USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1162 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 147 ASN : amide:sc= 0.221 K(o=1.7,f=-1.9) USER MOD Set 1.2: A 151 LYS NZ :NH3+ 169:sc= 1.5 (180deg=1.2) USER MOD Set 2.1: A 8 ASN : amide:sc= 0.131 K(o=0.042,f=-4.7!) USER MOD Set 2.2: A 123 THR OG1 : rot 180:sc= -0.089 USER MOD Set 3.1: A 17 SER OG : rot 180:sc= 0.583 USER MOD Set 3.2: A 115 LYS NZ :NH3+ -173:sc= 0.583 (180deg=-0.00666) USER MOD Set 4.1: A 91 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 92 SER OG : rot 180:sc=-0.00116 USER MOD Set 5.1: A 15 THR OG1 : rot -75:sc= 0.372 USER MOD Set 5.2: A 117 THR OG1 : rot 180:sc= 0.351 USER MOD Single : A 5 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0423) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00406) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 LYS NZ :NH3+ -119:sc= 1.27 (180deg=-0.0111) USER MOD Single : A 27 TYR OH : rot 180:sc= 0.321 USER MOD Single : A 28 THR OG1 : rot 180:sc= -1.91! USER MOD Single : A 29 LYS NZ :NH3+ -171:sc= 0.447 (180deg=0.349) USER MOD Single : A 35 GLN : amide:sc= -0.0307 X(o=-0.031,f=-0.026) USER MOD Single : A 38 HIS : no HE2:sc= 0.385 K(o=0.38,f=-1.7) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 43 SER OG : rot 180:sc= -0.115 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc=-0.00618 K(o=-0.0062,f=-2) USER MOD Single : A 52 THR OG1 : rot 180:sc= -0.149 USER MOD Single : A 53 LYS NZ :NH3+ 155:sc= 1.23 (180deg=0.675) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 29:sc= 0.254 USER MOD Single : A 62 GLN : amide:sc= -0.0336 X(o=-0.034,f=-0.16) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 66 MET CE :methyl 163:sc= -0.0866 (180deg=-0.434) USER MOD Single : A 68 SER OG : rot 180:sc= -0.138 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 89:sc= 1.14 USER MOD Single : A 76 GLN : amide:sc= -0.105 K(o=-0.1,f=-0.99) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.115) USER MOD Single : A 96 LYS NZ :NH3+ -161:sc= 0.322 (180deg=0.0257) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -158:sc= -0.106 (180deg=-0.645) USER MOD Single : A 103 MET CE :methyl 147:sc= -0.971 (180deg=-2.48) USER MOD Single : A 104 HIS : no HE2:sc= -0.271 K(o=-0.27,f=-1.4) USER MOD Single : A 106 THR OG1 : rot -13:sc= 0.739 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 116 THR OG1 : rot 67:sc= 0.835 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 37:sc= -1.02! USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= -0.447 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0.145 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= 0.26 X(o=0.26,f=0) USER MOD Single : A 132 GLN : amide:sc= 0.0974 K(o=0.097,f=-0.61) USER MOD Single : A 136 MET CE :methyl -162:sc= -0.0823 (180deg=-0.459) USER MOD Single : A 140 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 MET CE :methyl -141:sc= -1.56 (180deg=-2.89!) USER MOD Single : A 143 ASN : amide:sc= 0.142 K(o=0.14,f=-0.56) USER MOD Single : A 144 SER OG : rot 77:sc= 0.53 USER MOD Single : A 145 THR OG1 : rot 80:sc= 0.102 USER MOD Single : A 148 GLN : amide:sc= 0.0935 X(o=0.093,f=-0.0069) USER MOD Single : A 154 ASN : amide:sc= 0.525 K(o=0.53,f=0) USER MOD Single : A 155 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.42) USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 3.646 -16.395 -1.725 1.00 24.21 N ATOM 35 CA ILE A 3 4.192 -15.295 -2.556 1.00 35.51 C ATOM 36 C ILE A 3 5.698 -15.475 -2.886 1.00 62.34 C ATOM 37 O ILE A 3 6.456 -16.056 -2.101 1.00 55.41 O ATOM 38 CB ILE A 3 3.937 -13.904 -1.865 1.00 52.13 C ATOM 39 CG1 ILE A 3 4.613 -13.833 -0.454 1.00 45.12 C ATOM 40 CG2 ILE A 3 2.415 -13.631 -1.777 1.00 54.42 C ATOM 41 CD1 ILE A 3 4.387 -12.539 0.312 1.00 72.32 C ATOM 0 HA ILE A 3 3.660 -15.326 -3.507 1.00 35.51 H new ATOM 0 HB ILE A 3 4.395 -13.125 -2.475 1.00 52.13 H new ATOM 0 HG12 ILE A 3 4.244 -14.662 0.149 1.00 45.12 H new ATOM 0 HG13 ILE A 3 5.686 -13.981 -0.576 1.00 45.12 H new ATOM 0 HG21 ILE A 3 2.245 -12.667 -1.298 1.00 54.42 H new ATOM 0 HG22 ILE A 3 1.989 -13.617 -2.780 1.00 54.42 H new ATOM 0 HG23 ILE A 3 1.938 -14.416 -1.191 1.00 54.42 H new ATOM 0 HD11 ILE A 3 4.896 -12.592 1.274 1.00 72.32 H new ATOM 0 HD12 ILE A 3 4.784 -11.702 -0.263 1.00 72.32 H new ATOM 0 HD13 ILE A 3 3.319 -12.394 0.474 1.00 72.32 H new ATOM 53 N GLU A 4 6.113 -14.974 -4.066 1.00 10.31 N ATOM 54 CA GLU A 4 7.511 -15.081 -4.554 1.00 60.30 C ATOM 55 C GLU A 4 8.294 -13.780 -4.270 1.00 4.23 C ATOM 56 O GLU A 4 7.715 -12.701 -4.194 1.00 44.13 O ATOM 57 CB GLU A 4 7.567 -15.427 -6.079 1.00 71.41 C ATOM 58 CG GLU A 4 6.929 -14.400 -7.055 1.00 74.14 C ATOM 59 CD GLU A 4 5.409 -14.584 -7.272 1.00 13.12 C ATOM 60 OE1 GLU A 4 4.600 -14.083 -6.458 1.00 44.01 O ATOM 61 OE2 GLU A 4 5.018 -15.262 -8.248 1.00 12.14 O ATOM 0 H GLU A 4 5.493 -14.483 -4.710 1.00 10.31 H new ATOM 0 HA GLU A 4 7.982 -15.899 -4.009 1.00 60.30 H new ATOM 0 HB2 GLU A 4 8.612 -15.558 -6.359 1.00 71.41 H new ATOM 0 HB3 GLU A 4 7.074 -16.388 -6.228 1.00 71.41 H new ATOM 0 HG2 GLU A 4 7.110 -13.395 -6.675 1.00 74.14 H new ATOM 0 HG3 GLU A 4 7.433 -14.472 -8.019 1.00 74.14 H new ATOM 68 N LYS A 5 9.624 -13.900 -4.086 1.00 41.31 N ATOM 69 CA LYS A 5 10.506 -12.754 -3.741 1.00 30.15 C ATOM 70 C LYS A 5 11.752 -12.741 -4.658 1.00 33.03 C ATOM 71 O LYS A 5 12.310 -13.801 -4.975 1.00 31.44 O ATOM 72 CB LYS A 5 10.973 -12.793 -2.244 1.00 11.12 C ATOM 73 CG LYS A 5 9.864 -13.009 -1.182 1.00 72.21 C ATOM 74 CD LYS A 5 9.448 -14.499 -0.997 1.00 41.20 C ATOM 75 CE LYS A 5 10.609 -15.388 -0.516 1.00 12.54 C ATOM 76 NZ LYS A 5 10.202 -16.807 -0.388 1.00 2.45 N ATOM 0 H LYS A 5 10.120 -14.787 -4.171 1.00 41.31 H new ATOM 0 HA LYS A 5 9.919 -11.848 -3.890 1.00 30.15 H new ATOM 0 HB2 LYS A 5 11.709 -13.590 -2.136 1.00 11.12 H new ATOM 0 HB3 LYS A 5 11.483 -11.856 -2.020 1.00 11.12 H new ATOM 0 HG2 LYS A 5 10.210 -12.617 -0.225 1.00 72.21 H new ATOM 0 HG3 LYS A 5 8.986 -12.429 -1.465 1.00 72.21 H new ATOM 0 HD2 LYS A 5 8.631 -14.557 -0.278 1.00 41.20 H new ATOM 0 HD3 LYS A 5 9.068 -14.885 -1.943 1.00 41.20 H new ATOM 0 HE2 LYS A 5 11.440 -15.311 -1.217 1.00 12.54 H new ATOM 0 HE3 LYS A 5 10.969 -15.025 0.447 1.00 12.54 H new ATOM 0 HZ1 LYS A 5 10.945 -17.338 0.110 1.00 2.45 H new ATOM 0 HZ2 LYS A 5 9.314 -16.866 0.150 1.00 2.45 H new ATOM 0 HZ3 LYS A 5 10.061 -17.214 -1.334 1.00 2.45 H new ATOM 90 N LYS A 6 12.183 -11.536 -5.071 1.00 31.22 N ATOM 91 CA LYS A 6 13.420 -11.334 -5.859 1.00 53.13 C ATOM 92 C LYS A 6 14.458 -10.539 -5.030 1.00 64.15 C ATOM 93 O LYS A 6 14.516 -9.306 -5.114 1.00 42.50 O ATOM 94 CB LYS A 6 13.109 -10.619 -7.210 1.00 13.33 C ATOM 95 CG LYS A 6 12.133 -11.389 -8.130 1.00 60.50 C ATOM 96 CD LYS A 6 11.959 -10.739 -9.526 1.00 3.23 C ATOM 97 CE LYS A 6 11.396 -9.308 -9.469 1.00 74.24 C ATOM 98 NZ LYS A 6 11.196 -8.742 -10.830 1.00 63.11 N ATOM 0 H LYS A 6 11.684 -10.670 -4.869 1.00 31.22 H new ATOM 0 HA LYS A 6 13.846 -12.310 -6.094 1.00 53.13 H new ATOM 0 HB2 LYS A 6 12.690 -9.635 -6.998 1.00 13.33 H new ATOM 0 HB3 LYS A 6 14.044 -10.459 -7.746 1.00 13.33 H new ATOM 0 HG2 LYS A 6 12.493 -12.410 -8.255 1.00 60.50 H new ATOM 0 HG3 LYS A 6 11.160 -11.452 -7.643 1.00 60.50 H new ATOM 0 HD2 LYS A 6 12.924 -10.722 -10.033 1.00 3.23 H new ATOM 0 HD3 LYS A 6 11.294 -11.359 -10.127 1.00 3.23 H new ATOM 0 HE2 LYS A 6 10.447 -9.311 -8.933 1.00 74.24 H new ATOM 0 HE3 LYS A 6 12.078 -8.671 -8.906 1.00 74.24 H new ATOM 0 HZ1 LYS A 6 10.816 -7.777 -10.752 1.00 63.11 H new ATOM 0 HZ2 LYS A 6 12.106 -8.716 -11.332 1.00 63.11 H new ATOM 0 HZ3 LYS A 6 10.526 -9.337 -11.358 1.00 63.11 H new ATOM 112 N LYS A 7 15.254 -11.278 -4.213 1.00 61.30 N ATOM 113 CA LYS A 7 16.367 -10.728 -3.382 1.00 52.32 C ATOM 114 C LYS A 7 15.848 -9.767 -2.272 1.00 51.44 C ATOM 115 O LYS A 7 15.621 -10.189 -1.130 1.00 73.10 O ATOM 116 CB LYS A 7 17.493 -10.061 -4.264 1.00 42.23 C ATOM 117 CG LYS A 7 18.509 -11.032 -4.941 1.00 54.32 C ATOM 118 CD LYS A 7 17.882 -12.121 -5.855 1.00 30.40 C ATOM 119 CE LYS A 7 17.174 -11.563 -7.109 1.00 71.22 C ATOM 120 NZ LYS A 7 18.089 -10.829 -8.018 1.00 65.34 N ATOM 0 H LYS A 7 15.142 -12.287 -4.109 1.00 61.30 H new ATOM 0 HA LYS A 7 16.827 -11.576 -2.874 1.00 52.32 H new ATOM 0 HB2 LYS A 7 17.012 -9.472 -5.044 1.00 42.23 H new ATOM 0 HB3 LYS A 7 18.051 -9.365 -3.637 1.00 42.23 H new ATOM 0 HG2 LYS A 7 19.209 -10.443 -5.534 1.00 54.32 H new ATOM 0 HG3 LYS A 7 19.089 -11.526 -4.161 1.00 54.32 H new ATOM 0 HD2 LYS A 7 18.665 -12.810 -6.170 1.00 30.40 H new ATOM 0 HD3 LYS A 7 17.164 -12.699 -5.273 1.00 30.40 H new ATOM 0 HE2 LYS A 7 16.713 -12.386 -7.655 1.00 71.22 H new ATOM 0 HE3 LYS A 7 16.369 -10.897 -6.798 1.00 71.22 H new ATOM 0 HZ1 LYS A 7 17.559 -10.494 -8.848 1.00 65.34 H new ATOM 0 HZ2 LYS A 7 18.497 -10.015 -7.516 1.00 65.34 H new ATOM 0 HZ3 LYS A 7 18.853 -11.463 -8.328 1.00 65.34 H new ATOM 134 N ASN A 8 15.645 -8.483 -2.624 1.00 20.22 N ATOM 135 CA ASN A 8 15.150 -7.437 -1.690 1.00 24.32 C ATOM 136 C ASN A 8 13.749 -6.912 -2.104 1.00 44.11 C ATOM 137 O ASN A 8 13.231 -5.989 -1.493 1.00 72.24 O ATOM 138 CB ASN A 8 16.166 -6.268 -1.615 1.00 61.45 C ATOM 139 CG ASN A 8 16.391 -5.564 -2.961 1.00 2.12 C ATOM 140 OD1 ASN A 8 16.285 -6.159 -4.032 1.00 53.54 O ATOM 141 ND2 ASN A 8 16.711 -4.297 -2.917 1.00 3.41 N ATOM 0 H ASN A 8 15.819 -8.134 -3.567 1.00 20.22 H new ATOM 0 HA ASN A 8 15.050 -7.890 -0.704 1.00 24.32 H new ATOM 0 HB2 ASN A 8 15.814 -5.538 -0.886 1.00 61.45 H new ATOM 0 HB3 ASN A 8 17.120 -6.649 -1.249 1.00 61.45 H new ATOM 0 HD21 ASN A 8 16.878 -3.783 -3.782 1.00 3.41 H new ATOM 0 HD22 ASN A 8 16.794 -3.823 -2.018 1.00 3.41 H new ATOM 148 N LYS A 9 13.151 -7.519 -3.139 1.00 32.35 N ATOM 149 CA LYS A 9 11.767 -7.223 -3.588 1.00 1.53 C ATOM 150 C LYS A 9 10.814 -8.370 -3.188 1.00 3.24 C ATOM 151 O LYS A 9 11.183 -9.540 -3.257 1.00 11.33 O ATOM 152 CB LYS A 9 11.742 -6.995 -5.133 1.00 30.43 C ATOM 153 CG LYS A 9 12.408 -5.669 -5.563 1.00 73.23 C ATOM 154 CD LYS A 9 12.403 -5.404 -7.087 1.00 20.41 C ATOM 155 CE LYS A 9 13.398 -6.287 -7.854 1.00 50.24 C ATOM 156 NZ LYS A 9 13.526 -5.873 -9.274 1.00 31.31 N ATOM 0 H LYS A 9 13.612 -8.237 -3.698 1.00 32.35 H new ATOM 0 HA LYS A 9 11.425 -6.311 -3.098 1.00 1.53 H new ATOM 0 HB2 LYS A 9 12.249 -7.825 -5.625 1.00 30.43 H new ATOM 0 HB3 LYS A 9 10.708 -7.004 -5.478 1.00 30.43 H new ATOM 0 HG2 LYS A 9 11.899 -4.845 -5.064 1.00 73.23 H new ATOM 0 HG3 LYS A 9 13.440 -5.666 -5.212 1.00 73.23 H new ATOM 0 HD2 LYS A 9 11.399 -5.575 -7.476 1.00 20.41 H new ATOM 0 HD3 LYS A 9 12.641 -4.356 -7.269 1.00 20.41 H new ATOM 0 HE2 LYS A 9 14.374 -6.237 -7.372 1.00 50.24 H new ATOM 0 HE3 LYS A 9 13.072 -7.326 -7.807 1.00 50.24 H new ATOM 0 HZ1 LYS A 9 14.207 -6.494 -9.757 1.00 31.31 H new ATOM 0 HZ2 LYS A 9 12.600 -5.945 -9.741 1.00 31.31 H new ATOM 0 HZ3 LYS A 9 13.861 -4.890 -9.320 1.00 31.31 H new ATOM 170 N ILE A 10 9.584 -8.016 -2.772 1.00 32.32 N ATOM 171 CA ILE A 10 8.508 -8.994 -2.483 1.00 75.01 C ATOM 172 C ILE A 10 7.375 -8.797 -3.502 1.00 1.11 C ATOM 173 O ILE A 10 6.866 -7.685 -3.665 1.00 20.03 O ATOM 174 CB ILE A 10 7.916 -8.834 -1.021 1.00 11.41 C ATOM 175 CG1 ILE A 10 9.009 -9.098 0.061 1.00 1.02 C ATOM 176 CG2 ILE A 10 6.689 -9.764 -0.798 1.00 11.35 C ATOM 177 CD1 ILE A 10 8.536 -8.951 1.506 1.00 53.22 C ATOM 0 H ILE A 10 9.304 -7.046 -2.626 1.00 32.32 H new ATOM 0 HA ILE A 10 8.940 -9.992 -2.555 1.00 75.01 H new ATOM 0 HB ILE A 10 7.577 -7.803 -0.920 1.00 11.41 H new ATOM 0 HG12 ILE A 10 9.399 -10.106 -0.077 1.00 1.02 H new ATOM 0 HG13 ILE A 10 9.838 -8.410 -0.106 1.00 1.02 H new ATOM 0 HG21 ILE A 10 6.309 -9.628 0.214 1.00 11.35 H new ATOM 0 HG22 ILE A 10 5.908 -9.514 -1.516 1.00 11.35 H new ATOM 0 HG23 ILE A 10 6.990 -10.803 -0.936 1.00 11.35 H new ATOM 0 HD11 ILE A 10 9.366 -9.154 2.183 1.00 53.22 H new ATOM 0 HD12 ILE A 10 8.175 -7.936 1.669 1.00 53.22 H new ATOM 0 HD13 ILE A 10 7.729 -9.658 1.699 1.00 53.22 H new ATOM 189 N ILE A 11 7.013 -9.880 -4.196 1.00 14.41 N ATOM 190 CA ILE A 11 5.885 -9.897 -5.134 1.00 43.21 C ATOM 191 C ILE A 11 4.660 -10.534 -4.438 1.00 72.31 C ATOM 192 O ILE A 11 4.615 -11.751 -4.234 1.00 35.54 O ATOM 193 CB ILE A 11 6.256 -10.703 -6.432 1.00 44.24 C ATOM 194 CG1 ILE A 