9.150 -1.582 1.00 34.22 C ATOM 1965 C PHE A 133 -5.201 7.902 -0.729 1.00 74.40 C ATOM 1966 O PHE A 133 -4.562 7.736 0.314 1.00 25.23 O ATOM 1967 CB PHE A 133 -3.990 8.968 -2.697 1.00 51.15 C ATOM 1968 CG PHE A 133 -2.560 8.990 -2.285 1.00 43.43 C ATOM 1969 CD1 PHE A 133 -1.878 10.185 -2.202 1.00 13.12 C ATOM 1970 CD2 PHE A 133 -1.893 7.827 -2.007 1.00 33.32 C ATOM 1971 CE1 PHE A 133 -0.562 10.212 -1.843 1.00 14.21 C ATOM 1972 CE2 PHE A 133 -0.572 7.848 -1.653 1.00 34.20 C ATOM 1973 CZ PHE A 133 0.095 9.051 -1.570 1.00 60.44 C ATOM 0 H PHE A 133 -3.941 10.288 -0.189 1.00 0.41 H new ATOM 0 HA PHE A 133 -5.987 9.295 -2.052 1.00 34.22 H new ATOM 0 HB2 PHE A 133 -4.189 8.018 -3.193 1.00 51.15 H new ATOM 0 HB3 PHE A 133 -4.146 9.753 -3.437 1.00 51.15 H new ATOM 0 HD1 PHE A 133 -2.391 11.109 -2.423 1.00 13.12 H new ATOM 0 HD2 PHE A 133 -2.415 6.884 -2.068 1.00 33.32 H new ATOM 0 HE1 PHE A 133 -0.041 11.155 -1.775 1.00 14.21 H new ATOM 0 HE2 PHE A 133 -0.054 6.925 -1.439 1.00 34.20 H new ATOM 0 HZ PHE A 133 1.138 9.073 -1.289 1.00 60.44 H new ATOM 1983 N ARG A 134 -6.075 7.022 -1.202 1.00 3.42 N ATOM 1984 CA ARG A 134 -6.506 5.849 -0.458 1.00 61.41 C ATOM 1985 C ARG A 134 -6.129 4.559 -1.188 1.00 74.25 C ATOM 1986 O ARG A 134 -6.359 4.416 -2.405 1.00 10.34 O ATOM 1987 CB ARG A 134 -8.025 5.931 -0.227 1.00 13.40 C ATOM 1988 CG ARG A 134 -8.421 7.199 0.513 1.00 13.01 C ATOM 1989 CD ARG A 134 -9.919 7.396 0.628 1.00 5.44 C ATOM 1990 NE ARG A 134 -10.217 8.671 1.309 1.00 10.55 N ATOM 1991 CZ ARG A 134 -11.312 9.411 1.134 1.00 23.45 C ATOM 1992 NH1 ARG A 134 -12.317 8.953 0.409 1.00 11.11 N ATOM 1993 NH2 ARG A 134 -11.404 10.614 1.699 1.00 42.21 N ATOM 0 H ARG A 134 -6.508 7.105 -2.122 1.00 3.42 H new ATOM 0 HA ARG A 134 -5.996 5.830 0.505 1.00 61.41 H new ATOM 0 HB2 ARG A 134 -8.540 5.896 -1.187 1.00 13.40 H new ATOM 0 HB3 ARG A 134 -8.353 5.061 0.343 1.00 13.40 H new ATOM 0 HG2 ARG A 134 -7.989 7.175 1.513 1.00 13.01 H new ATOM 0 HG3 ARG A 134 -7.989 8.058 -0.000 1.00 13.01 H new ATOM 0 HD2 ARG A 134 -10.370 7.392 -0.364 1.00 5.44 H new ATOM 0 HD3 ARG A 134 -10.360 6.568 1.183 1.00 5.44 H new ATOM 0 HE ARG A 134 -9.524 9.017 1.972 1.00 10.55 H new ATOM 0 HH11 ARG A 134 -12.257 8.029 -0.020 1.00 11.11 H new ATOM 0 HH12 ARG A 134 -13.153 9.523 0.278 1.00 11.11 H new ATOM 0 HH21 ARG A 134 -10.636 10.971 2.267 1.00 42.21 H new ATOM 0 HH22 ARG A 134 -12.243 11.178 1.564 1.00 42.21 H new ATOM 2007 N LEU A 135 -5.552 3.648 -0.446 1.00 23.32 N ATOM 2008 CA LEU A 135 -5.076 