11 7.563 -10.139 -7.081 1.00 40.24 C ATOM 195 CG2 ILE A 11 5.089 -10.710 -7.450 1.00 51.33 C ATOM 196 CD1 ILE A 11 8.101 -10.967 -8.240 1.00 61.02 C ATOM 0 H ILE A 11 7.497 -10.775 -4.123 1.00 14.41 H new ATOM 0 HA ILE A 11 5.647 -8.875 -5.429 1.00 43.21 H new ATOM 0 HB ILE A 11 6.439 -11.737 -6.139 1.00 44.24 H new ATOM 0 HG12 ILE A 11 7.370 -9.126 -7.434 1.00 40.24 H new ATOM 0 HG13 ILE A 11 8.333 -10.068 -6.313 1.00 40.24 H new ATOM 0 HG21 ILE A 11 5.381 -11.276 -8.334 1.00 51.33 H new ATOM 0 HG22 ILE A 11 4.213 -11.173 -6.996 1.00 51.33 H new ATOM 0 HG23 ILE A 11 4.850 -9.686 -7.737 1.00 51.33 H new ATOM 0 HD11 ILE A 11 9.007 -10.503 -8.629 1.00 61.02 H new ATOM 0 HD12 ILE A 11 8.330 -11.974 -7.892 1.00 61.02 H new ATOM 0 HD13 ILE A 11 7.352 -11.017 -9.030 1.00 61.02 H new ATOM 208 N PHE A 12 3.684 -9.695 -4.055 1.00 70.30 N ATOM 209 CA PHE A 12 2.422 -10.147 -3.441 1.00 71.35 C ATOM 210 C PHE A 12 1.291 -10.025 -4.482 1.00 22.15 C ATOM 211 O PHE A 12 0.968 -8.922 -4.938 1.00 52.54 O ATOM 212 CB PHE A 12 2.095 -9.295 -2.173 1.00 54.04 C ATOM 213 CG PHE A 12 1.002 -9.875 -1.252 1.00 21.43 C ATOM 214 CD1 PHE A 12 -0.348 -9.717 -1.553 1.00 62.34 C ATOM 215 CD2 PHE A 12 1.327 -10.569 -0.083 1.00 1.12 C ATOM 216 CE1 PHE A 12 -1.331 -10.230 -0.729 1.00 73.53 C ATOM 217 CE2 PHE A 12 0.341 -11.080 0.744 1.00 33.22 C ATOM 218 CZ PHE A 12 -0.987 -10.915 0.418 1.00 41.24 C ATOM 0 H PHE A 12 3.747 -8.683 -4.162 1.00 70.30 H new ATOM 0 HA PHE A 12 2.519 -11.187 -3.128 1.00 71.35 H new ATOM 0 HB2 PHE A 12 3.009 -9.173 -1.592 1.00 54.04 H new ATOM 0 HB3 PHE A 12 1.786 -8.300 -2.494 1.00 54.04 H new ATOM 0 HD1 PHE A 12 -0.632 -9.183 -2.448 1.00 62.34 H new ATOM 0 HD2 PHE A 12 2.365 -10.709 0.180 1.00 1.12 H new ATOM 0 HE1 PHE A 12 -2.372 -10.094 -0.983 1.00 73.53 H new ATOM 0 HE2 PHE A 12 0.614 -11.608 1.646 1.00 33.22 H new ATOM 0 HZ PHE A 12 -1.756 -11.321 1.058 1.00 41.24 H new ATOM 228 N THR A 13 0.694 -11.158 -4.859 1.00 62.41 N ATOM 229 CA THR A 13 -0.486 -11.170 -5.743 1.00 73.15 C ATOM 230 C THR A 13 -1.757 -11.387 -4.900 1.00 34.41 C ATOM 231 O THR A 13 -1.730 -12.060 -3.859 1.00 52.23 O ATOM 232 CB THR A 13 -0.391 -12.267 -6.854 1.00 14.23 C ATOM 233 OG1 THR A 13 -1.500 -12.146 -7.766 1.00 73.01 O ATOM 234 CG2 THR A 13 -0.373 -13.684 -6.267 1.00 23.24 C ATOM 0 H THR A 13 1.006 -12.084 -4.568 1.00 62.41 H new ATOM 0 HA THR A 13 -0.528 -10.205 -6.248 1.00 73.15 H new ATOM 0 HB THR A 13 0.549 -12.108 -7.382 1.00 14.23 H new ATOM 0 HG1 THR A 13 -1.431 -12.836 -8.459 1.00 73.01 H new ATOM 0 HG21 THR A 13 -0.306 -14.412 -7.076 1.00 23.24 H new ATOM 0 HG22 THR A 13 0.488 -13.794 -5.608 1.00 23.24 H new ATOM 0 HG23 THR A 13 -1.288 -13.855 -5.700 1.00 23.24 H new ATOM 242 N ARG A 14 -2.860 -10.793 -5.354 1.00 10.11 N ATOM 243 CA ARG A 14 -4.157 -10.835 -4.656 1.00 53.54 C ATOM 244 C ARG A 14 -5.294 -10.553 -5.650 1.00 71.14 C ATOM 245 O ARG A 14 -5.104 -9.825 -6.626 1.00 11.45 O ATOM 246 CB ARG A 14 -4.219 -9.812 -3.478 1.00 0.24 C ATOM 247 CG ARG A 14 -3.960 -8.324 -3.866 1.00 51.42 C ATOM 248 CD ARG A 14 -2.466 -7.958 -3.887 1.00 74.04 C ATOM 249 NE ARG A 14 -2.184 -6.658 -4.524 1.00 61.25 N ATOM 250 CZ ARG A 14 -2.190 -5.489 -3.934 1.00 5.51 C ATOM 251 NH1 ARG A 14 -2.583 -5.356 -2.715 1.00 51.34 N ATOM 252 NH2 ARG A 14 -1.824 -4.442 -4.588 1.00 61.12 N ATOM 0 H ARG A 14 -2.885 -10.262 -6.225 1.00 10.11 H new ATOM 0 HA ARG A 14 -4.273 -11.833 -4.234 1.00 53.54 H new ATOM 0 HB2 ARG A 14 -5.201 -9.882 -3.011 1.00 0.24 H new ATOM 0 HB3 ARG A 14 -3.487 -10.106 -2.726 1.00 0.24 H new ATOM 0 HG2 ARG A 14 -4.389 -8.131 -4.849 1.00 51.42 H new ATOM 0 HG3 ARG A 14 -4.477 -7.675 -3.159 1.00 51.42 H new ATOM 0 HD2 ARG A 14 -2.091 -7.940 -2.864 1.00 74.04 H new ATOM 0 HD3 ARG A 14 -1.917 -8.738 -4.415 1.00 74.04 H new ATOM 0 HE ARG A 14 -1.963 -6.671 -5.520 1.00 61.25 H new ATOM 0 HH11 ARG A 14 -2.898 -6.171 -2.189 1.00 51.34 H new ATOM 0 HH12 ARG A 14 -2.579 -4.436 -2.275 1.00 51.34 H new ATOM 0 HH21 ARG A 14 -1.531 -4.525 -5.561 1.00 61.12 H new ATOM 0 HH22 ARG A 14 -1.827 -3.529 -4.133 1.00 61.12 H new ATOM 266 N THR A 15 -6.482 -11.095 -5.364 1.00 51.20 N ATOM 267 CA THR A 15 -7.651 -10.998 -6.271 1.00 53.41 C ATOM 268 C THR A 15 -8.915 -10.584 -5.487 1.00 60.13 C ATOM 269 O THR A 15 -9.364 -11.303 -4.591 1.00 1.44 O ATOM 270 CB THR A 15 -7.911 -12.346 -7.034 1.00 23.35 C ATOM 271 OG1 THR A 15 -6.704 -12.780 -7.689 1.00 22.13 O ATOM 272 CG2 THR A 15 -9.032 -12.210 -8.091 1.00 14.30 C ATOM 0 H THR A 15 -6.669 -11.612 -4.505 1.00 51.20 H new ATOM 0 HA THR A 15 -7.422 -10.232 -7.012 1.00 53.41 H new ATOM 0 HB THR A 15 -8.228 -13.079 -6.292 1.00 23.35 H new ATOM 0 HG1 THR A 15 -6.545 -12.227 -8.482 1.00 22.13 H new ATOM 0 HG21 THR A 15 -9.177 -13.167 -8.593 1.00 14.30 H new ATOM 0 HG22 THR A 15 -9.960 -11.913 -7.601 1.00 14.30 H new ATOM 0 HG23 THR A 15 -8.751 -11.454 -8.824 1.00 14.30 H new ATOM 280 N PHE A 16 -9.468 -9.402 -5.826 1.00 2.33 N ATOM 281 CA PHE A 16 -10.711 -8.864 -5.224 1.00 72.04 C ATOM 282 C PHE A 16 -11.788 -8.719 -6.322 1.00 54.13 C ATOM 283 O PHE A 16 -11.536 -8.077 -7.347 1.00 54.13 O ATOM 284 CB PHE A 16 -10.442 -7.480 -4.559 1.00 11.03 C ATOM 285 CG PHE A 16 -9.243 -7.465 -3.611 1.00 1.33 C ATOM 286 CD1 PHE A 16 -9.183 -8.343 -2.531 1.00 53.35 C ATOM 287 CD2 PHE A 16 -8.168 -6.596 -3.815 1.00 23.22 C ATOM 288 CE1 PHE A 16 -8.096 -8.350 -1.683 1.00 0.03 C ATOM 289 CE2 PHE A 16 -7.079 -6.607 -2.966 1.00 14.35 C ATOM 290 CZ PHE A 16 -7.043 -7.484 -1.903 1.00 64.50 C ATOM 0 H PHE A 16 -9.063 -8.786 -6.531 1.00 2.33 H new ATOM 0 HA PHE A 16 -11.061 -9.553 -4.455 1.00 72.04 H new ATOM 0 HB2 PHE A 16 -10.282 -6.738 -5.341 1.00 11.03 H new ATOM 0 HB3 PHE A 16 -11.331 -7.175 -4.007 1.00 11.03 H new ATOM 0 HD1 PHE A 16 -10.000 -9.028 -2.356 1.00 53.35 H new ATOM 0 HD2 PHE A 16 -8.189 -5.907 -4.647 1.00 23.22 H new ATOM 0 HE1 PHE A 16 -8.068 -9.033 -0.847 1.00 0.03 H new ATOM 0 HE2 PHE A 16 -6.256 -5.929 -3.135 1.00 14.35 H new ATOM 0 HZ PHE A 16 -6.190 -7.494 -1.241 1.00 64.50 H new ATOM 300 N SER A 17 -12.975 -9.316 -6.107 1.00 4.22 N ATOM 301 CA SER A 17 -14.107 -9.214 -7.057 1.00 5.52 C ATOM 302 C SER A 17 -14.691 -7.779 -7.032 1.00 22.33 C ATOM 303 O SER A 17 -15.521 -7.442 -6.175 1.00 14.34 O ATOM 304 CB SER A 17 -15.191 -10.259 -6.707 1.00 24.00 C ATOM 305 OG SER A 17 -14.647 -11.569 -6.697 1.00 43.51 O ATOM 0 H SER A 17 -13.179 -9.878 -5.280 1.00 4.22 H new ATOM 0 HA SER A 17 -13.749 -9.421 -8.065 1.00 5.52 H new ATOM 0 HB2 SER A 17 -15.619 -10.031 -5.731 1.00 24.00 H new ATOM 0 HB3 SER A 17 -16.003 -10.204 -7.432 1.00 24.00 H new ATOM 0 HG SER A 17 -15.350 -12.213 -6.472 1.00 43.51 H new ATOM 311 N ALA A 18 -14.215 -6.955 -7.982 1.00 21.54 N ATOM 312 CA ALA A 18 -14.488 -5.502 -8.054 1.00 61.30 C ATOM 313 C ALA A 18 -13.860 -4.919 -9.349 1.00 64.34 C ATOM 314 O ALA A 18 -12.998 -5.566 -9.952 1.00 11.14 O ATOM 315 CB ALA A 18 -13.912 -4.774 -6.807 1.00 4.11 C ATOM 0 H ALA A 18 -13.616 -7.284 -8.739 1.00 21.54 H new ATOM 0 HA ALA A 18 -15.567 -5.347 -8.073 1.00 61.30 H new ATOM 0 HB1 ALA A 18 -14.123 -3.707 -6.879 1.00 4.11 H new ATOM 0 HB2 ALA A 18 -14.375 -5.175 -5.905 1.00 4.11 H new ATOM 0 HB3 ALA A 18 -12.834 -4.928 -6.761 1.00 4.11 H new ATOM 321 N PRO A 19 -14.300 -3.709 -9.825 1.00 13.51 N ATOM 322 CA PRO A 19 -13.584 -2.968 -10.903 1.00 72.24 C ATOM 323 C PRO A 19 -12.185 -2.472 -10.432 1.00 0.44 C ATOM 324 O PRO A 19 -12.035 -2.022 -9.291 1.00 30.12 O ATOM 325 CB PRO A 19 -14.538 -1.776 -11.196 1.00 63.23 C ATOM 326 CG PRO A 19 -15.276 -1.585 -9.909 1.00 45.23 C ATOM 327 CD PRO A 19 -15.535 -2.982 -9.405 1.00 43.12 C ATOM 0 HA PRO A 19 -13.379 -3.584 -11.779 1.00 72.24 H new ATOM 0 HB2 PRO A 19 -13.984 -0.880 -11.476 1.00 63.23 H new ATOM 0 HB3 PRO A 19 -15.218 -2.001 -12.018 1.00 63.23 H new ATOM 0 HG2 PRO A 19 -14.686 -1.010 -9.196 1.00 45.23 H new ATOM 0 HG3 PRO A 19 -16.208 -1.041 -10.064 1.00 45.23 H new ATOM 0 HD2 PRO A 19 -15.672 -3.005 -8.324 1.00 43.12 H new ATOM 0 HD3 PRO A 19 -16.432 -3.414 -9.849 1.00 43.12 H new ATOM 335 N ILE A 20 -11.179 -2.531 -11.327 1.00 15.00 N ATOM 336 CA ILE A 20 -9.786 -2.117 -11.008 1.00 34.32 C ATOM 337 C ILE A 20 -9.690 -0.600 -10.677 1.00 14.20 C ATOM 338 O ILE A 20 -8.755 -0.153 -10.007 1.00 64.31 O ATOM 339 CB ILE A 20 -8.794 -2.493 -12.173 1.00 4.15 C ATOM 340 CG1 ILE A 20 -7.303 -2.372 -11.698 1.00 60.24 C ATOM 341 CG2 ILE A 20 -9.067 -1.628 -13.438 1.00 54.31 C ATOM 342 CD1 ILE A 20 -6.272 -2.948 -12.651 1.00 54.42 C ATOM 0 H ILE A 20 -11.300 -2.863 -12.284 1.00 15.00 H new ATOM 0 HA ILE A 20 -9.491 -2.669 -10.116 1.00 34.32 H new ATOM 0 HB ILE A 20 -8.967 -3.534 -12.447 1.00 4.15 H new ATOM 0 HG12 ILE A 20 -7.075 -1.319 -11.535 1.00 60.24 H new ATOM 0 HG13 ILE A 20 -7.204 -2.873 -10.735 1.00 60.24 H new ATOM 0 HG21 ILE A 20 -8.369 -1.907 -14.227 1.00 54.31 H new ATOM 0 HG22 ILE A 20 -10.088 -1.796 -13.780 1.00 54.31 H new ATOM 0 HG23 ILE A 20 -8.935 -0.574 -13.193 1.00 54.31 H new ATOM 0 HD11 ILE A 20 -5.275 -2.815 -12.232 1.00 54.42 H new ATOM 0 HD12 ILE A 20 -6.465 -4.011 -12.797 1.00 54.42 H new ATOM 0 HD13 ILE A 20 -6.335 -2.433 -13.609 1.00 54.42 H new ATOM 354 N ASN A 21 -10.684 0.162 -11.163 1.00 55.23 N ATOM 355 CA ASN A 21 -10.782 1.622 -10.985 1.00 21.11 C ATOM 356 C ASN A 21 -10.786 2.016 -9.482 1.00 75.21 C ATOM 357 O ASN A 21 -9.960 2.820 -9.049 1.00 22.04 O ATOM 358 CB ASN A 21 -12.066 2.134 -11.690 1.00 1.41 C ATOM 359 CG ASN A 21 -12.068 3.640 -11.915 1.00 13.43 C ATOM 360 OD1 ASN A 21 -11.699 4.121 -12.979 1.00 75.24 O ATOM 361 ND2 ASN A 21 -12.442 4.401 -10.912 1.00 32.02 N ATOM 0 H ASN A 21 -11.458 -0.227 -11.702 1.00 55.23 H new ATOM 0 HA ASN A 21 -9.906 2.089 -11.435 1.00 21.11 H new ATOM 0 HB2 ASN A 21 -12.171 1.630 -12.651 1.00 1.41 H new ATOM 0 HB3 ASN A 21 -12.935 1.862 -11.091 1.00 1.41 H new ATOM 0 HD21 ASN A 21 -12.429 5.416 -11.010 1.00 32.02 H new ATOM 0 HD22 ASN A 21 -12.745 3.977 -10.035 1.00 32.02 H new ATOM 368 N LYS A 22 -11.706 1.406 -8.699 1.00 41.32 N ATOM 369 CA LYS A 22 -11.836 1.692 -7.242 1.00 63.31 C ATOM 370 C LYS A 22 -10.640 1.131 -6.446 1.00 64.20 C ATOM 371 O LYS A 22 -10.263 1.673 -5.399 1.00 62.24 O ATOM 372 CB LYS A 22 -13.172 1.139 -6.662 1.00 44.13 C ATOM 373 CG LYS A 22 -13.447 -0.359 -6.938 1.00 64.14 C ATOM 374 CD LYS A 22 -14.595 -0.935 -6.072 1.00 10.30 C ATOM 375 CE LYS A 22 -15.926 -0.189 -6.270 1.00 12.15 C ATOM 376 NZ LYS A 22 -17.002 -0.700 -5.383 1.00 61.14 N ATOM 0 H LYS A 22 -12.370 0.714 -9.046 1.00 41.32 H new ATOM 0 HA LYS A 22 -11.842 2.777 -7.136 1.00 63.31 H new ATOM 0 HB2 LYS A 22 -13.174 1.298 -5.584 1.00 44.13 H new ATOM 0 HB3 LYS A 22 -13.996 1.724 -7.072 1.00 44.13 H new ATOM 0 HG2 LYS A 22 -13.694 -0.489 -7.992 1.00 64.14 H new ATOM 0 HG3 LYS A 22 -12.537 -0.930 -6.751 1.00 64.14 H new ATOM 0 HD2 LYS A 22 -14.735 -1.988 -6.316 1.00 10.30 H new ATOM 0 HD3 LYS A 22 -14.310 -0.887 -5.021 1.00 10.30 H new ATOM 0 HE2 LYS A 22 -15.775 0.873 -6.078 1.00 12.15 H new ATOM 0 HE3 LYS A 22 -16.241 -0.284 -7.309 1.00 12.15 H new ATOM 0 HZ1 LYS A 22 -17.783 -1.068 -5.962 1.00 61.14 H new ATOM 0 HZ2 LYS A 22 -16.625 -1.462 -4.784 1.00 61.14 H new ATOM 0 HZ3 LYS A 22 -17.352 0.072 -4.781 1.00 61.14 H new ATOM 390 N VAL A 23 -10.063 0.032 -6.960 1.00 32.32 N ATOM 391 CA VAL A 23 -8.860 -0.598 -6.384 1.00 71.34 C ATOM 392 C VAL A 23 -7.641 0.348 -6.502 1.00 13.02 C ATOM 393 O VAL A 23 -6.841 0.466 -5.579 1.00 71.21 O ATOM 394 CB VAL A 23 -8.566 -1.969 -7.091 1.00 12.33 C ATOM 395 CG1 VAL A 23 -7.328 -2.679 -6.478 1.00 74.25 C ATOM 396 CG2 VAL A 23 -9.817 -2.886 -7.040 1.00 22.14 C ATOM 0 H VAL A 23 -10.417 -0.447 -7.788 1.00 32.32 H new ATOM 0 HA VAL A 23 -9.044 -0.789 -5.327 1.00 71.34 H new ATOM 0 HB VAL A 23 -8.333 -1.761 -8.135 1.00 12.33 H new ATOM 0 HG11 VAL A 23 -7.158 -3.624 -6.994 1.00 74.25 H new ATOM 0 HG12 VAL A 23 -6.451 -2.041 -6.589 1.00 74.25 H new ATOM 0 HG13 VAL A 23 -7.505 -2.871 -5.420 1.00 74.25 H new ATOM 0 HG21 VAL A 23 -9.595 -3.832 -7.535 1.00 22.14 H new ATOM 0 HG22 VAL A 23 -10.088 -3.075 -6.001 1.00 22.14 H new ATOM 0 HG23 VAL A 23 -10.648 -2.397 -7.548 1.00 22.14 H new ATOM 406 N PHE A 24 -7.545 1.042 -7.649 1.00 41.15 N ATOM 407 CA PHE A 24 -6.533 2.093 -7.893 1.00 44.12 C ATOM 408 C PHE A 24 -6.764 3.303 -6.952 1.00 15.14 C ATOM 409 O PHE A 24 -5.809 3.897 -6.439 1.00 33.31 O ATOM 410 CB PHE A 24 -6.595 2.534 -9.380 1.00 61.14 C ATOM 411 CG PHE A 24 -5.598 3.628 -9.783 1.00 24.43 C ATOM 412 CD1 PHE A 24 -4.226 3.406 -9.703 1.00 3.24 C ATOM 413 CD2 PHE A 24 -6.034 4.873 -10.250 1.00 72.23 C ATOM 414 CE1 PHE A 24 -3.324 4.385 -10.073 1.00 5.21 C ATOM 415 CE2 PHE A 24 -5.128 5.850 -10.623 1.00 40.22 C ATOM 416 CZ PHE A 24 -3.774 5.606 -10.535 1.00 63.23 C ATOM 0 H PHE A 24 -8.170 0.891 -8.441 1.00 41.15 H new ATOM 0 HA PHE A 24 -5.542 1.691 -7.682 1.00 44.12 H new ATOM 0 HB2 PHE A 24 -6.423 1.660 -10.008 1.00 61.14 H new ATOM 0 HB3 PHE A 24 -7.603 2.888 -9.595 1.00 61.14 H new ATOM 0 HD1 PHE A 24 -3.861 2.454 -9.346 1.00 3.24 H new ATOM 0 HD2 PHE A 24 -7.093 5.074 -10.320 1.00 72.23 H new ATOM 0 HE1 PHE A 24 -2.263 4.195 -10.001 1.00 5.21 H new ATOM 0 HE2 PHE A 24 -5.482 6.805 -10.983 1.00 40.22 H new ATOM 0 HZ PHE A 24 -3.067 6.368 -10.827 1.00 63.23 H new ATOM 426 N ASP A 25 -8.052 3.646 -6.727 1.00 5.23 N ATOM 427 CA ASP A 25 -8.451 4.737 -5.807 1.00 35.11 C ATOM 428 C ASP A 25 -8.120 4.418 -4.324 1.00 30.25 C ATOM 429 O ASP A 25 -8.057 5.319 -3.496 1.00 63.23 O ATOM 430 CB ASP A 25 -9.951 5.068 -5.979 1.00 55.33 C ATOM 431 CG ASP A 25 -10.302 5.621 -7.370 1.00 52.02 C ATOM 432 OD1 ASP A 25 -9.560 6.487 -7.883 1.00 22.10 O ATOM 433 OD2 ASP A 25 -11.327 5.208 -7.958 1.00 42.45 O ATOM 0 H ASP A 25 -8.840 3.178 -7.174 1.00 5.23 H new ATOM 0 HA ASP A 25 -7.863 5.614 -6.076 1.00 35.11 H new ATOM 0 HB2 ASP A 25 -10.537 4.167 -5.797 1.00 55.33 H new ATOM 0 HB3 ASP A 25 -10.243 5.797 -5.223 1.00 55.33 H new ATOM 438 N ALA A 26 -7.922 3.130 -3.997 1.00 2.34 N ATOM 439 CA ALA A 26 -7.461 2.707 -2.650 1.00 40.23 C ATOM 440 C ALA A 26 -5.999 3.144 -2.364 1.00 4.34 C ATOM 441 O ALA A 26 -5.603 3.289 -1.205 1.00 11.52 O ATOM 442 CB ALA A 26 -7.608 1.190 -2.510 1.00 72.10 C ATOM 0 H ALA A 26 -8.073 2.356 -4.644 1.00 2.34 H new ATOM 0 HA ALA A 26 -8.088 3.205 -1.910 1.00 40.23 H new ATOM 0 HB1 ALA A 26 -7.269 0.881 -1.521 1.00 72.10 H new ATOM 0 HB2 ALA A 26 -8.654 0.912 -2.638 1.00 72.10 H new ATOM 0 HB3 ALA A 26 -7.005 0.694 -3.271 1.00 72.10 H new ATOM 448 N TYR A 27 -5.205 3.342 -3.437 1.00 45.21 N ATOM 449 CA TYR A 27 -3.777 3.754 -3.343 1.00 62.12 C ATOM 450 C TYR A 27 -3.570 5.237 -3.764 1.00 53.03 C ATOM 451 O TYR A 27 -2.447 5.752 -3.693 1.00 70.32 O ATOM 452 CB TYR A 27 -2.901 2.818 -4.226 1.00 2.20 C ATOM 453 CG TYR A 27 -3.054 1.318 -3.900 1.00 34.13 C ATOM 454 CD1 TYR A 27 -2.299 0.706 -2.894 1.00 5.33 C ATOM 455 CD2 TYR A 27 -3.966 0.519 -4.593 1.00 40.12 C ATOM 456 CE1 TYR A 27 -2.449 -0.640 -2.602 1.00 15.22 C ATOM 457 CE2 TYR A 27 -4.121 -0.822 -4.300 1.00 25.30 C ATOM 458 CZ TYR A 27 -3.362 -1.396 -3.305 1.00 33.31 C ATOM 459 OH TYR A 27 -3.515 -2.736 -3.013 1.00 72.44 O ATOM 0 H TYR A 27 -5.530 3.222 -4.396 1.00 45.21 H new ATOM 0 HA TYR A 27 -3.472 3.667 -2.300 1.00 62.12 H new ATOM 0 HB2 TYR A 27 -3.158 2.979 -5.273 1.00 2.20 H new ATOM 0 HB3 TYR A 27 -1.855 3.099 -4.108 1.00 2.20 H new ATOM 0 HD1 TYR A 27 -1.586 1.294 -2.335 1.00 5.33 H new ATOM 0 HD2 TYR A 27 -4.564 0.960 -5.377 1.00 40.12 H new ATOM 0 HE1 TYR A 27 -1.852 -1.096 -1.826 1.00 15.22 H new ATOM 0 HE2 TYR A 27 -4.835 -1.418 -4.849 1.00 25.30 H new ATOM 0 HH TYR A 27 -4.199 -3.122 -3.599 1.00 72.44 H new ATOM 469 N THR A 28 -4.650 5.915 -4.228 1.00 33.25 N ATOM 470 CA THR A 28 -4.576 7.328 -4.720 1.00 54.50 C ATOM 471 C THR A 28 -5.485 8.304 -3.942 1.00 4.53 C ATOM 472 O THR A 28 -5.236 9.515 -3.924 1.00 53.32 O ATOM 473 CB THR A 28 -4.942 7.425 -6.238 1.00 41.21 C ATOM 474 OG1 THR A 28 -6.236 6.867 -6.479 1.00 3.10 O ATOM 475 CG2 THR A 28 -3.906 6.724 -7.129 1.00 74.11 C ATOM 0 H THR A 28 -5.586 5.512 -4.275 1.00 33.25 H new ATOM 0 HA THR A 28 -3.540 7.624 -4.556 1.00 54.50 H new ATOM 0 HB THR A 28 -4.946 8.484 -6.496 1.00 41.21 H new ATOM 0 HG1 THR A 28 -6.450 6.937 -7.433 1.00 3.10 H new ATOM 0 HG21 THR A 28 -4.202 6.817 -8.174 1.00 74.11 H new ATOM 0 HG22 THR A 28 -2.930 7.187 -6.986 1.00 74.11 H new ATOM 0 HG23 THR A 28 -3.850 5.669 -6.861 1.00 74.11 H new ATOM 483 N LYS A 29 -6.543 7.776 -3.327 1.00 3.32 N ATOM 484 CA LYS A 29 -7.554 8.568 -2.579 1.00 43.33 C ATOM 485 C LYS A 29 -7.527 8.165 -1.085 1.00 52.35 C ATOM 486 O LYS A 29 -7.595 6.970 -0.758 1.00 41.24 O ATOM 487 CB LYS A 29 -8.975 8.342 -3.194 1.00 4.03 C ATOM 488 CG LYS A 29 -9.367 9.260 -4.382 1.00 42.43 C ATOM 489 CD LYS A 29 -8.510 9.036 -5.646 1.00 64.45 C ATOM 490 CE LYS A 29 -9.030 9.804 -6.868 1.00 12.21 C ATOM 491 NZ LYS A 29 -10.370 9.324 -7.298 1.00 42.31 N ATOM 0 H LYS A 29 -6.736 6.774 -3.327 1.00 3.32 H new ATOM 0 HA LYS A 29 -7.316 9.629 -2.657 1.00 43.33 H new ATOM 0 HB2 LYS A 29 -9.043 7.306 -3.526 1.00 4.03 H new ATOM 0 HB3 LYS A 29 -9.714 8.472 -2.403 1.00 4.03 H new ATOM 0 HG2 LYS A 29 -10.415 9.092 -4.630 1.00 42.43 H new ATOM 0 HG3 LYS A 29 -9.276 10.301 -4.071 1.00 42.43 H new ATOM 0 HD2 LYS A 29 -7.484 9.342 -5.441 1.00 64.45 H new ATOM 0 HD3 LYS A 29 -8.485 7.971 -5.877 1.00 64.45 H new ATOM 0 HE2 LYS A 29 -9.084 10.867 -6.632 1.00 12.21 H new ATOM 0 HE3 LYS A 29 -8.324 9.696 -7.692 1.00 12.21 H new ATOM 0 HZ1 LYS A 29 -10.618 9.758 -8.210 1.00 42.31 H new ATOM 0 HZ2 LYS A 29 -10.352 8.289 -7.401 1.00 42.31 H new ATOM 0 HZ3 LYS A 29 -11.079 9.588 -6.584 1.00 42.31 H new ATOM 505 N ARG A 30 -7.454 9.167 -0.178 1.00 44.50 N ATOM 506 CA ARG A 30 -7.227 8.914 1.265 1.00 54.40 C ATOM 507 C ARG A 30 -8.439 8.277 1.951 1.00 12.44 C ATOM 508 O ARG A 30 -8.274 7.381 2.763 1.00 3.23 O ATOM 509 CB ARG A 30 -6.764 10.205 2.018 1.00 21.01 C ATOM 510 CG ARG A 30 -7.821 11.321 2.295 1.00 73.24 C ATOM 511 CD ARG A 30 -8.528 11.203 3.662 1.00 45.53 C ATOM 512 NE ARG A 30 -9.409 12.348 3.945 1.00 52.14 N ATOM 513 CZ ARG A 30 -9.982 12.600 5.103 1.00 53.34 C ATOM 514 NH1 ARG A 30 -9.772 11.849 6.141 1.00 74.30 N ATOM 515 NH2 ARG A 30 -10.752 13.626 5.221 1.00 63.13 N ATOM 0 H ARG A 30 -7.548 10.154 -0.418 1.00 44.50 H new ATOM 0 HA ARG A 30 -6.415 8.188 1.320 1.00 54.40 H new ATOM 0 HB2 ARG A 30 -6.345 9.898 2.977 1.00 21.01 H new ATOM 0 HB3 ARG A 30 -5.952 10.651 1.444 1.00 21.01 H new ATOM 0 HG2 ARG A 30 -7.330 12.292 2.236 1.00 73.24 H new ATOM 0 HG3 ARG A 30 -8.574 11.296 1.507 1.00 73.24 H new ATOM 0 HD2 ARG A 30 -9.114 10.284 3.686 1.00 45.53 H new ATOM 0 HD3 ARG A 30 -7.778 11.123 4.449 1.00 45.53 H new ATOM 0 HE ARG A 30 -9.590 12.999 3.181 1.00 52.14 H new ATOM 0 HH11 ARG A 30 -9.151 11.043 6.070 1.00 74.30 H new ATOM 0 HH12 ARG A 30 -10.228 12.065 7.027 1.00 74.30 H new ATOM 0 HH21 ARG A 30 -10.914 14.237 4.420 1.00 63.13 H new ATOM 0 HH22 ARG A 30 -11.199 13.828 6.115 1.00 63.13 H new ATOM 529 N GLU A 31 -9.650 8.729 1.573 1.00 71.44 N ATOM 530 CA GLU A 31 -10.934 8.265 2.165 1.00 40.32 C ATOM 531 C GLU A 31 -11.089 6.723 2.126 1.00 23.44 C ATOM 532 O GLU A 31 -11.862 6.158 2.893 1.00 51.11 O ATOM 533 CB GLU A 31 -12.152 8.944 1.461 1.00 14.22 C ATOM 534 CG GLU A 31 -12.353 8.592 -0.050 1.00 75.24 C ATOM 535 CD GLU A 31 -11.701 9.568 -1.065 1.00 71.04 C ATOM 536 OE1 GLU A 31 -10.637 10.155 -0.770 1.00 32.33 O ATOM 537 OE2 GLU A 31 -12.263 9.752 -2.171 1.00 60.33 O ATOM 0 H GLU A 31 -9.773 9.431 0.844 1.00 71.44 H new ATOM 0 HA GLU A 31 -10.914 8.563 3.213 1.00 40.32 H new ATOM 0 HB2 GLU A 31 -13.058 8.670 2.001 1.00 14.22 H new ATOM 0 HB3 GLU A 31 -12.042 10.025 1.551 1.00 14.22 H new ATOM 0 HG2 GLU A 31 -11.953 7.594 -0.227 1.00 75.24 H new ATOM 0 HG3 GLU A 31 -13.423 8.548 -0.254 1.00 75.24 H new ATOM 544 N LEU A 32 -10.336 6.062 1.223 1.00 61.33 N ATOM 545 CA LEU A 32 -10.276 4.595 1.126 1.00 53.30 C ATOM 546 C LEU A 32 -9.008 4.055 1.831 1.00 53.20 C ATOM 547 O LEU A 32 -9.078 3.069 2.569 1.00 11.31 O ATOM 548 CB LEU A 32 -10.281 4.167 -0.359 1.00 52.33 C ATOM 549 CG LEU A 32 -11.472 4.696 -1.217 1.00 1.23 C ATOM 550 CD1 LEU A 32 -11.349 4.210 -2.669 1.00 11.14 C ATOM 551 CD2 LEU A 32 -12.842 4.314 -0.607 1.00 72.44 C ATOM 0 H LEU A 32 -9.750 6.538 0.537 1.00 61.33 H new ATOM 0 HA LEU A 32 -11.151 4.176 1.622 1.00 53.30 H new ATOM 0 HB2 LEU A 32 -9.351 4.503 -0.817 1.00 52.33 H new ATOM 0 HB3 LEU A 32 -10.282 3.078 -0.403 1.00 52.33 H new ATOM 0 HG LEU A 32 -11.421 5.785 -1.216 1.00 1.23 H new ATOM 0 HD11 LEU A 32 -12.188 4.589 -3.252 1.00 11.14 H new ATOM 0 HD12 LEU A 32 -10.416 4.575 -3.097 1.00 11.14 H new ATOM 0 HD13 LEU A 32 -11.356 3.120 -2.690 1.00 11.14 H new ATOM 0 HD21 LEU A 32 -13.642 4.703 -1.237 1.00 72.44 H new ATOM 0 HD22 LEU A 32 -12.923 3.229 -0.546 1.00 72.44 H new ATOM 0 HD23 LEU A 32 -12.927 4.741 0.392 1.00 72.44 H new ATOM 563 N PHE A 33 -7.859 4.730 1.588 1.00 65.23 N ATOM 564 CA PHE A 33 -6.522 4.312 2.097 1.00 21.15 C ATOM 565 C PHE A 33 -6.493 4.178 3.644 1.00 4.51 C ATOM 566 O PHE A 33 -6.023 3.168 4.177 1.00 70.15 O ATOM 567 CB PHE A 33 -5.448 5.316 1.613 1.00 5.14 C ATOM 568 CG PHE A 33 -3.996 4.915 1.915 1.00 73.33 C ATOM 569 CD1 PHE A 33 -3.314 4.019 1.085 1.00 60.42 C ATOM 570 CD2 PHE A 33 -3.306 5.449 3.008 1.00 0.23 C ATOM 571 CE1 PHE A 33 -1.999 3.669 1.342 1.00 4.33 C ATOM 572 CE2 PHE A 33 -1.994 5.096 3.264 1.00 25.50 C ATOM 573 CZ PHE A 33 -1.339 4.210 2.429 1.00 11.01 C ATOM 0 H PHE A 33 -7.829 5.584 1.031 1.00 65.23 H new ATOM 0 HA PHE A 33 -6.305 3.322 1.695 1.00 21.15 H new ATOM 0 HB2 PHE A 33 -5.555 5.448 0.536 1.00 5.14 H new ATOM 0 HB3 PHE A 33 -5.644 6.284 2.074 1.00 5.14 H new ATOM 0 HD1 PHE A 33 -3.821 3.594 0.231 1.00 60.42 H new ATOM 0 HD2 PHE A 33 -3.806 6.148 3.662 1.00 0.23 H new ATOM 0 HE1 PHE A 33 -1.489 2.973 0.693 1.00 4.33 H new ATOM 0 HE2 PHE A 33 -1.480 5.513 4.117 1.00 25.50 H new ATOM 0 HZ PHE A 33 -0.312 3.941 2.626 1.00 11.01 H new ATOM 583 N GLU A 34 -7.029 5.192 4.354 1.00 44.23 N ATOM 584 CA GLU A 34 -7.110 5.184 5.838 1.00 31.14 C ATOM 585 C GLU A 34 -8.266 4.301 6.392 1.00 1.44 C ATOM 586 O GLU A 34 -8.575 4.359 7.589 1.00 51.22 O ATOM 587 CB GLU A 34 -7.200 6.628 6.415 1.00 55.05 C ATOM 588 CG GLU A 34 -8.307 7.518 5.813 1.00 62.01 C ATOM 589 CD GLU A 34 -8.482 8.855 6.545 1.00 41.52 C ATOM 590 OE1 GLU A 34 -7.562 9.689 6.501 1.00 24.22 O ATOM 591 OE2 GLU A 34 -9.538 9.082 7.175 1.00 4.44 O ATOM 0 H GLU A 34 -7.415 6.033 3.925 1.00 44.23 H new ATOM 0 HA GLU A 34 -6.180 4.729 6.177 1.00 31.14 H new ATOM 0 HB2 GLU A 34 -7.358 6.561 7.491 1.00 55.05 H new ATOM 0 HB3 GLU A 34 -6.240 7.121 6.264 1.00 55.05 H new ATOM 0 HG2 GLU A 34 -8.076 7.714 4.766 1.00 62.01 H new ATOM 0 HG3 GLU A 34 -9.251 6.974 5.835 1.00 62.01 H new ATOM 598 N GLN A 35 -8.904 3.487 5.530 1.00 62.15 N ATOM 599 CA GLN A 35 -9.877 2.458 5.970 1.00 72.33 C ATOM 600 C GLN A 35 -9.252 1.041 5.957 1.00 10.43 C ATOM 601 O GLN A 35 -9.592 0.204 6.801 1.00 30.51 O ATOM 602 CB GLN A 35 -11.168 2.491 5.099 1.00 44.55 C ATOM 603 CG GLN A 35 -11.999 3.789 5.261 1.00 54.31 C ATOM 604 CD GLN A 35 -13.394 3.696 4.638 1.00 1.41 C ATOM 605 OE1 GLN A 35 -14.356 3.313 5.289 1.00 2.35 O ATOM 606 NE2 GLN A 35 -13.511 4.007 3.366 1.00 45.44 N ATOM 0 H GLN A 35 -8.765 3.519 4.520 1.00 62.15 H new ATOM 0 HA GLN A 35 -10.152 2.696 6.998 1.00 72.33 H new ATOM 0 HB2 GLN A 35 -10.891 2.376 4.051 1.00 44.55 H new ATOM 0 HB3 GLN A 35 -11.792 1.636 5.359 1.00 44.55 H new ATOM 0 HG2 GLN A 35 -12.097 4.019 6.322 1.00 54.31 H new ATOM 0 HG3 GLN A 35 -11.459 4.618 4.803 1.00 54.31 H new ATOM 0 HE21 GLN A 35 -12.696 4.324 2.842 1.00 45.44 H new ATOM 0 HE22 GLN A 35 -14.417 3.931 2.904 1.00 45.44 H new ATOM 615 N TRP A 36 -8.334 0.766 5.000 1.00 63.13 N ATOM 616 CA TRP A 36 -7.720 -0.585 4.859 1.00 11.53 C ATOM 617 C TRP A 36 -6.272 -0.650 5.421 1.00 34.31 C ATOM 618 O TRP A 36 -5.932 -1.593 6.144 1.00 72.30 O ATOM 619 CB TRP A 36 -7.763 -1.066 3.378 1.00 24.21 C ATOM 620 CG TRP A 36 -6.825 -0.353 2.416 1.00 64.14 C ATOM 621 CD1 TRP A 36 -7.055 0.800 1.728 1.00 53.43 C ATOM 622 CD2 TRP A 36 -5.511 -0.780 2.030 1.00 63.44 C ATOM 623 NE1 TRP A 36 -5.964 1.127 0.966 1.00 0.12 N ATOM 624 CE2 TRP A 36 -5.004 0.175 1.139 1.00 2.25 C ATOM 625 CE3 TRP A 36 -4.711 -1.873 2.375 1.00 21.13 C ATOM 626 CZ2 TRP A 36 -3.741 0.072 0.578 1.00 41.33 C ATOM 627 CZ3 TRP A 36 -3.453 -1.976 1.820 1.00 73.02 C ATOM 628 CH2 TRP A 36 -2.975 -1.005 0.934 1.00 63.20 C ATOM 0 H TRP A 36 -8.002 1.450 4.320 1.00 63.13 H new ATOM 0 HA TRP A 36 -8.321 -1.264 5.464 1.00 11.53 H new ATOM 0 HB2 TRP A 36 -7.532 -2.131 3.356 1.00 24.21 H new ATOM 0 HB3 TRP A 36 -8.783 -0.953 3.010 1.00 24.21 H new ATOM 0 HD1 TRP A 36 -7.968 1.375 1.776 1.00 53.43 H new ATOM 0 HE1 TRP A 36 -5.883 1.949 0.367 1.00 0.12 H new ATOM 0 HE3 TRP A 36 -5.072 -2.623 3.064 1.00 21.13 H new ATOM 0 HZ2 TRP A 36 -3.374 0.815 -0.115 1.00 41.33 H new ATOM 0 HZ3 TRP A 36 -2.827 -2.819 2.073 1.00 73.02 H new ATOM 0 HH2 TRP A 36 -1.982 -1.107 0.523 1.00 63.20 H new ATOM 639 N PHE A 37 -5.423 0.353 5.088 1.00 62.24 N ATOM 640 CA PHE A 37 -3.965 0.308 5.371 1.00 3.03 C ATOM 641 C PHE A 37 -3.661 0.607 6.860 1.00 11.31 C ATOM 642 O PHE A 37 -3.408 1.753 7.238 1.00 22.31 O ATOM 643 CB PHE A 37 -3.203 1.289 4.433 1.00 40.40 C ATOM 644 CG PHE A 37 -1.672 1.169 4.487 1.00 64.31 C ATOM 645 CD1 PHE A 37 -1.005 0.203 3.732 1.00 70.12 C ATOM 646 CD2 PHE A 37 -0.901 2.015 5.292 1.00 51.10 C ATOM 647 CE1 PHE A 37 0.373 0.088 3.777 1.00 61.15 C ATOM 648 CE2 PHE A 37 0.475 1.895 5.337 1.00 3.04 C ATOM 649 CZ PHE A 37 1.112 0.933 4.580 1.00 43.11 C ATOM 0 H PHE A 37 -5.724 1.208 4.620 1.00 62.24 H new ATOM 0 HA PHE A 37 -3.615 -0.705 5.171 1.00 3.03 H new ATOM 0 HB2 PHE A 37 -3.531 1.119 3.408 1.00 40.40 H new ATOM 0 HB3 PHE A 37 -3.483 2.310 4.692 1.00 40.40 H new ATOM 0 HD1 PHE A 37 -1.574 -0.465 3.103 1.00 70.12 H new ATOM 0 HD2 PHE A 37 -1.389 2.773 5.887 1.00 51.10 H new ATOM 0 HE1 PHE A 37 0.871 -0.664 3.183 1.00 61.15 H new ATOM 0 HE2 PHE A 37 1.053 2.556 5.966 1.00 3.04 H new ATOM 0 HZ PHE A 37 2.188 0.841 4.616 1.00 43.11 H new ATOM 659 N HIS A 38 -3.717 -0.443 7.697 1.00 65.23 N ATOM 660 CA HIS A 38 -3.432 -0.340 9.148 1.00 23.12 C ATOM 661 C HIS A 38 -3.155 -1.747 9.757 1.00 10.33 C ATOM 662 O HIS A 38 -3.646 -2.757 9.227 1.00 43.23 O ATOM 663 CB HIS A 38 -4.609 0.364 9.892 1.00 14.22 C ATOM 664 CG HIS A 38 -5.908 -0.402 9.894 1.00 24.42 C ATOM 665 ND1 HIS A 38 -6.228 -1.321 10.867 1.00 70.23 N ATOM 666 CD2 HIS A 38 -6.961 -0.384 9.043 1.00 4.52 C ATOM 667 CE1 HIS A 38 -7.406 -1.839 10.615 1.00 60.43 C ATOM 668 NE2 HIS A 38 -7.877 -1.289 9.518 1.00 30.33 N ATOM 0 H HIS A 38 -3.960 -1.386 7.393 1.00 65.23 H new ATOM 0 HA HIS A 38 -2.536 0.267 9.277 1.00 23.12 H new ATOM 0 HB2 HIS A 38 -4.310 0.546 10.924 1.00 14.22 H new ATOM 0 HB3 HIS A 38 -4.779 1.338 9.433 1.00 14.22 H new ATOM 0 HD1 HIS A 38 -5.638 -1.563 11.663 1.00 70.23 H new ATOM 0 HD2 HIS A 38 -7.061 0.227 8.158 1.00 4.52 H new ATOM 0 HE1 HIS A 38 -7.905 -2.591 11.209 1.00 60.43 H new ATOM 677 N PRO A 39 -2.357 -1.839 10.876 1.00 72.14 N ATOM 678 CA PRO A 39 -2.112 -3.124 11.591 1.00 72.11 C ATOM 679 C PRO A 39 -3.298 -3.569 12.504 1.00 64.22 C ATOM 680 O PRO A 39 -4.364 -2.936 12.524 1.00 71.32 O ATOM 681 CB PRO A 39 -0.834 -2.816 12.409 1.00 74.51 C ATOM 682 CG PRO A 39 -0.930 -1.354 12.711 1.00 11.25 C ATOM 683 CD PRO A 39 -1.593 -0.719 11.501 1.00 13.31 C ATOM 0 HA PRO A 39 -2.005 -3.964 10.905 1.00 72.11 H new ATOM 0 HB2 PRO A 39 -0.794 -3.409 13.323 1.00 74.51 H new ATOM 0 HB3 PRO A 39 0.067 -3.046 11.840 1.00 74.51 H new ATOM 0 HG2 PRO A 39 -1.516 -1.180 13.613 1.00 11.25 H new ATOM 0 HG3 PRO A 39 0.057 -0.926 12.885 1.00 11.25 H new ATOM 0 HD2 PRO A 39 -2.251 0.100 11.791 1.00 13.31 H new ATOM 0 HD3 PRO A 39 -0.855 -0.306 10.813 1.00 13.31 H new ATOM 691 N GLN A 40 -3.078 -4.665 13.262 1.00 4.54 N ATOM 692 CA GLN A 40 -4.127 -5.337 14.071 1.00 12.53 C ATOM 693 C GLN A 40 -4.681 -4.426 15.212 1.00 43.33 C ATOM 694 O GLN A 40 -3.955 -4.096 16.162 1.00 24.43 O ATOM 695 CB GLN A 40 -3.548 -6.654 14.663 1.00 12.11 C ATOM 696 CG GLN A 40 -4.568 -7.542 15.413 1.00 13.53 C ATOM 697 CD GLN A 40 -3.947 -8.780 16.070 1.00 53.24 C ATOM 698 OE1 GLN A 40 -2.796 -8.765 16.502 1.00 65.54 O ATOM 699 NE2 GLN A 40 -4.692 -9.865 16.137 1.00 52.53 N ATOM 0 H GLN A 40 -2.165 -5.113 13.333 1.00 4.54 H new ATOM 0 HA GLN A 40 -4.968 -5.557 13.413 1.00 12.53 H new ATOM 0 HB2 GLN A 40 -3.110 -7.236 13.852 1.00 12.11 H new ATOM 0 HB3 GLN A 40 -2.738 -6.401 15.347 1.00 12.11 H new ATOM 0 HG2 GLN A 40 -5.061 -6.944 16.180 1.00 13.53 H new ATOM 0 HG3 GLN A 40 -5.340 -7.862 14.713 1.00 13.53 H new ATOM 0 HE21 GLN A 40 -5.644 -9.853 15.772 1.00 52.53 H new ATOM 0 HE22 GLN A 40 -4.316 -10.717 16.554 1.00 52.53 H new ATOM 708 N ASP A 41 -5.962 -4.005 15.060 1.00 1.33 N ATOM 709 CA ASP A 41 -6.716 -3.181 16.051 1.00 12.15 C ATOM 710 C ASP A 41 -6.085 -1.779 16.313 1.00 51.33 C ATOM 711 O ASP A 41 -6.408 -1.114 17.309 1.00 14.43 O ATOM 712 CB ASP A 41 -6.931 -3.968 17.374 1.00 14.34 C ATOM 713 CG ASP A 41 -7.888 -5.166 17.205 1.00 41.21 C ATOM 714 OD1 ASP A 41 -7.447 -6.233 16.728 1.00 72.13 O ATOM 715 OD2 ASP A 41 -9.089 -5.032 17.529 1.00 13.25 O ATOM 0 H ASP A 41 -6.514 -4.230 14.232 1.00 1.33 H new ATOM 0 HA ASP A 41 -7.689 -2.980 15.603 1.00 12.15 H new ATOM 0 HB2 ASP A 41 -5.969 -4.326 17.740 1.00 14.34 H new ATOM 0 HB3 ASP A 41 -7.329 -3.294 18.132 1.00 14.34 H new ATOM 720 N ALA A 42 -5.218 -1.328 15.394 1.00 2.42 N ATOM 721 CA ALA A 42 -4.646 0.035 15.409 1.00 60.45 C ATOM 722 C ALA A 42 -5.132 0.809 14.166 1.00 53.43 C ATOM 723 O ALA A 42 -5.113 0.275 13.056 1.00 42.44 O ATOM 724 CB ALA A 42 -3.113 -0.030 15.463 1.00 23.41 C ATOM 0 H ALA A 42 -4.890 -1.898 14.614 1.00 2.42 H new ATOM 0 HA ALA A 42 -4.985 0.563 16.300 1.00 60.45 H new ATOM 0 HB1 ALA A 42 -2.706 0.981 15.473 1.00 23.41 H new ATOM 0 HB2 ALA A 42 -2.803 -0.555 16.366 1.00 23.41 H new ATOM 0 HB3 ALA A 42 -2.740 -0.562 14.588 1.00 23.41 H new ATOM 730 N SER A 43 -5.571 2.059 14.374 1.00 23.21 N ATOM 731 CA SER A 43 -6.160 2.926 13.323 1.00 32.43 C ATOM 732 C SER A 43 -5.066 3.638 12.482 1.00 71.43 C ATOM 733 O SER A 43 -3.864 3.430 12.687 1.00 61.02 O ATOM 734 CB SER A 43 -7.100 3.963 14.001 1.00 24.53 C ATOM 735 OG SER A 43 -7.776 4.789 13.057 1.00 4.33 O ATOM 0 H SER A 43 -5.530 2.510 15.288 1.00 23.21 H new ATOM 0 HA SER A 43 -6.730 2.305 12.632 1.00 32.43 H new ATOM 0 HB2 SER A 43 -7.835 3.437 14.611 1.00 24.53 H new ATOM 0 HB3 SER A 43 -6.517 4.590 14.675 1.00 24.53 H new ATOM 0 HG SER A 43 -8.355 5.422 13.531 1.00 4.33 H new ATOM 741 N VAL A 44 -5.503 4.456 11.509 1.00 25.40 N ATOM 742 CA VAL A 44 -4.615 5.273 10.651 1.00 3.25 C ATOM 743 C VAL A 44 -5.320 6.597 10.246 1.00 74.42 C ATOM 744 O VAL A 44 -6.511 6.613 9.918 1.00 53.31 O ATOM 745 CB VAL A 44 -4.142 4.458 9.383 1.00 53.42 C ATOM 746 CG1 VAL A 44 -5.344 3.848 8.628 1.00 3.40 C ATOM 747 CG2 VAL A 44 -3.248 5.310 8.437 1.00 22.00 C ATOM 0 H VAL A 44 -6.492 4.573 11.291 1.00 25.40 H new ATOM 0 HA VAL A 44 -3.723 5.528 11.223 1.00 3.25 H new ATOM 0 HB VAL A 44 -3.524 3.636 9.745 1.00 53.42 H new ATOM 0 HG11 VAL A 44 -4.986 3.294 7.761 1.00 3.40 H new ATOM 0 HG12 VAL A 44 -5.886 3.174 9.291 1.00 3.40 H new ATOM 0 HG13 VAL A 44 -6.010 4.646 8.299 1.00 3.40 H new ATOM 0 HG21 VAL A 44 -2.947 4.707 7.580 1.00 22.00 H new ATOM 0 HG22 VAL A 44 -3.809 6.179 8.091 1.00 22.00 H new ATOM 0 HG23 VAL A 44 -2.361 5.642 8.976 1.00 22.00 H new ATOM 757 N THR A 45 -4.566 7.704 10.292 1.00 34.01 N ATOM 758 CA THR A 45 -5.060 9.064 9.998 1.00 51.41 C ATOM 759 C THR A 45 -4.190 9.715 8.909 1.00 54.43 C ATOM 760 O THR A 45 -3.026 10.034 9.157 1.00 42.20 O ATOM 761 CB THR A 45 -5.034 9.942 11.302 1.00 33.43 C ATOM 762 OG1 THR A 45 -5.931 9.384 12.281 1.00 41.52 O ATOM 763 CG2 THR A 45 -5.405 11.424 11.050 1.00 71.03 C ATOM 0 H THR A 45 -3.577 7.683 10.539 1.00 34.01 H new ATOM 0 HA THR A 45 -6.087 8.996 9.639 1.00 51.41 H new ATOM 0 HB THR A 45 -4.007 9.929 11.667 1.00 33.43 H new ATOM 0 HG1 THR A 45 -5.911 9.932 13.093 1.00 41.52 H new ATOM 0 HG21 THR A 45 -5.368 11.973 11.991 1.00 71.03 H new ATOM 0 HG22 THR A 45 -4.697 11.862 10.346 1.00 71.03 H new ATOM 0 HG23 THR A 45 -6.412 11.482 10.636 1.00 71.03 H new ATOM 771 N VAL A 46 -4.741 9.876 7.692 1.00 42.31 N ATOM 772 CA VAL A 46 -4.050 10.587 6.593 1.00 34.45 C ATOM 773 C VAL A 46 -4.345 12.105 6.671 1.00 51.11 C ATOM 774 O VAL A 46 -5.492 12.535 6.505 1.00 61.12 O ATOM 775 CB VAL A 46 -4.454 10.028 5.178 1.00 22.22 C ATOM 776 CG1 VAL A 46 -3.656 10.722 4.047 1.00 13.41 C ATOM 777 CG2 VAL A 46 -4.284 8.491 5.109 1.00 54.50 C ATOM 0 H VAL A 46 -5.665 9.524 7.441 1.00 42.31 H new ATOM 0 HA VAL A 46 -2.980 10.417 6.717 1.00 34.45 H new ATOM 0 HB VAL A 46 -5.510 10.255 5.030 1.00 22.22 H new ATOM 0 HG11 VAL A 46 -3.959 10.312 3.084 1.00 13.41 H new ATOM 0 HG12 VAL A 46 -3.856 11.793 4.065 1.00 13.41 H new ATOM 0 HG13 VAL A 46 -2.590 10.549 4.195 1.00 13.41 H new ATOM 0 HG21 VAL A 46 -4.571 8.137 4.119 1.00 54.50 H new ATOM 0 HG22 VAL A 46 -3.243 8.231 5.299 1.00 54.50 H new ATOM 0 HG23 VAL A 46 -4.918 8.021 5.861 1.00 54.50 H new ATOM 787 N TYR A 47 -3.295 12.894 6.948 1.00 12.10 N ATOM 788 CA TYR A 47 -3.372 14.367 7.071 1.00 53.12 C ATOM 789 C TYR A 47 -3.523 15.031 5.682 1.00 61.32 C ATOM 790 O TYR A 47 -4.367 15.916 5.481 1.00 10.11 O ATOM 791 CB TYR A 47 -2.095 14.895 7.777 1.00 40.35 C ATOM 792 CG TYR A 47 -1.874 14.331 9.191 1.00 61.42 C ATOM 793 CD1 TYR A 47 -1.305 13.065 9.383 1.00 53.21 C ATOM 794 CD2 TYR A 47 -2.230 15.059 10.333 1.00 32.04 C ATOM 795 CE1 TYR A 47 -1.103 12.553 10.649 1.00 41.34 C ATOM 796 CE2 TYR A 47 -2.027 14.547 11.601 1.00 42.42 C ATOM 797 CZ TYR A 47 -1.464 13.296 11.754 1.00 51.01 C ATOM 798 OH TYR A 47 -1.262 12.785 13.020 1.00 63.01 O ATOM 0 H TYR A 47 -2.355 12.527 7.096 1.00 12.10 H new ATOM 0 HA TYR A 47 -4.250 14.622 7.665 1.00 53.12 H new ATOM 0 HB2 TYR A 47 -1.228 14.653 7.162 1.00 40.35 H new ATOM 0 HB3 TYR A 47 -2.150 15.982 7.837 1.00 40.35 H new ATOM 0 HD1 TYR A 47 -1.019 12.478 8.523 1.00 53.21 H new ATOM 0 HD2 TYR A 47 -2.671 16.038 10.221 1.00 32.04 H new ATOM 0 HE1 TYR A 47 -0.664 11.574 10.774 1.00 41.34 H new ATOM 0 HE2 TYR A 47 -2.308 15.124 12.469 1.00 42.42 H new ATOM 0 HH TYR A 47 -1.569 13.434 13.687 1.00 63.01 H new ATOM 808 N ASP A 48 -2.688 14.581 4.728 1.00 24.11 N ATOM 809 CA ASP A 48 -2.687 15.070 3.333 1.00 33.24 C ATOM 810 C ASP A 48 -2.401 13.897 2.368 1.00 23.22 C ATOM 811 O ASP A 48 -1.695 12.960 2.738 1.00 21.45 O ATOM 812 CB ASP A 48 -1.628 16.190 3.171 1.00 21.31 C ATOM 813 CG ASP A 48 -1.695 16.886 1.799 1.00 41.21 C ATOM 814 OD1 ASP A 48 -2.518 17.816 1.632 1.00 55.15 O ATOM 815 OD2 ASP A 48 -0.947 16.496 0.873 1.00 1.00 O ATOM 0 H ASP A 48 -1.987 13.861 4.903 1.00 24.11 H new ATOM 0 HA ASP A 48 -3.666 15.484 3.091 1.00 33.24 H new ATOM 0 HB2 ASP A 48 -1.769 16.933 3.956 1.00 21.31 H new ATOM 0 HB3 ASP A 48 -0.634 15.765 3.309 1.00 21.31 H new ATOM 820 N PHE A 49 -2.937 13.958 1.132 1.00 31.44 N ATOM 821 CA PHE A 49 -2.745 12.881 0.130 1.00 34.53 C ATOM 822 C PHE A 49 -2.803 13.456 -1.305 1.00 3.05 C ATOM 823 O PHE A 49 -3.776 14.118 -1.673 1.00 54.43 O ATOM 824 CB PHE A 49 -3.825 11.764 0.314 1.00 3.35 C ATOM 825 CG PHE A 49 -3.440 10.361 -0.201 1.00 64.34 C ATOM 826 CD1 PHE A 49 -2.934 10.155 -1.486 1.00 2.11 C ATOM 827 CD2 PHE A 49 -3.599 9.238 0.613 1.00 50.14 C ATOM 828 CE1 PHE A 49 -2.604 8.890 -1.927 1.00 14.13 C ATOM 829 CE2 PHE A 49 -3.274 7.979 0.165 1.00 44.33 C ATOM 830 CZ PHE A 49 -2.775 7.803 -1.101 1.00 4.12 C ATOM 0 H PHE A 49 -3.505 14.738 0.801 1.00 31.44 H new ATOM 0 HA PHE A 49 -1.760 12.440 0.285 1.00 34.53 H new ATOM 0 HB2 PHE A 49 -4.063 11.687 1.375 1.00 3.35 H new ATOM 0 HB3 PHE A 49 -4.736 12.079 -0.195 1.00 3.35 H new ATOM 0 HD1 PHE A 49 -2.799 11.000 -2.145 1.00 2.11 H new ATOM 0 HD2 PHE A 49 -3.985 9.360 1.614 1.00 50.14 H new ATOM 0 HE1 PHE A 49 -2.210 8.753 -2.923 1.00 14.13 H new ATOM 0 HE2 PHE A 49 -3.412 7.125 0.812 1.00 44.33 H new ATOM 0 HZ PHE A 49 -2.517 6.813 -1.448 1.00 4.12 H new ATOM 840 N ASN A 50 -1.761 13.171 -2.097 1.00 0.11 N ATOM 841 CA ASN A 50 -1.710 13.488 -3.537 1.00 34.50 C ATOM 842 C ASN A 50 -0.889 12.388 -4.253 1.00 1.23 C ATOM 843 O ASN A 50 0.282 12.176 -3.934 1.00 54.24 O ATOM 844 CB ASN A 50 -1.095 14.901 -3.757 1.00 52.14 C ATOM 845 CG ASN A 50 -1.313 15.471 -5.168 1.00 40.53 C ATOM 846 OD1 ASN A 50 -1.402 14.747 -6.155 1.00 31.11 O ATOM 847 ND2 ASN A 50 -1.405 16.783 -5.269 1.00 5.14 N ATOM 0 H ASN A 50 -0.918 12.709 -1.755 1.00 0.11 H new ATOM 0 HA ASN A 50 -2.716 13.508 -3.957 1.00 34.50 H new