2.373 -0.946 1.00 22.25 C ATOM 2009 C LEU A 135 -5.757 1.260 -0.177 1.00 73.02 C ATOM 2010 O LEU A 135 -5.978 1.386 1.021 1.00 25.14 O ATOM 2011 CB LEU A 135 -3.541 2.208 -0.765 1.00 10.52 C ATOM 2012 CG LEU A 135 -2.591 3.228 -1.434 1.00 54.21 C ATOM 2013 CD1 LEU A 135 -2.625 4.579 -0.745 1.00 54.33 C ATOM 2014 CD2 LEU A 135 -1.173 2.692 -1.472 1.00 21.51 C ATOM 0 H LEU A 135 -5.393 3.772 0.554 1.00 23.32 H new ATOM 0 HA LEU A 135 -5.306 2.331 -2.011 1.00 22.25 H new ATOM 0 HB2 LEU A 135 -3.333 2.218 0.305 1.00 10.52 H new ATOM 0 HB3 LEU A 135 -3.271 1.218 -1.132 1.00 10.52 H new ATOM 0 HG LEU A 135 -2.944 3.373 -2.455 1.00 54.21 H new ATOM 0 HD11 LEU A 135 -1.942 5.262 -1.250 1.00 54.33 H new ATOM 0 HD12 LEU A 135 -3.637 4.982 -0.785 1.00 54.33 H new ATOM 0 HD13 LEU A 135 -2.321 4.465 0.295 1.00 54.33 H new ATOM 0 HD21 LEU A 135 -0.520 3.424 -1.946 1.00 21.51 H new ATOM 0 HD22 LEU A 135 -0.828 2.503 -0.455 1.00 21.51 H new ATOM 0 HD23 LEU A 135 -1.150 1.763 -2.041 1.00 21.51 H new ATOM 2026 N VAL A 136 -6.118 0.208 -0.852 1.00 73.31 N ATOM 2027 CA VAL A 136 -6.719 -0.943 -0.205 1.00 1.11 C ATOM 2028 C VAL A 136 -5.763 -2.111 -0.307 1.00 62.33 C ATOM 2029 O VAL A 136 -5.233 -2.397 -1.388 1.00 50.33 O ATOM 2030 CB VAL A 136 -8.100 -1.313 -0.817 1.00 50.12 C ATOM 2031 CG1 VAL A 136 -8.683 -2.558 -0.152 1.00 21.00 C ATOM 2032 CG2 VAL A 136 -9.062 -0.158 -0.660 1.00 65.33 C ATOM 0 H VAL A 136 -6.009 0.114 -1.862 1.00 73.31 H new ATOM 0 HA VAL A 136 -6.901 -0.693 0.840 1.00 1.11 H new ATOM 0 HB VAL A 136 -7.952 -1.525 -1.876 1.00 50.12 H new ATOM 0 HG11 VAL A 136 -9.648 -2.792 -0.601 1.00 21.00 H new ATOM 0 HG12 VAL A 136 -8.004 -3.398 -0.294 1.00 21.00 H new ATOM 0 HG13 VAL A 136 -8.814 -2.374 0.914 1.00 21.00 H new ATOM 0 HG21 VAL A 136 -10.026 -0.426 -1.092 1.00 65.33 H new ATOM 0 HG22 VAL A 136 -9.189 0.069 0.399 1.00 65.33 H new ATOM 0 HG23 VAL A 136 -8.666 0.718 -1.174 1.00 65.33 H new ATOM 2042 N PHE A 137 -5.522 -2.750 0.803 1.00 44.52 N ATOM 2043 CA PHE A 137 -4.591 -3.847 0.881 1.00 14.51 C ATOM 2044 C PHE A 137 -5.300 -5.185 0.713 1.00 25.24 C ATOM 2045 O PHE A 137 -6.345 -5.427 1.324 1.00 30.24 O ATOM 2046 CB PHE A 137 -3.860 -3.781 2.226 1.00 24.05 C ATOM 2047 CG PHE A 137 -2.945 -4.936 2.519 1.00 62.22 C ATOM 2048 CD1 PHE A 137 -1.703 -5.033 1.928 1.00 22.13 C ATOM 2049 CD2 PHE A 137 -3.326 -5.912 3.415 1.00 23.14 C ATOM 2050 CE1 PHE A 137 -0.869 -6.079 2.232 1.00 62.24 C ATOM 2051 CE2 PHE A 137 -2.498 -6.963 3.720 1.00 63.22 C ATOM 2052 CZ PHE A 137 -1.271 -7.045 3.133 1.00 24.12 C ATOM 0 H PHE A 137 -5.970 -2.523 1.691 1.00 44.52 H new ATOM 0 HA PHE A 137 -3.869 -3.763 0.069 1.00 14.51 H new ATOM 0 HB2 PHE A 137 -3.277 -2.860 2.259 1.00 24.05 H new ATOM 0 HB3 PHE A 137 -4.603 -3.717 3.021 1.00 24.05 H new ATOM 0 HD1 PHE A 137 -1.385 -4.281 1.221 1.00 22.13 H new ATOM 0 HD2 PHE A 137 -4.296 -5.848 3.886 1.00 23.14 H new ATOM 0 HE1 PHE A 137 0.103 -6.147 1.766 1.00 62.24 H new ATOM 0 HE2 PHE A 137 -2.817 -7.720 4.421 1.00 63.22 H new ATOM 0 HZ PHE A 137 -0.612 -7.867 3.373 1.00 24.12 H new ATOM 2062 N LEU A 138 -4.746 -6.034 -0.120 1.00 41.43 N ATOM 2063 CA LEU A 138 -5.264 -7.362 -0.335 1.00 31.53 C ATOM 2064 C LEU A 138 -4.156 -8.367 -0.090 1.00 11.02 C ATOM 2065 O LEU A 138 -2.968 -8.035 -0.187 1.00 75.32 O ATOM 2066 CB LEU A 138 -5.826 -7.573 -1.772 1.00 53.41 C ATOM 2067 CG LEU A 138 -7.073 -6.764 -2.210 1.00 51.10 C ATOM 2068 CD1 LEU A 138 -6.751 -5.298 -2.468 1.00 34.20 C ATOM 2069 CD2 LEU A 138 -7.708 -7.398 -3.437 1.00 1.31 C ATOM 0 H LEU A 138 -3.916 -5.819 -0.672 1.00 41.43 H new ATOM 0 HA LEU A 138 -6.092 -7.501 0.360 1.00 31.53 H new ATOM 0 HB2 LEU A 138 -5.024 -7.351 -2.476 1.00 53.41 H new ATOM 0 HB3 LEU A 138 -6.063 -8.631 -1.882 1.00 53.41 H new ATOM 0 HG LEU A 138 -7.785 -6.792 -1.385 1.00 51.10 H new ATOM 0 HD11 LEU A 138 -7.657 -4.774 -2.772 1.00 34.20 H new ATOM 0 HD12 LEU A 138 -6.359 -4.846 -1.557 1.00 34.20 H new ATOM 0 HD13 LEU A 138 -6.006 -5.223 -3.260 1.00 34.20 H new ATOM 0 HD21 LEU A 138 -8.583 -6.820 -3.734 1.00 1.31 H new ATOM 0 HD22 LEU A 138 -6.987 -7.411 -4.254 1.00 1.31 H new ATOM 0 HD23 LEU A 138 -8.010 -8.419 -3.204 1.00 1.31 H new ATOM 2081 N ALA A 139 -4.526 -9.573 0.243 1.00 2.33 N ATOM 2082 CA ALA A 139 -3.561 -10.629 0.424 1.00 43.01 C ATOM 2083 C ALA A 139 -3.077 -11.098 -0.940 1.00 55.11 C ATOM 2084 O ALA A 139 -3.825 -11.037 -1.918 1.00 2.12 O ATOM 2085 CB ALA A 139 -4.175 -11.780 1.201 1.00 14.43 C ATOM 0 H ALA A 139 -5.495 -9.853 0.396 1.00 2.33 H new ATOM 0 HA ALA A 139 -2.713 -10.254 0.997 1.00 43.01 H new ATOM 0 HB1 ALA A 139 -3.434 -12.569 1.329 1.00 14.43 H new ATOM 0 HB2 ALA A 139 -4.501 -11.426 2.179 1.00 14.43 H new ATOM 0 HB3 ALA A 139 -5.032 -12.173 0.653 1.00 14.43 H new ATOM 2091 N GLY A 140 -1.844 -11.535 -1.006 1.00 63.51 N ATOM 2092 CA GLY A 140 -1.281 -11.963 -2.258 1.00 11.14 C ATOM 2093 C GLY A 140 -1.792 -13.313 -2.673 1.00 2.13 C ATOM 2094 O GLY A 140 -1.870 -14.230 -1.833 1.00 65.13 O ATOM 0 H GLY A 140 -1.213 -11.603 -0.207 1.00 63.51 H new ATOM 0 HA2 GLY A 140 -1.519 -11.232 -3.031 1.00 11.14 H new ATOM 0 HA3 GLY A 140 -0.195 -11.997 -2.174 1.00 11.14 H new ATOM 2098 N PRO A 141 -2.137 -13.475 -3.960 1.00 4.32 N ATOM 2099 CA PRO A 141 -2.691 -14.717 -4.490 1.00 45.45 C ATOM 2100 C PRO A 141 -1.714 -15.870 -4.390 1.00 53.03 C ATOM 2101 O PRO A 141 -0.488 -15.677 -4.404 1.00 12.45 O ATOM 2102 CB PRO A 141 -2.971 -14.399 -5.954 1.00 33.42 C ATOM 2103 CG PRO A 141 -2.084 -13.251 -6.272 1.00 14.44 C ATOM 2104 CD PRO A 141 -1.991 -12.453 -5.014 1.00 44.31 C ATOM 0 HA PRO A 141 -3.574 -15.030 -3.932 1.00 45.45 H new ATOM 0 HB2 PRO A 141 -2.754 -15.255 -6.593 1.00 33.42 H new ATOM 0 HB3 PRO A 141 -4.019 -14.143 -6.109 1.00 33.42 H new ATOM 0 HG2 PRO A 141 -1.100 -13.593 -6.592 1.00 14.44 H new ATOM 0 HG3 PRO A 141 -2.494 -12.653 -7.086 1.00 14.44 H new ATOM 0 HD2 PRO A 141 -1.038 -11.929 -4.938 1.00 44.31 H new ATOM 0 HD3 PRO A 141 -2.776 -11.699 -4.956 1.00 44.31 H new ATOM 2112 N ALA A 142 -2.244 -17.058 -4.327 1.00 43.31 N ATOM 2113 CA ALA A 142 -1.429 -18.220 -4.137 1.00 22.51 C ATOM 2114 C ALA A 142 -1.564 -19.185 -5.289 1.00 32.12 C ATOM 2115 O ALA A 142 -2.155 -20.255 -5.153 1.00 62.44 O ATOM 2116 CB ALA A 142 -1.726 -18.899 -2.804 1.00 54.02 C ATOM 0 H ALA A 142 -3.243 -17.246 -4.405 1.00 43.31 H new ATOM 0 HA ALA A 142 -0.391 -17.888 -4.110 1.00 22.51 H new ATOM 0 HB1 ALA A 142 -1.090 -19.777 -2.693 1.00 54.02 H new ATOM 0 HB2 ALA A 142 -1.529 -18.203 -1.989 1.00 54.02 H new ATOM 0 HB3 ALA A 142 -2.772 -19.203 -2.776 1.00 54.02 H new ATOM 2122 N GLU A 143 -1.120 -18.761 -6.438 1.00 62.31 N ATOM 2123 CA GLU A 143 -1.051 -19.605 -7.571 1.00 1.14 C ATOM 2124 C GLU A 143 0.277 -20.316 -7.540 1.00 74.44 C ATOM 2125 O GLU A 143 0.338 -21.461 -7.070 1.00 36.93 O ATOM 2126 CB GLU A 143 -1.194 -18.816 -8.872 1.00 75.35 C ATOM 2127 CG GLU A 143 -2.617 -18.416 -9.277 1.00 44.34 C ATOM 2128 CD GLU A 143 -3.236 -17.353 -8.412 1.00 32.25 C ATOM 2129 OE1 GLU A 143 -2.960 -16.162 -8.648 1.00 74.15 O ATOM 2130 OE2 GLU A 143 -4.037 -17.691 -7.501 1.00 41.51 O ATOM 2131 OXT GLU A 143 1.299 -19.699 -7.905 1.00 36.93 O ATOM 0 H GLU A 143 -0.795 -17.808 -6.604 1.00 62.31 H new ATOM 0 HA GLU A 143 -1.874 -20.319 -7.538 1.00 1.14 H new ATOM 0 HB2 GLU A 143 -0.596 -17.909 -8.788 1.00 75.35 H new ATOM 0 HB3 GLU A 143 -0.763 -19.408 -9.679 1.00 75.35 H new ATOM 0 HG2 GLU A 143 -2.602 -18.064 -10.309 1.00 44.34 H new ATOM 0 HG3 GLU A 143 -3.251 -19.302 -9.252 1.00 44.34 H new TER 2138 GLU A 143