ATOM 0 HB2 ASN A 50 -1.525 15.589 -3.029 1.00 52.14 H new ATOM 0 HB3 ASN A 50 -0.024 14.854 -3.558 1.00 52.14 H new ATOM 0 HD21 ASN A 50 -1.553 17.215 -6.181 1.00 5.14 H new ATOM 0 HD22 ASN A 50 -1.328 17.365 -4.435 1.00 5.14 H new ATOM 854 N ALA A 51 -1.515 11.686 -5.210 1.00 64.31 N ATOM 855 CA ALA A 51 -0.885 10.566 -5.934 1.00 32.03 C ATOM 856 C ALA A 51 -0.857 10.832 -7.450 1.00 44.30 C ATOM 857 O ALA A 51 -1.871 10.687 -8.150 1.00 44.01 O ATOM 858 CB ALA A 51 -1.611 9.261 -5.605 1.00 53.14 C ATOM 0 H ALA A 51 -2.472 11.877 -5.505 1.00 64.31 H new ATOM 0 HA ALA A 51 0.151 10.474 -5.607 1.00 32.03 H new ATOM 0 HB1 ALA A 51 -1.141 8.438 -6.143 1.00 53.14 H new ATOM 0 HB2 ALA A 51 -1.554 9.073 -4.533 1.00 53.14 H new ATOM 0 HB3 ALA A 51 -2.656 9.340 -5.905 1.00 53.14 H new ATOM 864 N THR A 52 0.324 11.233 -7.937 1.00 33.02 N ATOM 865 CA THR A 52 0.571 11.545 -9.361 1.00 32.54 C ATOM 866 C THR A 52 2.085 11.453 -9.653 1.00 15.10 C ATOM 867 O THR A 52 2.862 10.991 -8.808 1.00 22.10 O ATOM 868 CB THR A 52 0.022 12.975 -9.733 1.00 54.21 C ATOM 869 OG1 THR A 52 0.176 13.222 -11.145 1.00 1.41 O ATOM 870 CG2 THR A 52 0.720 14.097 -8.936 1.00 52.43 C ATOM 0 H THR A 52 1.149 11.353 -7.350 1.00 33.02 H new ATOM 0 HA THR A 52 0.040 10.818 -9.976 1.00 32.54 H new ATOM 0 HB THR A 52 -1.035 12.985 -9.469 1.00 54.21 H new ATOM 0 HG1 THR A 52 -0.171 14.113 -11.361 1.00 1.41 H new ATOM 0 HG21 THR A 52 0.307 15.062 -9.228 1.00 52.43 H new ATOM 0 HG22 THR A 52 0.558 13.941 -7.870 1.00 52.43 H new ATOM 0 HG23 THR A 52 1.789 14.082 -9.146 1.00 52.43 H new ATOM 878 N LYS A 53 2.502 11.857 -10.862 1.00 13.02 N ATOM 879 CA LYS A 53 3.923 12.065 -11.174 1.00 62.22 C ATOM 880 C LYS A 53 4.414 13.338 -10.431 1.00 1.43 C ATOM 881 O LYS A 53 4.195 14.459 -10.901 1.00 53.01 O ATOM 882 CB LYS A 53 4.168 12.185 -12.710 1.00 1.52 C ATOM 883 CG LYS A 53 3.986 10.885 -13.547 1.00 72.42 C ATOM 884 CD LYS A 53 2.532 10.362 -13.627 1.00 35.34 C ATOM 885 CE LYS A 53 1.555 11.355 -14.285 1.00 15.34 C ATOM 886 NZ LYS A 53 0.187 10.789 -14.388 1.00 64.21 N ATOM 0 H LYS A 53 1.873 12.047 -11.642 1.00 13.02 H new ATOM 0 HA LYS A 53 4.490 11.198 -10.836 1.00 62.22 H new ATOM 0 HB2 LYS A 53 3.491 12.942 -13.105 1.00 1.52 H new ATOM 0 HB3 LYS A 53 5.183 12.552 -12.866 1.00 1.52 H new ATOM 0 HG2 LYS A 53 4.347 11.068 -14.559 1.00 72.42 H new ATOM 0 HG3 LYS A 53 4.615 10.104 -13.120 1.00 72.42 H new ATOM 0 HD2 LYS A 53 2.521 9.428 -14.189 1.00 35.34 H new ATOM 0 HD3 LYS A 53 2.181 10.133 -12.621 1.00 35.34 H new ATOM 0 HE2 LYS A 53 1.525 12.276 -13.703 1.00 15.34 H new ATOM 0 HE3 LYS A 53 1.917 11.617 -15.279 1.00 15.34 H new ATOM 0 HZ1 LYS A 53 -0.507 11.563 -14.423 1.00 64.21 H new ATOM 0 HZ2 LYS A 53 0.112 10.217 -15.253 1.00 64.21 H new ATOM 0 HZ3 LYS A 53 -0.004 10.190 -13.560 1.00 64.21 H new ATOM 900 N GLY A 54 5.023 13.149 -9.247 1.00 3.02 N ATOM 901 CA GLY A 54 5.464 14.270 -8.396 1.00 1.53 C ATOM 902 C GLY A 54 4.417 14.708 -7.365 1.00 34.32 C ATOM 903 O GLY A 54 4.257 15.904 -7.095 1.00 32.42 O ATOM 0 H GLY A 54 5.222 12.228 -8.856 1.00 3.02 H new ATOM 0 HA2 GLY A 54 6.377 13.982 -7.874 1.00 1.53 H new ATOM 0 HA3 GLY A 54 5.714 15.120 -9.031 1.00 1.53 H new ATOM 907 N GLY A 55 3.689 13.727 -6.804 1.00 1.13 N ATOM 908 CA GLY A 55 2.788 13.951 -5.655 1.00 44.24 C ATOM 909 C GLY A 55 3.394 13.459 -4.334 1.00 52.10 C ATOM 910 O GLY A 55 4.523 12.962 -4.321 1.00 53.43 O ATOM 0 H GLY A 55 3.707 12.761 -7.130 1.00 1.13 H new ATOM 0 HA2 GLY A 55 2.563 15.014 -5.575 1.00 44.24 H new ATOM 0 HA3 GLY A 55 1.843 13.438 -5.832 1.00 44.24 H new ATOM 914 N SER A 56 2.645 13.592 -3.223 1.00 1.55 N ATOM 915 CA SER A 56 3.066 13.057 -1.899 1.00 34.44 C ATOM 916 C SER A 56 1.883 12.965 -0.912 1.00 33.41 C ATOM 917 O SER A 56 0.880 13.667 -1.052 1.00 61.35 O ATOM 918 CB SER A 56 4.199 13.902 -1.264 1.00 24.20 C ATOM 919 OG SER A 56 3.774 15.220 -0.961 1.00 4.14 O ATOM 0 H SER A 56 1.742 14.066 -3.209 1.00 1.55 H new ATOM 0 HA SER A 56 3.444 12.053 -2.089 1.00 34.44 H new ATOM 0 HB2 SER A 56 4.547 13.415 -0.353 1.00 24.20 H new ATOM 0 HB3 SER A 56 5.047 13.943 -1.948 1.00 24.20 H new ATOM 0 HG SER A 56 4.516 15.719 -0.561 1.00 4.14 H new ATOM 925 N ALA A 57 2.036 12.097 0.103 1.00 62.34 N ATOM 926 CA ALA A 57 1.035 11.885 1.166 1.00 40.21 C ATOM 927 C ALA A 57 1.715 11.759 2.542 1.00 52.13 C ATOM 928 O ALA A 57 2.847 11.291 2.641 1.00 3.14 O ATOM 929 CB ALA A 57 0.199 10.627 0.878 1.00 24.35 C ATOM 0 H ALA A 57 2.867 11.516 0.211 1.00 62.34 H new ATOM 0 HA ALA A 57 0.374 12.752 1.182 1.00 40.21 H new ATOM 0 HB1 ALA A 57 -0.534 10.487 1.673 1.00 24.35 H new ATOM 0 HB2 ALA A 57 -0.317 10.743 -0.075 1.00 24.35 H new ATOM 0 HB3 ALA A 57 0.854 9.757 0.832 1.00 24.35 H new ATOM 935 N PHE A 58 1.001 12.166 3.598 1.00 72.33 N ATOM 936 CA PHE A 58 1.453 12.024 4.995 1.00 33.02 C ATOM 937 C PHE A 58 0.325 11.408 5.844 1.00 72.14 C ATOM 938 O PHE A 58 -0.815 11.878 5.813 1.00 54.21 O ATOM 939 CB PHE A 58 1.904 13.398 5.571 1.00 4.42 C ATOM 940 CG PHE A 58 2.304 13.385 7.056 1.00 20.12 C ATOM 941 CD1 PHE A 58 3.150 12.397 7.570 1.00 52.41 C ATOM 942 CD2 PHE A 58 1.844 14.365 7.933 1.00 11.43 C ATOM 943 CE1 PHE A 58 3.514 12.391 8.899 1.00 32.30 C ATOM 944 CE2 PHE A 58 2.210 14.356 9.266 1.00 12.12 C ATOM 945 CZ PHE A 58 3.043 13.370 9.748 1.00 21.34 C ATOM 0 H PHE A 58 0.085 12.607 3.511 1.00 72.33 H new ATOM 0 HA PHE A 58 2.315 11.358 5.025 1.00 33.02 H new ATOM 0 HB2 PHE A 58 2.750 13.759 4.986 1.00 4.42 H new ATOM 0 HB3 PHE A 58 1.094 14.115 5.436 1.00 4.42 H new ATOM 0 HD1 PHE A 58 3.525 11.625 6.914 1.00 52.41 H new ATOM 0 HD2 PHE A 58 1.192 15.143 7.566 1.00 11.43 H new ATOM 0 HE1 PHE A 58 4.169 11.619 9.276 1.00 32.30 H new ATOM 0 HE2 PHE A 58 1.842 15.123 9.931 1.00 12.12 H new ATOM 0 HZ PHE A 58 3.327 13.364 10.790 1.00 21.34 H new ATOM 955 N TYR A 59 0.669 10.356 6.601 1.00 25.23 N ATOM 956 CA TYR A 59 -0.267 9.649 7.492 1.00 41.45 C ATOM 957 C TYR A 59 0.428 9.197 8.792 1.00 24.31 C ATOM 958 O TYR A 59 1.656 9.259 8.908 1.00 31.25 O ATOM 959 CB TYR A 59 -0.928 8.448 6.752 1.00 40.23 C ATOM 960 CG TYR A 59 0.035 7.398 6.162 1.00 13.22 C ATOM 961 CD1 TYR A 59 0.614 7.568 4.894 1.00 20.10 C ATOM 962 CD2 TYR A 59 0.345 6.223 6.858 1.00 2.32 C ATOM 963 CE1 TYR A 59 1.461 6.612 4.354 1.00 71.24 C ATOM 964 CE2 TYR A 59 1.186 5.269 6.319 1.00 32.00 C ATOM 965 CZ TYR A 59 1.743 5.466 5.069 1.00 1.14 C ATOM 966 OH TYR A 59 2.574 4.504 4.531 1.00 24.25 O ATOM 0 H TYR A 59 1.612 9.968 6.613 1.00 25.23 H new ATOM 0 HA TYR A 59 -1.056 10.346 7.774 1.00 41.45 H new ATOM 0 HB2 TYR A 59 -1.599 7.944 7.448 1.00 40.23 H new ATOM 0 HB3 TYR A 59 -1.544 8.841 5.943 1.00 40.23 H new ATOM 0 HD1 TYR A 59 0.395 8.461 4.328 1.00 20.10 H new ATOM 0 HD2 TYR A 59 -0.082 6.059 7.836 1.00 2.32 H new ATOM 0 HE1 TYR A 59 1.898 6.764 3.378 1.00 71.24 H new ATOM 0 HE2 TYR A 59 1.408 4.369 6.874 1.00 32.00 H new ATOM 0 HH TYR A 59 3.215 4.928 3.923 1.00 24.25 H new ATOM 976 N ALA A 60 -0.377 8.752 9.769 1.00 23.42 N ATOM 977 CA ALA A 60 0.119 8.264 11.069 1.00 72.00 C ATOM 978 C ALA A 60 -0.751 7.102 11.583 1.00 40.44 C ATOM 979 O ALA A 60 -1.979 7.193 11.573 1.00 60.23 O ATOM 980 CB ALA A 60 0.154 9.407 12.097 1.00 74.25 C ATOM 0 H ALA A 60 -1.393 8.720 9.681 1.00 23.42 H new ATOM 0 HA ALA A 60 1.135 7.894 10.929 1.00 72.00 H new ATOM 0 HB1 ALA A 60 0.523 9.028 13.050 1.00 74.25 H new ATOM 0 HB2 ALA A 60 0.815 10.197 11.740 1.00 74.25 H new ATOM 0 HB3 ALA A 60 -0.851 9.808 12.230 1.00 74.25 H new ATOM 986 N ILE A 61 -0.106 6.017 12.034 1.00 40.35 N ATOM 987 CA ILE A 61 -0.787 4.859 12.634 1.00 71.30 C ATOM 988 C ILE A 61 -1.214 5.195 14.083 1.00 5.32 C ATOM 989 O ILE A 61 -0.375 5.269 14.993 1.00 2.41 O ATOM 990 CB ILE A 61 0.143 3.584 12.619 1.00 64.21 C ATOM 991 CG1 ILE A 61 0.579 3.218 11.159 1.00 75.13 C ATOM 992 CG2 ILE A 61 -0.520 2.372 13.332 1.00 61.14 C ATOM 993 CD1 ILE A 61 -0.558 2.883 10.201 1.00 41.31 C ATOM 0 H ILE A 61 0.908 5.917 11.993 1.00 40.35 H new ATOM 0 HA ILE A 61 -1.674 4.635 12.041 1.00 71.30 H new ATOM 0 HB ILE A 61 1.041 3.834 13.184 1.00 64.21 H new ATOM 0 HG12 ILE A 61 1.144 4.054 10.747 1.00 75.13 H new ATOM 0 HG13 ILE A 61 1.257 2.366 11.203 1.00 75.13 H new ATOM 0 HG21 ILE A 61 0.155 1.516 13.298 1.00 61.14 H new ATOM 0 HG22 ILE A 61 -0.727 2.630 14.371 1.00 61.14 H new ATOM 0 HG23 ILE A 61 -1.453 2.119 12.828 1.00 61.14 H new ATOM 0 HD11 ILE A 61 -0.148 2.645 9.219 1.00 41.31 H new ATOM 0 HD12 ILE A 61 -1.113 2.025 10.581 1.00 41.31 H new ATOM 0 HD13 ILE A 61 -1.227 3.739 10.117 1.00 41.31 H new ATOM 1005 N GLN A 62 -2.523 5.441 14.268 1.00 31.54 N ATOM 1006 CA GLN A 62 -3.108 5.780 15.577 1.00 51.24 C ATOM 1007 C GLN A 62 -3.399 4.476 16.374 1.00 5.15 C ATOM 1008 O GLN A 62 -4.424 3.831 16.184 1.00 51.10 O ATOM 1009 CB GLN A 62 -4.416 6.630 15.361 1.00 21.03 C ATOM 1010 CG GLN A 62 -4.560 7.842 16.307 1.00 52.11 C ATOM 1011 CD GLN A 62 -4.537 7.485 17.796 1.00 34.01 C ATOM 1012 OE1 GLN A 62 -5.025 6.442 18.222 1.00 60.33 O ATOM 1013 NE2 GLN A 62 -3.940 8.339 18.595 1.00 25.03 N ATOM 0 H GLN A 62 -3.207 5.410 13.512 1.00 31.54 H new ATOM 0 HA GLN A 62 -2.406 6.378 16.158 1.00 51.24 H new ATOM 0 HB2 GLN A 62 -4.436 6.986 14.331 1.00 21.03 H new ATOM 0 HB3 GLN A 62 -5.281 5.980 15.491 1.00 21.03 H new ATOM 0 HG2 GLN A 62 -3.754 8.546 16.102 1.00 52.11 H new ATOM 0 HG3 GLN A 62 -5.496 8.354 16.082 1.00 52.11 H new ATOM 0 HE21 GLN A 62 -3.542 9.199 18.217 1.00 25.03 H new ATOM 0 HE22 GLN A 62 -3.874 8.143 19.594 1.00 25.03 H new ATOM 1022 N ALA A 63 -2.476 4.114 17.267 1.00 14.40 N ATOM 1023 CA ALA A 63 -2.609 2.953 18.178 1.00 70.10 C ATOM 1024 C ALA A 63 -3.041 3.435 19.591 1.00 0.30 C ATOM 1025 O ALA A 63 -2.722 4.572 19.968 1.00 32.13 O ATOM 1026 CB ALA A 63 -1.271 2.183 18.226 1.00 50.11 C ATOM 0 H ALA A 63 -1.599 4.620 17.387 1.00 14.40 H new ATOM 0 HA ALA A 63 -3.380 2.277 17.808 1.00 70.10 H new ATOM 0 HB1 ALA A 63 -1.367 1.328 18.896 1.00 50.11 H new ATOM 0 HB2 ALA A 63 -1.016 1.833 17.226 1.00 50.11 H new ATOM 0 HB3 ALA A 63 -0.484 2.843 18.591 1.00 50.11 H new ATOM 1032 N PRO A 64 -3.763 2.586 20.406 1.00 32.14 N ATOM 1033 CA PRO A 64 -4.287 2.994 21.751 1.00 11.11 C ATOM 1034 C PRO A 64 -3.205 3.431 22.801 1.00 45.14 C ATOM 1035 O PRO A 64 -3.566 3.903 23.886 1.00 3.45 O ATOM 1036 CB PRO A 64 -5.076 1.736 22.229 1.00 42.41 C ATOM 1037 CG PRO A 64 -4.523 0.601 21.420 1.00 71.04 C ATOM 1038 CD PRO A 64 -4.182 1.191 20.072 1.00 13.21 C ATOM 0 HA PRO A 64 -4.889 3.898 21.662 1.00 11.11 H new ATOM 0 HB2 PRO A 64 -4.937 1.565 23.296 1.00 42.41 H new ATOM 0 HB3 PRO A 64 -6.147 1.855 22.062 1.00 42.41 H new ATOM 0 HG2 PRO A 64 -3.640 0.174 21.896 1.00 71.04 H new ATOM 0 HG3 PRO A 64 -5.253 -0.203 21.323 1.00 71.04 H new ATOM 0 HD2 PRO A 64 -3.382 0.637 19.581 1.00 13.21 H new ATOM 0 HD3 PRO A 64 -5.039 1.178 19.398 1.00 13.21 H new ATOM 1046 N GLN A 65 -1.898 3.275 22.486 1.00 4.13 N ATOM 1047 CA GLN A 65 -0.790 3.771 23.365 1.00 3.43 C ATOM 1048 C GLN A 65 0.453 4.242 22.532 1.00 62.30 C ATOM 1049 O GLN A 65 1.529 4.509 23.085 1.00 32.45 O ATOM 1050 CB GLN A 65 -0.404 2.662 24.403 1.00 25.33 C ATOM 1051 CG GLN A 65 0.487 3.134 25.583 1.00 15.41 C ATOM 1052 CD GLN A 65 0.850 2.024 26.580 1.00 34.43 C ATOM 1053 OE1 GLN A 65 0.100 1.079 26.785 1.00 11.35 O ATOM 1054 NE2 GLN A 65 2.000 2.137 27.220 1.00 73.24 N ATOM 0 H GLN A 65 -1.576 2.813 21.636 1.00 4.13 H new ATOM 0 HA GLN A 65 -1.146 4.648 23.906 1.00 3.43 H new ATOM 0 HB2 GLN A 65 -1.320 2.235 24.810 1.00 25.33 H new ATOM 0 HB3 GLN A 65 0.114 1.861 23.877 1.00 25.33 H new ATOM 0 HG2 GLN A 65 1.406 3.561 25.182 1.00 15.41 H new ATOM 0 HG3 GLN A 65 -0.029 3.932 26.117 1.00 15.41 H new ATOM 0 HE21 GLN A 65 2.611 2.933 27.035 1.00 73.24 H new ATOM 0 HE22 GLN A 65 2.277 1.429 27.900 1.00 73.24 H new ATOM 1063 N MET A 66 0.286 4.410 21.200 1.00 55.33 N ATOM 1064 CA MET A 66 1.406 4.778 20.282 1.00 2.41 C ATOM 1065 C MET A 66 0.881 5.506 19.020 1.00 33.20 C ATOM 1066 O MET A 66 -0.179 5.178 18.519 1.00 50.05 O ATOM 1067 CB MET A 66 2.192 3.492 19.877 1.00 43.53 C ATOM 1068 CG MET A 66 3.378 3.709 18.919 1.00 0.35 C ATOM 1069 SD MET A 66 4.224 2.172 18.479 1.00 12.24 S ATOM 1070 CE MET A 66 2.930 1.241 17.648 1.00 75.14 C ATOM 0 H MET A 66 -0.612 4.298 20.730 1.00 55.33 H new ATOM 0 HA MET A 66 2.073 5.462 20.806 1.00 2.41 H new ATOM 0 HB2 MET A 66 2.564 3.015 20.784 1.00 43.53 H new ATOM 0 HB3 MET A 66 1.496 2.794 19.412 1.00 43.53 H new ATOM 0 HG2 MET A 66 3.020 4.193 18.010 1.00 0.35 H new ATOM 0 HG3 MET A 66 4.092 4.390 19.382 1.00 0.35 H new ATOM 0 HE1 MET A 66 3.377 0.430 17.073 1.00 75.14 H new ATOM 0 HE2 MET A 66 2.247 0.826 18.389 1.00 75.14 H new ATOM 0 HE3 MET A 66 2.380 1.901 16.977 1.00 75.14 H new ATOM 1080 N ILE A 67 1.629 6.506 18.514 1.00 40.41 N ATOM 1081 CA ILE A 67 1.334 7.171 17.214 1.00 42.12 C ATOM 1082 C ILE A 67 2.630 7.206 16.369 1.00 1.14 C ATOM 1083 O ILE A 67 3.613 7.832 16.771 1.00 25.10 O ATOM 1084 CB ILE A 67 0.771 8.640 17.395 1.00 23.14 C ATOM 1085 CG1 ILE A 67 -0.481 8.659 18.342 1.00 52.21 C ATOM 1086 CG2 ILE A 67 0.422 9.267 16.017 1.00 2.43 C ATOM 1087 CD1 ILE A 67 -1.037 10.045 18.652 1.00 63.11 C ATOM 0 H ILE A 67 2.452 6.879 18.986 1.00 40.41 H new ATOM 0 HA ILE A 67 0.557 6.595 16.710 1.00 42.12 H new ATOM 0 HB ILE A 67 1.552 9.240 17.862 1.00 23.14 H new ATOM 0 HG12 ILE A 67 -1.271 8.061 17.887 1.00 52.21 H new ATOM 0 HG13 ILE A 67 -0.215 8.173 19.281 1.00 52.21 H new ATOM 0 HG21 ILE A 67 0.037 10.276 16.163 1.00 2.43 H new ATOM 0 HG22 ILE A 67 1.318 9.307 15.398 1.00 2.43 H new ATOM 0 HG23 ILE A 67 -0.334 8.658 15.521 1.00 2.43 H new ATOM 0 HD11 ILE A 67 -1.899 9.952 19.313 1.00 63.11 H new ATOM 0 HD12 ILE A 67 -0.269 10.644 19.140 1.00 63.11 H new ATOM 0 HD13 ILE A 67 -1.341 10.531 17.725 1.00 63.11 H new ATOM 1099 N SER A 68 2.632 6.520 15.209 1.00 24.33 N ATOM 1100 CA SER A 68 3.843 6.385 14.357 1.00 64.12 C ATOM 1101 C SER A 68 3.610 6.978 12.950 1.00 24.21 C ATOM 1102 O SER A 68 2.691 6.578 12.251 1.00 63.13 O ATOM 1103 CB SER A 68 4.251 4.902 14.256 1.00 63.33 C ATOM 1104 OG SER A 68 5.442 4.742 13.502 1.00 5.44 O ATOM 0 H SER A 68 1.809 6.048 14.835 1.00 24.33 H new ATOM 0 HA SER A 68 4.652 6.948 14.823 1.00 64.12 H new ATOM 0 HB2 SER A 68 4.395 4.494 15.256 1.00 63.33 H new ATOM 0 HB3 SER A 68 3.446 4.333 13.792 1.00 63.33 H new ATOM 0 HG SER A 68 5.676 3.791 13.457 1.00 5.44 H new ATOM 1110 N TYR A 69 4.488 7.901 12.536 1.00 53.30 N ATOM 1111 CA TYR A 69 4.291 8.754 11.335 1.00 14.12 C ATOM 1112 C TYR A 69 5.054 8.207 10.098 1.00 4.33 C ATOM 1113 O TYR A 69 6.139 7.637 10.241 1.00 64.12 O ATOM 1114 CB TYR A 69 4.764 10.194 11.667 1.00 73.53 C ATOM 1115 CG TYR A 69 4.127 10.791 12.940 1.00 75.53 C ATOM 1116 CD1 TYR A 69 4.645 10.495 14.205 1.00 61.20 C ATOM 1117 CD2 TYR A 69 3.010 11.632 12.881 1.00 24.35 C ATOM 1118 CE1 TYR A 69 4.078 11.009 15.351 1.00 40.51 C ATOM 1119 CE2 TYR A 69 2.440 12.150 14.032 1.00 20.23 C ATOM 1120 CZ TYR A 69 2.976 11.836 15.263 1.00 25.14 C ATOM 1121 OH TYR A 69 2.406 12.348 16.413 1.00 22.45 O ATOM 0 H TYR A 69 5.365 8.086 13.023 1.00 53.30 H new ATOM 0 HA TYR A 69 3.232 8.752 11.078 1.00 14.12 H new ATOM 0 HB2 TYR A 69 5.848 10.191 11.784 1.00 73.53 H new ATOM 0 HB3 TYR A 69 4.536 10.843 10.822 1.00 73.53 H new ATOM 0 HD1 TYR A 69 5.508 9.850 14.285 1.00 61.20 H new ATOM 0 HD2 TYR A 69 2.585 11.882 11.920 1.00 24.35 H new ATOM 0 HE1 TYR A 69 4.495 10.765 16.317 1.00 40.51 H new ATOM 0 HE2 TYR A 69 1.578 12.798 13.966 1.00 20.23 H new ATOM 0 HH TYR A 69 1.640 12.912 16.176 1.00 22.45 H new ATOM 1131 N THR A 70 4.490 8.419 8.884 1.00 64.01 N ATOM 1132 CA THR A 70 5.106 7.984 7.599 1.00 42.43 C ATOM 1133 C THR A 70 4.682 8.924 6.431 1.00 43.20 C ATOM 1134 O THR A 70 3.498 9.233 6.267 1.00 71.11 O ATOM 1135 CB THR A 70 4.728 6.499 7.234 1.00 23.44 C ATOM 1136 OG1 THR A 70 5.139 5.597 8.280 1.00 3.45 O ATOM 1137 CG2 THR A 70 5.367 6.041 5.912 1.00 21.40 C ATOM 0 H THR A 70 3.596 8.896 8.764 1.00 64.01 H new ATOM 0 HA THR A 70 6.186 8.039 7.738 1.00 42.43 H new ATOM 0 HB THR A 70 3.644 6.477 7.121 1.00 23.44 H new ATOM 0 HG1 THR A 70 4.894 4.680 8.036 1.00 3.45 H new ATOM 0 HG21 THR A 70 5.076 5.011 5.705 1.00 21.40 H new ATOM 0 HG22 THR A 70 5.026 6.684 5.101 1.00 21.40 H new ATOM 0 HG23 THR A 70 6.452 6.102 5.992 1.00 21.40 H new ATOM 1145 N ILE A 71 5.674 9.379 5.635 1.00 31.45 N ATOM 1146 CA ILE A 71 5.472 10.247 4.442 1.00 73.44 C ATOM 1147 C ILE A 71 5.831 9.481 3.137 1.00 4.11 C ATOM 1148 O ILE A 71 6.993 9.142 2.923 1.00 21.01 O ATOM 1149 CB ILE A 71 6.395 11.525 4.544 1.00 34.20 C ATOM 1150 CG1 ILE A 71 6.149 12.269 5.892 1.00 4.14 C ATOM 1151 CG2 ILE A 71 6.194 12.472 3.326 1.00 1.02 C ATOM 1152 CD1 ILE A 71 7.108 13.401 6.194 1.00 43.14 C ATOM 0 H ILE A 71 6.655 9.153 5.801 1.00 31.45 H new ATOM 0 HA ILE A 71 4.423 10.541 4.413 1.00 73.44 H new ATOM 0 HB ILE A 71 7.434 11.195 4.524 1.00 34.20 H new ATOM 0 HG12 ILE A 71 5.134 12.667 5.888 1.00 4.14 H new ATOM 0 HG13 ILE A 71 6.204 11.543 6.703 1.00 4.14 H new ATOM 0 HG21 ILE A 71 6.844 13.341 3.429 1.00 1.02 H new ATOM 0 HG22 ILE A 71 6.441 11.940 2.407 1.00 1.02 H new ATOM 0 HG23 ILE A 71 5.155 12.799 3.287 1.00 1.02 H new ATOM 0 HD11 ILE A 71 6.850 13.851 7.153 1.00 43.14 H new ATOM 0 HD12 ILE A 71 8.126 13.014 6.237 1.00 43.14 H new ATOM 0 HD13 ILE A 71 7.040 14.155 5.410 1.00 43.14 H new ATOM 1164 N ALA A 72 4.851 9.248 2.246 1.00 51.21 N ATOM 1165 CA ALA A 72 5.107 8.583 0.943 1.00 52.25 C ATOM 1166 C ALA A 72 5.221 9.622 -0.204 1.00 70.11 C ATOM 1167 O ALA A 72 4.267 10.331 -0.502 1.00 42.43 O ATOM 1168 CB ALA A 72 3.988 7.565 0.643 1.00 64.50 C ATOM 0 H ALA A 72 3.876 9.507 2.398 1.00 51.21 H new ATOM 0 HA ALA A 72 6.059 8.055 1.008 1.00 52.25 H new ATOM 0 HB1 ALA A 72 4.183 7.082 -0.314 1.00 64.50 H new ATOM 0 HB2 ALA A 72 3.960 6.812 1.431 1.00 64.50 H new ATOM 0 HB3 ALA A 72 3.029 8.081 0.600 1.00 64.50 H new ATOM 1174 N GLU A 73 6.405 9.698 -0.830 1.00 62.44 N ATOM 1175 CA GLU A 73 6.640 10.498 -2.050 1.00 34.25 C ATOM 1176 C GLU A 73 6.148 9.728 -3.298 1.00 75.41 C ATOM 1177 O GLU A 73 6.756 8.737 -3.687 1.00 24.12 O ATOM 1178 CB GLU A 73 8.166 10.781 -2.168 1.00 72.11 C ATOM 1179 CG GLU A 73 8.737 11.745 -1.103 1.00 21.25 C ATOM 1180 CD GLU A 73 8.341 13.215 -1.347 1.00 62.21 C ATOM 1181 OE1 GLU A 73 8.843 13.808 -2.332 1.00 75.01 O ATOM 1182 OE2 GLU A 73 7.541 13.780 -0.574 1.00 72.03 O ATOM 0 H GLU A 73 7.235 9.203 -0.504 1.00 62.44 H new ATOM 0 HA GLU A 73 6.089 11.436 -1.988 1.00 34.25 H new ATOM 0 HB2 GLU A 73 8.702 9.834 -2.103 1.00 72.11 H new ATOM 0 HB3 GLU A 73 8.368 11.195 -3.156 1.00 72.11 H new ATOM 0 HG2 GLU A 73 8.386 11.439 -0.118 1.00 21.25 H new ATOM 0 HG3 GLU A 73 9.824 11.664 -1.093 1.00 21.25 H new ATOM 1189 N TYR A 74 5.079 10.216 -3.946 1.00 13.42 N ATOM 1190 CA TYR A 74 4.517 9.579 -5.163 1.00 0.43 C ATOM 1191 C TYR A 74 5.264 10.057 -6.420 1.00 74.33 C ATOM 1192 O TYR A 74 5.058 11.175 -6.898 1.00 70.11 O ATOM 1193 CB TYR A 74 2.983 9.817 -5.246 1.00 4.14 C ATOM 1194 CG TYR A 74 2.204 9.026 -4.176 1.00 54.54 C ATOM 1195 CD1 TYR A 74 2.141 9.471 -2.858 1.00 4.30 C ATOM 1196 CD2 TYR A 74 1.579 7.809 -4.474 1.00 32.21 C ATOM 1197 CE1 TYR A 74 1.489 8.741 -1.885 1.00 30.42 C ATOM 1198 CE2 TYR A 74 0.914 7.083 -3.504 1.00 61.14 C ATOM 1199 CZ TYR A 74 0.878 7.549 -2.209 1.00 31.11 C ATOM 1200 OH TYR A 74 0.239 6.817 -1.230 1.00 63.34 O ATOM 0 H TYR A 74 4.579 11.054 -3.651 1.00 13.42 H new ATOM 0 HA TYR A 74 4.665 8.501 -5.102 1.00 0.43 H new ATOM 0 HB2 TYR A 74 2.777 10.881 -5.129 1.00 4.14 H new ATOM 0 HB3 TYR A 74 2.627 9.531 -6.236 1.00 4.14 H new ATOM 0 HD1 TYR A 74 2.612 10.406 -2.592 1.00 4.30 H new ATOM 0 HD2 TYR A 74 1.617 7.429 -5.484 1.00 32.21 H new ATOM 0 HE1 TYR A 74 1.458 9.104 -0.868 1.00 30.42 H new ATOM 0 HE2 TYR A 74 0.425 6.155 -3.761 1.00 61.14 H new ATOM 0 HH TYR A 74 -0.697 7.102 -1.167 1.00 63.34 H new ATOM 1210 N LEU A 75 6.157 9.185 -6.930 1.00 60.15 N ATOM 1211 CA LEU A 75 7.115 9.530 -7.997 1.00 31.22 C ATOM 1212 C LEU A 75 6.443 9.499 -9.389 1.00 2.22 C ATOM 1213 O LEU A 75 6.486 10.491 -10.125 1.00 25.33 O ATOM 1214 CB LEU A 75 8.338 8.565 -7.928 1.00 1.22 C ATOM 1215 CG LEU A 75 9.560 8.924 -8.838 1.00 33.13 C ATOM 1216 CD1 LEU A 75 10.032 10.380 -8.610 1.00 22.13 C ATOM 1217 CD2 LEU A 75 10.723 7.929 -8.618 1.00 4.22 C ATOM 0 H LEU A 75 6.233 8.219 -6.612 1.00 60.15 H new ATOM 0 HA LEU A 75 7.466 10.550 -7.842 1.00 31.22 H new ATOM 0 HB2 LEU A 75 8.682 8.523 -6.895 1.00 1.22 H new ATOM 0 HB3 LEU A 75 7.998 7.563 -8.192 1.00 1.22 H new ATOM 0 HG LEU A 75 9.231 8.843 -9.874 1.00 33.13 H new ATOM 0 HD11 LEU A 75 10.882 10.593 -9.259 1.00 22.13 H new ATOM 0 HD12 LEU A 75 9.218 11.067 -8.841 1.00 22.13 H new ATOM 0 HD13 LEU A 75 10.330 10.507 -7.569 1.00 22.13 H new ATOM 0 HD21 LEU A 75 11.560 8.200 -9.262 1.00 4.22 H new ATOM 0 HD22 LEU A 75 11.040 7.965 -7.576 1.00 4.22 H new ATOM 0 HD23 LEU A 75 10.390 6.920 -8.861 1.00 4.22 H new ATOM 1229 N GLN A 76 5.833 8.349 -9.746 1.00 22.32 N ATOM 1230 CA GLN A 76 5.060 8.185 -11.006 1.00 53.01 C ATOM 1231 C GLN A 76 3.760 7.384 -10.741 1.00 71.53 C ATOM 1232 O GLN A 76 3.809 6.200 -10.448 1.00 53.25 O ATOM 1233 CB GLN A 76 5.935 7.439 -12.069 1.00 45.25 C ATOM 1234 CG GLN A 76 7.182 8.225 -12.584 1.00 4.53 C ATOM 1235 CD GLN A 76 8.485 7.411 -12.574 1.00 74.21 C ATOM 1236 OE1 GLN A 76 8.674 6.531 -11.745 1.00 75.20 O ATOM 1237 NE2 GLN A 76 9.398 7.699 -13.482 1.00 30.33 N ATOM 0 H GLN A 76 5.860 7.506 -9.173 1.00 22.32 H new ATOM 0 HA GLN A 76 4.792 9.171 -11.385 1.00 53.01 H new ATOM 0 HB2 GLN A 76 6.274 6.497 -11.639 1.00 45.25 H new ATOM 0 HB3 GLN A 76 5.305 7.191 -12.923 1.00 45.25 H new ATOM 0 HG2 GLN A 76 6.988 8.567 -13.600 1.00 4.53 H new ATOM 0 HG3 GLN A 76 7.317 9.114 -11.968 1.00 4.53 H new ATOM 0 HE21 GLN A 76 9.223 8.436 -14.165 1.00 30.33 H new ATOM 0 HE22 GLN A 76 10.279 7.185 -13.501 1.00 30.33 H new ATOM 1246 N VAL A 77 2.590 8.029 -10.876 1.00 24.13 N ATOM 1247 CA VAL A 77 1.270 7.362 -10.699 1.00 75.10 C ATOM 1248 C VAL A 77 0.358 7.759 -11.881 1.00 53.10 C ATOM 1249 O VAL A 77 0.006 8.938 -12.029 1.00 2.20 O ATOM 1250 CB VAL A 77 0.595 7.738 -9.320 1.00 3.22 C ATOM 1251 CG1 VAL A 77 -0.718 6.951 -9.099 1.00 12.32 C ATOM 1252 CG2 VAL A 77 1.572 7.527 -8.135 1.00 11.52 C ATOM 0 H VAL A 77 2.522 9.020 -11.109 1.00 24.13 H new ATOM 0 HA VAL A 77 1.420 6.282 -10.686 1.00 75.10 H new ATOM 0 HB VAL A 77 0.345 8.798 -9.362 1.00 3.22 H new ATOM 0 HG11 VAL A 77 -1.155 7.234 -8.142 1.00 12.32 H new ATOM 0 HG12 VAL A 77 -1.420 7.181 -9.901 1.00 12.32 H new ATOM 0 HG13 VAL A 77 -0.506 5.882 -9.099 1.00 12.32 H new ATOM 0 HG21 VAL A 77 1.076 7.795 -7.202 1.00 11.52 H new ATOM 0 HG22 VAL A 77 1.877 6.481 -8.097 1.00 11.52 H new ATOM 0 HG23 VAL A 77 2.451 8.156 -8.272 1.00 11.52 H new ATOM 1262 N ASP A 78 -0.011 6.774 -12.718 1.00 14.11 N ATOM 1263 CA ASP A 78 -0.611 7.034 -14.045 1.00 25.22 C ATOM 1264 C ASP A 78 -1.579 5.894 -14.460 1.00 74.54 C ATOM 1265 O ASP A 78 -1.153 4.732 -14.558 1.00 3.33 O ATOM 1266 CB ASP A 78 0.542 7.180 -15.075 1.00 42.42 C ATOM 1267 CG ASP A 78 0.072 7.648 -16.460 1.00 54.11 C ATOM 1268 OD1 ASP A 78 -0.179 8.863 -16.630 1.00 42.50 O ATOM 1269 OD2 ASP A 78 -0.026 6.818 -17.384 1.00 23.32 O ATOM 0 H ASP A 78 0.095 5.783 -12.500 1.00 14.11 H new ATOM 0 HA ASP A 78 -1.200 7.951 -14.007 1.00 25.22 H new ATOM 0 HB2 ASP A 78 1.274 7.889 -14.690 1.00 42.42 H new ATOM 0 HB3 ASP A 78 1.050 6.221 -15.178 1.00 42.42 H new ATOM 1274 N ALA A 79 -2.880 6.249 -14.686 1.00 63.02 N ATOM 1275 CA ALA A 79 -3.953 5.308 -15.136 1.00 13.23 C ATOM 1276 C ALA A 79 -4.278 4.200 -14.079 1.00 51.11 C ATOM 1277 O ALA A 79 -3.477 3.973 -13.171 1.00 45.13 O ATOM 1278 CB ALA A 79 -3.585 4.713 -16.522 1.00 23.40 C ATOM 0 H ALA A 79 -3.215 7.204 -14.560 1.00 63.02 H new ATOM 0 HA ALA A 79 -4.876 5.879 -15.239 1.00 13.23 H new ATOM 0 HB1 ALA A 79 -4.370 4.029 -16.844 1.00 23.40 H new ATOM 0 HB2 ALA A 79 -3.485 5.519 -17.249 1.00 23.40 H new ATOM 0 HB3 ALA A 79 -2.641 4.173 -16.447 1.00 23.40 H new ATOM 1284 N PRO A 80 -5.450 3.464 -14.163 1.00 3.43 N ATOM 1285 CA PRO A 80 -5.739 2.314 -13.245 1.00 71.33 C ATOM 1286 C PRO A 80 -4.909 1.045 -13.597 1.00 52.22 C ATOM 1287 O PRO A 80 -5.413 -0.073 -13.527 1.00 21.05 O ATOM 1288 CB PRO A 80 -7.263 2.089 -13.447 1.00 33.24 C ATOM 1289 CG PRO A 80 -7.513 2.518 -14.861 1.00 64.41 C ATOM 1290 CD PRO A 80 -6.586 3.698 -15.102 1.00 53.22 C ATOM 0 HA PRO A 80 -5.466 2.520 -12.210 1.00 71.33 H new ATOM 0 HB2 PRO A 80 -7.535 1.045 -13.293 1.00 33.24 H new ATOM 0 HB3 PRO A 80 -7.850 2.678 -12.742 1.00 33.24 H new ATOM 0 HG2 PRO A 80 -7.304 1.707 -15.559 1.00 64.41 H new ATOM 0 HG3 PRO A 80 -8.555 2.803 -15.005 1.00 64.41 H new ATOM 0 HD2 PRO A 80 -6.247 3.734 -16.137 1.00 53.22 H new ATOM 0 HD3 PRO A 80 -7.085 4.645 -14.897 1.00 53.22 H new ATOM 1298 N TYR A 81 -3.625 1.235 -13.958 1.00 75.22 N ATOM 1299 CA TYR A 81 -2.735 0.157 -14.432 1.00 64.30 C ATOM 1300 C TYR A 81 -1.365 0.175 -13.706 1.00 23.41 C ATOM 1301 O TYR A 81 -0.783 -0.893 -13.461 1.00 50.45 O ATOM 1302 CB TYR A 81 -2.533 0.286 -15.967 1.00 31.15 C ATOM 1303 CG TYR A 81 -3.828 0.115 -16.784 1.00 70.34 C ATOM 1304 CD1 TYR A 81 -4.393 -1.149 -16.979 1.00 43.53 C ATOM 1305 CD2 TYR A 81 -4.491 1.208 -17.348 1.00 45.02 C ATOM 1306 CE1 TYR A 81 -5.559 -1.314 -17.701 1.00 30.54 C ATOM 1307 CE2 TYR A 81 -5.659 1.046 -18.072 1.00 21.40 C ATOM 1308 CZ TYR A 81 -6.188 -0.214 -18.246 1.00 25.32 C ATOM 1309 OH TYR A 81 -7.350 -0.378 -18.970 1.00 63.12 O ATOM 0 H TYR A 81 -3.173 2.149 -13.929 1.00 75.22 H new ATOM 0 HA TYR A 81 -3.210 -0.797 -14.202 1.00 64.30 H new ATOM 0 HB2 TYR A 81 -2.103 1.263 -16.186 1.00 31.15 H new ATOM 0 HB3 TYR A 81 -1.809 -0.461 -16.292 1.00 31.15 H new ATOM 0 HD1 TYR A 81 -3.907 -2.016 -16.556 1.00 43.53 H new ATOM 0 HD2 TYR A 81 -4.084 2.199 -17.216 1.00 45.02 H new ATOM 0 HE1 TYR A 81 -5.977 -2.301 -17.838 1.00 30.54 H new ATOM 0 HE2 TYR A 81 -6.155 1.905 -18.500 1.00 21.40 H new ATOM 0 HH TYR A 81 -7.666 0.495 -19.284 1.00 63.12 H new ATOM 1319 N TYR A 82 -0.838 1.384 -13.359 1.00 33.24 N ATOM 1320 CA TYR A 82 0.524 1.504 -12.765 1.00 31.41 C ATOM 1321 C TYR A 82 0.595 2.519 -11.589 1.00 2.33 C ATOM 1322 O TYR A 82 0.075 3.638 -11.672 1.00 63.33 O ATOM 1323 CB TYR A 82 1.557 1.896 -13.855 1.00 0.32 C ATOM 1324 CG TYR A 82 3.024 1.717 -13.416 1.00 2.13 C ATOM 1325 CD1 TYR A 82 3.556 0.436 -13.208 1.00 12.23 C ATOM 1326 CD2 TYR A 82 3.871 2.812 -13.195 1.00 61.31 C ATOM 1327 CE1 TYR A 82 4.868 0.258 -12.800 1.00 1.11 C ATOM 1328 CE2 TYR A 82 5.184 2.633 -12.791 1.00 73.51 C ATOM 1329 CZ TYR A 82 5.676 1.357 -12.591 1.00 72.40 C ATOM 1330 OH TYR A 82 6.984 1.184 -12.182 1.00 15.31 O ATOM 0 H TYR A 82 -1.325 2.272 -13.478 1.00 33.24 H new ATOM 0 HA TYR A 82 0.765 0.523 -12.355 1.00 31.41 H new ATOM 0 HB2 TYR A 82 1.378 1.293 -14.745 1.00 0.32 H new ATOM 0 HB3 TYR A 82 1.396 2.937 -14.137 1.00 0.32 H new ATOM 0 HD1 TYR A 82 2.930 -0.429 -13.369 1.00 12.23 H new ATOM 0 HD2 TYR A 82 3.493 3.813 -13.342 1.00 61.31 H new ATOM 0 HE1 TYR A 82 5.257 -0.738 -12.646 1.00 1.11 H new ATOM 0 HE2 TYR A 82 5.822 3.490 -12.633 1.00 73.51 H new ATOM 0 HH TYR A 82 7.414 2.059 -12.082 1.00 15.31 H new ATOM 1340 N ILE A 83 1.263 2.087 -10.492 1.00 42.13 N ATOM 1341 CA ILE A 83 1.596 2.930 -9.318 1.00 22.34 C ATOM 1342 C ILE A 83 3.128 2.840 -9.057 1.00 30.14 C ATOM 1343 O ILE A 83 3.707 1.753 -9.145 1.00 23.31 O ATOM 1344 CB ILE A 83 0.834 2.482 -7.995 1.00 62.45 C ATOM 1345 CG1 ILE A 83 -0.734 2.479 -8.151 1.00 54.22 C ATOM 1346 CG2 ILE A 83 1.258 3.356 -6.782 1.00 12.11 C ATOM 1347 CD1 ILE A 83 -1.326 1.265 -8.861 1.00 74.21 C ATOM 0 H ILE A 83 1.591 1.126 -10.397 1.00 42.13 H new ATOM 0 HA ILE A 83 1.281 3.947 -9.551 1.00 22.34 H new ATOM 0 HB ILE A 83 1.132 1.450 -7.811 1.00 62.45 H new ATOM 0 HG12 ILE A 83 -1.180 2.550 -7.159 1.00 54.22 H new ATOM 0 HG13 ILE A 83 -1.028 3.375 -8.697 1.00 54.22 H new ATOM 0 HG21 ILE A 83 0.722 3.028 -5.892 1.00 12.11 H new ATOM 0 HG22 ILE A 83 2.331 3.254 -6.618 1.00 12.11 H new ATOM 0 HG23 ILE A 83 1.019 4.400 -6.985 1.00 12.11 H new ATOM 0 HD11 ILE A 83 -2.410 1.367 -8.913 1.00 74.21 H new ATOM 0 HD12 ILE A 83 -0.919 1.199 -9.870 1.00 74.21 H new ATOM 0 HD13 ILE A 83 -1.073 0.361 -8.308 1.00 74.21 H new ATOM 1359 N GLU A 84 3.774 3.982 -8.760 1.00 54.32 N ATOM 1360 CA GLU A 84 5.202 4.031 -8.347 1.00 71.12 C ATOM 1361 C GLU A 84 5.375 5.130 -7.268 1.00 52.02 C ATOM 1362 O GLU A 84 5.082 6.304 -7.534 1.00 75.22 O ATOM 1363 CB GLU A 84 6.112 4.311 -9.604 1.00 5.22 C ATOM 1364 CG GLU A 84 7.545 3.718 -9.575 1.00 12.11 C ATOM 1365 CD GLU A 84 8.614 4.527 -8.809 1.00 2.41 C ATOM 1366 OE1 GLU A 84 8.492 4.711 -7.582 1.00 35.43 O ATOM 1367 OE2 GLU A 84 9.627 4.924 -9.430 1.00 13.51 O ATOM 0 H GLU A 84 3.328 4.899 -8.797 1.00 54.32 H new ATOM 0 HA GLU A 84 5.506 3.074 -7.923 1.00 71.12 H new ATOM 0 HB2 GLU A 84 5.602 3.924 -10.486 1.00 5.22 H new ATOM 0 HB3 GLU A 84 6.193 5.391 -9.731 1.00 5.22 H new ATOM 0 HG2 GLU A 84 7.492 2.722 -9.136 1.00 12.11 H new ATOM 0 HG3 GLU A 84 7.883 3.595 -10.604 1.00 12.11 H new ATOM 1374 N TYR A 85 5.844 4.757 -6.055 1.00 64.02 N ATOM 1375 CA TYR A 85 6.149 5.740 -4.990 1.00 72.21 C ATOM 1376 C TYR A 85 7.277 5.262 -4.048 1.00 41.34 C ATOM 1377 O TYR A 85 7.474 4.069 -3.837 1.00 71.03 O ATOM 1378 CB TYR A 85 4.872 6.128 -4.176 1.00 23.00 C ATOM 1379 CG TYR A 85 4.216 5.050 -3.285 1.00 33.01 C ATOM 1380 CD1 TYR A 85 4.641 4.832 -1.967 1.00 4.32 C ATOM 1381 CD2 TYR A 85 3.132 4.291 -3.741 1.00 4.01 C ATOM 1382 CE1 TYR A 85 4.023 3.904 -1.152 1.00 3.11 C ATOM 1383 CE2 TYR A 85 2.514 3.359 -2.928 1.00 22.11 C ATOM 1384 CZ TYR A 85 2.961 3.168 -1.634 1.00 4.01 C ATOM 1385 OH TYR A 85 2.343 2.240 -0.822 1.00 31.10 O ATOM 0 H TYR A 85 6.019 3.788 -5.790 1.00 64.02 H new ATOM 0 HA TYR A 85 6.510 6.634 -5.497 1.00 72.21 H new ATOM 0 HB2 TYR A 85 5.128 6.975 -3.539 1.00 23.00 H new ATOM 0 HB3 TYR A 85 4.120 6.477 -4.884 1.00 23.00 H new ATOM 0 HD1 TYR A 85 5.472 5.403 -1.580 1.00 4.32 H new ATOM 0 HD2 TYR A 85 2.771 4.436 -4.748 1.00 4.01 H new ATOM 0 HE1 TYR A 85 4.370 3.755 -0.140 1.00 3.11 H new ATOM 0 HE2 TYR A 85 1.683 2.781 -3.304 1.00 22.11 H new ATOM 0 HH TYR A 85 1.613 1.809 -1.314 1.00 31.10 H new ATOM 1395 N LEU A 86 8.016 6.236 -3.498 1.00 33.53 N ATOM 1396 CA LEU A 86 8.960 6.040 -2.387 1.00 71.15 C ATOM 1397 C LEU A 86 8.213 6.228 -1.051 1.00 3.42 C ATOM 1398 O LEU A 86 7.644 7.287 -0.824 1.00 22.30 O ATOM 1399 CB LEU A 86 10.077 7.111 -2.480 1.00 32.21 C ATOM 1400 CG LEU A 86 10.927 7.118 -3.784 1.00 64.20 C ATOM 1401 CD1 LEU A 86 11.768 8.409 -3.892 1.00 14.45 C ATOM 1402 CD2 LEU A 86 11.824 5.866 -3.864 1.00 35.30 C ATOM 0 H LEU A 86 7.974 7.203 -3.820 1.00 33.53 H new ATOM 0 HA LEU A 86 9.389 5.039 -2.441 1.00 71.15 H new ATOM 0 HB2 LEU A 86 9.618 8.093 -2.367 1.00 32.21 H new ATOM 0 HB3 LEU A 86 10.751 6.975 -1.634 1.00 32.21 H new ATOM 0 HG LEU A 86 10.241 7.095 -4.631 1.00 64.20 H new ATOM 0 HD11 LEU A 86 12.352 8.387 -4.812 1.00 14.45 H new ATOM 0 HD12 LEU A 86 11.106 9.275 -3.903 1.00 14.45 H new ATOM 0 HD13 LEU A 86 12.441 8.478 -3.037 1.00 14.45 H new ATOM 0 HD21 LEU A 86 12.408 5.895 -4.784 1.00 35.30 H new ATOM 0 HD22 LEU A 86 12.498 5.846 -3.007 1.00 35.30 H new ATOM 0 HD23 LEU A 86 11.201 4.971 -3.857 1.00 35.30 H new ATOM 1414 N ASP A 87 8.232 5.229 -0.163 1.00 73.51 N ATOM 1415 CA ASP A 87 7.590 5.342 1.161 1.00 62.43 C ATOM 1416 C ASP A 87 8.671 5.639 2.222 1.00 34.21 C ATOM 1417 O ASP A 87 9.378 4.740 2.671 1.00 53.20 O ATOM 1418 CB ASP A 87 6.836 4.018 1.485 1.00 1.12 C ATOM 1419 CG ASP A 87 5.896 4.139 2.695 1.00 35.04 C ATOM 1420 OD1 ASP A 87 4.852 4.819 2.573 1.00 51.22 O ATOM 1421 OD2 ASP A 87 6.198 3.567 3.768 1.00 51.42 O ATOM 0 H ASP A 87 8.684 4.330 -0.332 1.00 73.51 H new ATOM 0 HA ASP A 87 6.867 6.157 1.163 1.00 62.43 H new ATOM 0 HB2 ASP A 87 6.258 3.714 0.613 1.00 1.12 H new ATOM 0 HB3 ASP A 87 7.564 3.230 1.676 1.00 1.12 H new ATOM 1426 N TYR A 88 8.786 6.900 2.635 1.00 24.23 N ATOM 1427 CA TYR A 88 9.730 7.299 3.692 1.00 13.13 C ATOM 1428 C TYR A 88 9.017 7.218 5.047 1.00 72.42 C ATOM 1429 O TYR A 88 8.037 7.922 5.265 1.00 3.12 O ATOM 1430 CB TYR A 88 10.253 8.751 3.459 1.00 52.32 C ATOM 1431 CG TYR A 88 11.268 8.896 2.315 1.00 15.42 C ATOM 1432 CD1 TYR A 88 10.857 9.010 0.985 1.00 61.41 C ATOM 1433 CD2 TYR A 88 12.646 8.926 2.574 1.00 23.42 C ATOM 1434 CE1 TYR A 88 11.779 9.144 -0.038 1.00 4.25 C ATOM 1435 CE2 TYR A 88 13.567 9.059 1.553 1.00 73.44 C ATOM 1436 CZ TYR A 88 13.132 9.168 0.248 1.00 13.00 C ATOM 1437 OH TYR A 88 14.050 9.294 -0.777 1.00 45.00 O ATOM 0 H TYR A 88 8.237 7.671 2.255 1.00 24.23 H new ATOM 0 HA TYR A 88 10.587 6.625 3.674 1.00 13.13 H new ATOM 0 HB2 TYR A 88 9.402 9.400 3.254 1.00 52.32 H new ATOM 0 HB3 TYR A 88 10.712 9.109 4.381 1.00 52.32 H new ATOM 0 HD1 TYR A 88 9.803 8.993 0.751 1.00 61.41 H new ATOM 0 HD2 TYR A 88 12.994 8.843 3.593 1.00 23.42 H new ATOM 0 HE1 TYR A 88 11.442 9.230 -1.060 1.00 4.25 H new ATOM 0 HE2 TYR A 88 14.624 9.078 1.775 1.00 73.44 H new ATOM 0 HH TYR A 88 14.957 9.295 -0.406 1.00 45.00 H new ATOM 1447 N PHE A 89 9.501 6.354 5.949 1.00 52.44 N ATOM 1448 CA PHE A 89 9.086 6.394 7.364 1.00 73.24 C ATOM 1449 C PHE A 89 9.470 7.771 7.949 1.00 44.22 C ATOM 1450 O PHE A 89 10.577 8.239 7.710 1.00 23.35 O ATOM 1451 CB PHE A 89 9.760 5.246 8.154 1.00 32.01 C ATOM 1452 CG PHE A 89 9.412 5.200 9.646 1.00 61.12 C ATOM 1453 CD1 PHE A 89 8.140 4.821 10.074 1.00 71.52 C ATOM 1454 CD2 PHE A 89 10.361 5.528 10.618 1.00 75.14 C ATOM 1455 CE1 PHE A 89 7.832 4.771 11.420 1.00 55.12 C ATOM 1456 CE2 PHE A 89 10.050 5.480 11.964 1.00 44.34 C ATOM 1457 CZ PHE A 89 8.785 5.102 12.365 1.00 0.43 C ATOM 0 H PHE A 89 10.176 5.622 5.730 1.00 52.44 H new ATOM 0 HA PHE A 89 8.008 6.257 7.442 1.00 73.24 H new ATOM 0 HB2 PHE A 89 9.477 4.296 7.700 1.00 32.01 H new ATOM 0 HB3 PHE A 89 10.841 5.339 8.050 1.00 32.01 H new ATOM 0 HD1 PHE A 89 7.386 4.563 9.344 1.00 71.52 H new ATOM 0 HD2 PHE A 89 11.354 5.824 10.313 1.00 75.14 H new ATOM 0 HE1 PHE A 89 6.843 4.472 11.735 1.00 55.12 H new ATOM 0 HE2 PHE A 89 10.796 5.738 12.701 1.00 44.34 H new ATOM 0 HZ PHE A 89 8.540 5.065 13.416 1.00 0.43 H new ATOM 1467 N ALA A 90 8.545 8.428 8.655 1.00 53.02 N ATOM 1468 CA ALA A 90 8.806 9.754 9.244 1.00 15.24 C ATOM 1469 C ALA A 90 9.298 9.609 10.699 1.00 63.02 C ATOM 1470 O ALA A 90 8.800 8.759 11.447 1.00 54.04 O ATOM 1471 CB ALA A 90 7.549 10.637 9.158 1.00 13.22 C ATOM 0 H ALA A 90 7.608 8.067 8.835 1.00 53.02 H new ATOM 0 HA ALA A 90 9.595 10.244 8.674 1.00 15.24 H new ATOM 0 HB1 ALA A 90 7.759 11.612 9.597 1.00 13.22 H new ATOM 0 HB2 ALA A 90 7.264 10.763 8.114 1.00 13.22 H new ATOM 0 HB3 ALA A 90 6.733 10.162 9.702 1.00 13.22 H new ATOM 1477 N THR A 91 10.276 10.447 11.089 1.00 41.02 N ATOM 1478 CA THR A 91 10.870 10.408 12.446 1.00 13.40 C ATOM 1479 C THR A 91 9.867 10.874 13.540 1.00 51.14 C ATOM 1480 O THR A 91 9.471 10.083 14.402 1.00 33.02 O ATOM 1481 CB THR A 91 12.210 11.235 12.529 1.00 4.32 C ATOM 1482 OG1 THR A 91 12.671 11.306 13.892 1.00 11.33 O ATOM 1483 CG2 THR A 91 12.078 12.659 11.945 1.00 62.21 C ATOM 0 H THR A 91 10.676 11.164 10.483 1.00 41.02 H new ATOM 0 HA THR A 91 11.111 9.363 12.642 1.00 13.40 H new ATOM 0 HB THR A 91 12.940 10.705 11.917 1.00 4.32 H new ATOM 0 HG1 THR A 91 13.504 11.820 13.929 1.00 11.33 H new ATOM 0 HG21 THR A 91 13.033 13.178 12.031 1.00 62.21 H new ATOM 0 HG22 THR A 91 11.792 12.597 10.895 1.00 62.21 H new ATOM 0 HG23 THR A 91 11.315 13.209 12.496 1.00 62.21 H new ATOM 1491 N SER A 92 9.418 12.140 13.448 1.00 50.31 N ATOM 1492 CA SER A 92 8.602 12.811 14.503 1.00 22.23 C ATOM 1493 C SER A 92 8.247 14.255 14.090 1.00 75.41 C ATOM 1494 O SER A 92 7.107 14.703 14.247 1.00 33.31 O ATOM 1495 CB SER A 92 9.361 12.860 15.860 1.00 44.53 C ATOM 1496 OG SER A 92 10.575 13.596 15.760 1.00 53.14 O ATOM 0 H SER A 92 9.606 12.736 12.642 1.00 50.31 H new ATOM 0 HA SER A 92 7.691 12.224 14.618 1.00 22.23 H new ATOM 0 HB2 SER A 92 8.722 13.314 16.618 1.00 44.53 H new ATOM 0 HB3 SER A 92 9.578 11.845 16.192 1.00 44.53 H new ATOM 0 HG SER A 92 11.024 13.607 16.631 1.00 53.14 H new ATOM 1502 N LYS A 93 9.246 14.964 13.526 1.00 60.21 N ATOM 1503 CA LYS A 93 9.176 16.428 13.235 1.00 35.52 C ATOM 1504 C LYS A 93 8.336 16.786 11.973 1.00 64.15 C ATOM 1505 O LYS A 93 8.416 17.919 11.475 1.00 54.33 O ATOM 1506 CB LYS A 93 10.623 16.976 13.062 1.00 43.03 C ATOM 1507 CG LYS A 93 11.581 16.698 14.243 1.00 22.30 C ATOM 1508 CD LYS A 93 11.083 17.305 15.576 1.00 33.11 C ATOM 1509 CE LYS A 93 12.081 17.106 16.730 1.00 15.10 C ATOM 1510 NZ LYS A 93 13.380 17.790 16.474 1.00 21.05 N ATOM 0 H LYS A 93 10.134 14.542 13.254 1.00 60.21 H new ATOM 0 HA LYS A 93 8.667 16.891 14.081 1.00 35.52 H new ATOM 0 HB2 LYS A 93 11.052 16.543 12.158 1.00 43.03 H new ATOM 0 HB3 LYS A 93 10.569 18.053 12.905 1.00 43.03 H new ATOM 0 HG2 LYS A 93 11.701 15.621 14.362 1.00 22.30 H new ATOM 0 HG3 LYS A 93 12.565 17.104 14.010 1.00 22.30 H new ATOM 0 HD2 LYS A 93 10.900 18.371 15.439 1.00 33.11 H new ATOM 0 HD3 LYS A 93 10.129 16.850 15.844 1.00 33.11 H new ATOM 0 HE2 LYS A 93 11.647 17.488 17.654 1.00 15.10 H new ATOM 0 HE3 LYS A 93 12.256 16.040 16.877 1.00 15.10 H new ATOM 0 HZ1 LYS A 93 13.957 17.775 17.339 1.00 21.05 H new ATOM 0 HZ2 LYS A 93 13.887 17.298 15.711 1.00 21.05 H new ATOM 0 HZ3 LYS A 93 13.204 18.776 16.193 1.00 21.05 H new ATOM 1524 N GLY A 94 7.506 15.845 11.485 1.00 10.41 N ATOM 1525 CA GLY A 94 6.800 16.020 10.205 1.00 12.03 C ATOM 1526 C GLY A 94 7.724 15.897 8.988 1.00 12.13 C ATOM 1527 O GLY A 94 7.454 16.473 7.926 1.00 50.31 O ATOM 0 H GLY A 94 7.310 14.962 11.955 1.00 10.41 H new ATOM 0 HA2 GLY A 94 6.008 15.275 10.129 1.00 12.03 H new ATOM 0 HA3 GLY A 94 6.320 16.999 10.192 1.00 12.03 H new ATOM 1531 N GLU A 95 8.825 15.141 9.161 1.00 43.21 N ATOM 1532 CA GLU A 95 9.829 14.887 8.102 1.00 33.13 C ATOM 1533 C GLU A 95 10.330 13.426 8.170 1.00 40.40 C ATOM 1534 O GLU A 95 10.071 12.723 9.150 1.00 1.52 O ATOM 1535 CB GLU A 95 11.024 15.870 8.224 1.00 31.55 C ATOM 1536 CG GLU A 95 11.868 15.713 9.505 1.00 40.31 C ATOM 1537 CD GLU A 95 13.094 16.642 9.527 1.00 12.21 C ATOM 1538 OE1 GLU A 95 14.006 16.441 8.694 1.00 5.24 O ATOM 1539 OE2 GLU A 95 13.134 17.595 10.342 1.00 65.43 O ATOM 0 H GLU A 95 9.047 14.684 10.046 1.00 43.21 H new ATOM 0 HA GLU A 95 9.349 15.049 7.137 1.00 33.13 H new ATOM 0 HB2 GLU A 95 11.674 15.737 7.360 1.00 31.55 H new ATOM 0 HB3 GLU A 95 10.642 16.890 8.181 1.00 31.55 H new ATOM 0 HG2 GLU A 95 11.244 15.922 10.374 1.00 40.31 H new ATOM 0 HG3 GLU A 95 12.200 14.678 9.592 1.00 40.31 H new ATOM 1546 N LYS A 96 11.064 13.004 7.123 1.00 12.12 N ATOM 1547 CA LYS A 96 11.589 11.617 6.966 1.00 53.41 C ATOM 1548 C LYS A 96 12.517 11.162 8.132 1.00 32.15 C ATOM 1549 O LYS A 96 12.990 11.979 8.929 1.00 23.14 O ATOM 1550 CB LYS A 96 12.328 11.482 5.586 1.00 32.13 C ATOM 1551 CG LYS A 96 13.841 11.881 5.540 1.00 34.51 C ATOM 1552 CD LYS A 96 14.161 13.324 6.026 1.00 32.25 C ATOM 1553 CE LYS A 96 13.515 14.432 5.177 1.00 34.54 C ATOM 1554 NZ LYS A 96 13.881 15.790 5.670 1.00 25.41 N ATOM 0 H LYS A 96 11.317 13.617 6.348 1.00 12.12 H new ATOM 0 HA LYS A 96 10.727 10.950 6.996 1.00 53.41 H new ATOM 0 HB2 LYS A 96 12.242 10.446 5.257 1.00 32.13 H new ATOM 0 HB3 LYS A 96 11.796 12.093 4.857 1.00 32.13 H new ATOM 0 HG2 LYS A 96 14.405 11.176 6.151 1.00 34.51 H new ATOM 0 HG3 LYS A 96 14.198 11.772 4.516 1.00 34.51 H new ATOM 0 HD2 LYS A 96 13.826 13.431 7.058 1.00 32.25 H new ATOM 0 HD3 LYS A 96 15.242 13.464 6.025 1.00 32.25 H new ATOM 0 HE2 LYS A 96 13.830 14.325 4.139 1.00 34.54 H new ATOM 0 HE3 LYS A 96 12.431 14.319 5.195 1.00 34.54 H new ATOM 0 HZ1 LYS A 96 13.201 16.487 5.304 1.00 25.41 H new ATOM 0 HZ2 LYS A 96 13.860 15.799 6.710 1.00 25.41 H new ATOM 0 HZ3 LYS A 96 14.837 16.033 5.341 1.00 25.41 H new ATOM 1568 N ASP A 97 12.773 9.852 8.201 1.00 63.32 N ATOM 1569 CA ASP A 97 13.622 9.242 9.241 1.00 13.33 C ATOM 1570 C ASP A 97 15.096 9.147 8.769 1.00 11.52 C ATOM 1571 O ASP A 97 15.368 8.955 7.577 1.00 61.33 O ATOM 1572 CB ASP A 97 13.053 7.850 9.579 1.00 33.04 C ATOM 1573 CG ASP A 97 13.751 7.178 10.761 1.00 53.13 C ATOM 1574 OD1 ASP A 97 13.503 7.586 11.913 1.00 35.31 O ATOM 1575 OD2 ASP A 97 14.553 6.249 10.547 1.00 43.31 O ATOM 0 H ASP A 97 12.397 9.177 7.535 1.00 63.32 H new ATOM 0 HA ASP A 97 13.616 9.865 10.135 1.00 13.33 H new ATOM 0 HB2 ASP A 97 11.990 7.945 9.801 1.00 33.04 H new ATOM 0 HB3 ASP A 97 13.140 7.208 8.703 1.00 33.04 H new ATOM 1580 N THR A 98 16.045 9.283 9.716 1.00 61.10 N ATOM 1581 CA THR A 98 17.501 9.272 9.409 1.00 2.20 C ATOM 1582 C THR A 98 18.144 7.869 9.583 1.00 12.13 C ATOM 1583 O THR A 98 19.234 7.613 9.056 1.00 42.04 O ATOM 1584 CB THR A 98 18.259 10.329 10.282 1.00 15.22 C ATOM 1585 OG1 THR A 98 19.637 10.427 9.876 1.00 12.15 O ATOM 1586 CG2 THR A 98 18.198 10.016 11.787 1.00 13.43 C ATOM 0 H THR A 98 15.834 9.403 10.707 1.00 61.10 H new ATOM 0 HA THR A 98 17.598 9.538 8.356 1.00 2.20 H new ATOM 0 HB THR A 98 17.751 11.279 10.119 1.00 15.22 H new ATOM 0 HG1 THR A 98 20.095 11.093 10.431 1.00 12.15 H new ATOM 0 HG21 THR A 98 18.740 10.783 12.340 1.00 13.43 H new ATOM 0 HG22 THR A 98 17.158 10.000 12.113 1.00 13.43 H new ATOM 0 HG23 THR A 98 18.652 9.043 11.975 1.00 13.43 H new ATOM 1594 N SER A 99 17.456 6.954 10.302 1.00 14.43 N ATOM 1595 CA SER A 99 17.965 5.572 10.561 1.00 51.03 C ATOM 1596 C SER A 99 17.624 4.592 9.415 1.00 14.22 C ATOM 1597 O SER A 99 18.267 3.543 9.287 1.00 13.20 O ATOM 1598 CB SER A 99 17.411 5.027 11.902 1.00 72.20 C ATOM 1599 OG SER A 99 17.865 5.806 12.996 1.00 22.30 O ATOM 0 H SER A 99 16.543 7.141 10.718 1.00 14.43 H new ATOM 0 HA SER A 99 19.051 5.645 10.619 1.00 51.03 H new ATOM 0 HB2 SER A 99 16.321 5.030 11.877 1.00 72.20 H new ATOM 0 HB3 SER A 99 17.724 3.991 12.034 1.00 72.20 H new ATOM 0 HG SER A 99 17.500 5.443 13.830 1.00 22.30 H new ATOM 1605 N MET A 100 16.602 4.919 8.595 1.00 54.31 N ATOM 1606 CA MET A 100 16.221 4.101 7.408 1.00 75.35 C ATOM 1607 C MET A 100 15.962 4.998 6.158 1.00 62.41 C ATOM 1608 O MET A 100 15.556 6.159 6.304 1.00 2.21 O ATOM 1609 CB MET A 100 14.968 3.224 7.710 1.00 53.32 C ATOM 1610 CG MET A 100 13.674 3.994 8.025 1.00 42.51 C ATOM 1611 SD MET A 100 12.228 2.909 8.084 1.00 65.34 S ATOM 1612 CE MET A 100 12.094 2.373 6.370 1.00 41.31 C ATOM 0 H MET A 100 16.020 5.746 8.729 1.00 54.31 H new ATOM 0 HA MET A 100 17.060 3.442 7.186 1.00 75.35 H new ATOM 0 HB2 MET A 100 14.784 2.578 6.852 1.00 53.32 H new ATOM 0 HB3 MET A 100 15.197 2.575 8.555 1.00 53.32 H new ATOM 0 HG2 MET A 100 13.781 4.505 8.982 1.00 42.51 H new ATOM 0 HG3 MET A 100 13.518 4.763 7.269 1.00 42.51 H new ATOM 0 HE1 MET A 100 11.075 2.041 6.171 1.00 41.31 H new ATOM 0 HE2 MET A 100 12.341 3.204 5.709 1.00 41.31 H new ATOM 0 HE3 MET A 100 12.785 1.549 6.191 1.00 41.31 H new ATOM 1622 N PRO A 101 16.213 4.478 4.901 1.00 3.11 N ATOM 1623 CA PRO A 101 15.901 5.205 3.637 1.00 40.25 C ATOM 1624 C PRO A 101 14.440 4.973 3.125 1.00 42.32 C ATOM 1625 O PRO A 101 13.571 4.498 3.869 1.00 43.53 O ATOM 1626 CB PRO A 101 16.958 4.613 2.674 1.00 71.40 C ATOM 1627 CG PRO A 101 17.078 3.177 3.098 1.00 61.22 C ATOM 1628 CD PRO A 101 16.848 3.156 4.605 1.00 72.52 C ATOM 0 HA PRO A 101 15.945 6.289 3.745 1.00 40.25 H new ATOM 0 HB2 PRO A 101 16.641 4.696 1.634 1.00 71.40 H new ATOM 0 HB3 PRO A 101 17.911 5.135 2.759 1.00 71.40 H new ATOM 0 HG2 PRO A 101 16.344 2.557 2.584 1.00 61.22 H new ATOM 0 HG3 PRO A 101 18.062 2.779 2.849 1.00 61.22 H new ATOM 0 HD2 PRO A 101 16.200 2.329 4.897 1.00 72.52 H new ATOM 0 HD3 PRO A 101 17.785 3.034 5.149 1.00 72.52 H new ATOM 1636 N GLY A 102 14.195 5.330 1.843 1.00 40.15 N ATOM 1637 CA GLY A 102 12.869 5.211 1.210 1.00 12.52 C ATOM 1638 C GLY A 102 12.526 3.793 0.720 1.00 41.10 C ATOM 1639 O GLY A 102 13.296 3.170 -0.018 1.00 33.44 O ATOM 0 H GLY A 102 14.912 5.707 1.223 1.00 40.15 H new ATOM 0 HA2 GLY A 102 12.109 5.530 1.923 1.00 12.52 H new ATOM 0 HA3 GLY A 102 12.820 5.897 0.364 1.00 12.52 H new ATOM 1643 N MET A 103 11.357 3.309 1.152 1.00 34.02 N ATOM 1644 CA MET A 103 10.760 2.019 0.746 1.00 65.33 C ATOM 1645 C MET A 103 10.082 2.139 -0.664 1.00 31.25 C ATOM 1646 O MET A 103 8.934 2.568 -0.778 1.00 2.22 O ATOM 1647 CB MET A 103 9.724 1.616 1.845 1.00 61.42 C ATOM 1648 CG MET A 103 8.956 0.333 1.573 1.00 64.54 C ATOM 1649 SD MET A 103 10.028 -1.095 1.377 1.00 43.11 S ATOM 1650 CE MET A 103 8.871 -2.248 0.664 1.00 4.45 C ATOM 0 H MET A 103 10.775 3.818 1.818 1.00 34.02 H new ATOM 0 HA MET A 103 11.528 1.251 0.658 1.00 65.33 H new ATOM 0 HB2 MET A 103 10.248 1.512 2.795 1.00 61.42 H new ATOM 0 HB3 MET A 103 9.009 2.430 1.963 1.00 61.42 H new ATOM 0 HG2 MET A 103 8.262 0.150 2.393 1.00 64.54 H new ATOM 0 HG3 MET A 103 8.357 0.458 0.671 1.00 64.54 H new ATOM 0 HE1 MET A 103 9.394 -2.906 -0.030 1.00 4.45 H new ATOM 0 HE2 MET A 103 8.416 -2.843 1.456 1.00 4.45 H new ATOM 0 HE3 MET A 103 8.095 -1.701 0.129 1.00 4.45 H new ATOM 1660 N HIS A 104 10.801 1.761 -1.738 1.00 62.11 N ATOM 1661 CA HIS A 104 10.353 2.011 -3.137 1.00 13.40 C ATOM 1662 C HIS A 104 9.340 0.927 -3.638 1.00 25.41 C ATOM 1663 O HIS A 104 9.711 -0.204 -3.956 1.00 12.31 O ATOM 1664 CB HIS A 104 11.602 2.120 -4.053 1.00 54.51 C ATOM 1665 CG HIS A 104 11.325 2.230 -5.526 1.00 54.34 C ATOM 1666 ND1 HIS A 104 11.182 1.128 -6.337 1.00 43.23 N ATOM 1667 CD2 HIS A 104 11.203 3.302 -6.340 1.00 60.34 C ATOM 1668 CE1 HIS A 104 10.995 1.514 -7.574 1.00 2.23 C ATOM 1669 NE2 HIS A 104 11.000 2.823 -7.606 1.00 40.14 N ATOM 0 H HIS A 104 11.698 1.280 -1.672 1.00 62.11 H new ATOM 0 HA HIS A 104 9.806 2.953 -3.172 1.00 13.40 H new ATOM 0 HB2 HIS A 104 12.180 2.991 -3.745 1.00 54.51 H new ATOM 0 HB3 HIS A 104 12.230 1.245 -3.885 1.00 54.51 H new ATOM 0 HD1 HIS A 104 11.216 0.158 -6.023 1.00 43.23 H new ATOM 0 HD2 HIS A 104 11.256 4.340 -6.047 1.00 60.34 H new ATOM 0 HE1 HIS A 104 10.859 0.863 -8.425 1.00 2.23 H new ATOM 1678 N ILE A 105 8.054 1.306 -3.672 1.00 70.44 N ATOM 1679 CA ILE A 105 6.937 0.478 -4.200 1.00 33.23 C ATOM 1680 C ILE A 105 6.756 0.655 -5.738 1.00 31.45 C ATOM 1681 O ILE A 105 6.884 1.762 -6.269 1.00 71.40 O ATOM 1682 CB ILE A 105 5.573 0.837 -3.441 1.00 0.53 C ATOM 1683 CG1 ILE A 105 5.448 0.074 -2.083 1.00 33.30 C ATOM 1684 CG2 ILE A 105 4.310 0.585 -4.305 1.00 51.02 C ATOM 1685 CD1 ILE A 105 6.448 0.469 -1.023 1.00 20.43 C ATOM 0 H ILE A 105 7.745 2.215 -3.328 1.00 70.44 H new ATOM 0 HA ILE A 105 7.190 -0.566 -4.016 1.00 33.23 H new ATOM 0 HB ILE A 105 5.625 1.908 -3.243 1.00 0.53 H new ATOM 0 HG12 ILE A 105 4.444 0.232 -1.688 1.00 33.30 H new ATOM 0 HG13 ILE A 105 5.551 -0.994 -2.275 1.00 33.30 H new ATOM 0 HG21 ILE A 105 3.420 0.848 -3.733 1.00 51.02 H new ATOM 0 HG22 ILE A 105 4.357 1.198 -5.205 1.00 51.02 H new ATOM 0 HG23 ILE A 105 4.264 -0.468 -4.584 1.00 51.02 H new ATOM 0 HD11 ILE A 105 6.274 -0.119 -0.122 1.00 20.43 H new ATOM 0 HD12 ILE A 105 7.458 0.283 -1.388 1.00 20.43 H new ATOM 0 HD13 ILE A 105 6.335 1.528 -0.792 1.00 20.43 H new ATOM 1697 N THR A 106 6.468 -0.472 -6.430 1.00 14.23 N ATOM 1698 CA THR A 106 5.914 -0.489 -7.811 1.00 12.04 C ATOM 1699 C THR A 106 4.750 -1.507 -7.884 1.00 64.34 C ATOM 1700 O THR A 106 4.956 -2.706 -7.692 1.00 51.42 O ATOM 1701 CB THR A 106 6.986 -0.860 -8.907 1.00 2.34 C ATOM 1702 OG1 THR A 106 7.601 -2.131 -8.623 1.00 3.30 O ATOM 1703 CG2 THR A 106 8.073 0.207 -9.025 1.00 21.43 C ATOM 0 H THR A 106 6.614 -1.405 -6.045 1.00 14.23 H new ATOM 0 HA THR A 106 5.570 0.523 -8.025 1.00 12.04 H new ATOM 0 HB THR A 106 6.452 -0.920 -9.855 1.00 2.34 H new ATOM 0 HG1 THR A 106 7.387 -2.400 -7.705 1.00 3.30 H new ATOM 0 HG21 THR A 106 8.791 -0.088 -9.791 1.00 21.43 H new ATOM 0 HG22 THR A 106 7.620 1.159 -9.300 1.00 21.43 H new ATOM 0 HG23 THR A 106 8.585 0.312 -8.069 1.00 21.43 H new ATOM 1711 N LEU A 107 3.520 -1.025 -8.147 1.00 35.30 N ATOM 1712 CA LEU A 107 2.329 -1.894 -8.322 1.00 72.44 C ATOM 1713 C LEU A 107 1.948 -1.957 -9.819 1.00 72.34 C ATOM 1714 O LEU A 107 2.002 -0.939 -10.517 1.00 54.20 O ATOM 1715 CB LEU A 107 1.123 -1.371 -7.486 1.00 71.50 C ATOM 1716 CG LEU A 107 1.423 -0.917 -6.019 1.00 70.25 C ATOM 1717 CD1 LEU A 107 0.170 -0.310 -5.351 1.00 41.13 C ATOM 1718 CD2 LEU A 107 1.988 -2.069 -5.177 1.00 12.50 C ATOM 0 H LEU A 107 3.319 -0.030 -8.245 1.00 35.30 H new ATOM 0 HA LEU A 107 2.577 -2.894 -7.966 1.00 72.44 H new ATOM 0 HB2 LEU A 107 0.681 -0.529 -8.018 1.00 71.50 H new ATOM 0 HB3 LEU A 107 0.369 -2.157 -7.450 1.00 71.50 H new ATOM 0 HG LEU A 107 2.185 -0.140 -6.071 1.00 70.25 H new ATOM 0 HD11 LEU A 107 0.412 -0.005 -4.333 1.00 41.13 H new ATOM 0 HD12 LEU A 107 -0.162 0.558 -5.921 1.00 41.13 H new ATOM 0 HD13 LEU A 107 -0.626 -1.054 -5.327 1.00 41.13 H new ATOM 0 HD21 LEU A 107 2.184 -1.717 -4.164 1.00 12.50 H new ATOM 0 HD22 LEU A 107 1.265 -2.884 -5.144 1.00 12.50 H new ATOM 0 HD23 LEU A 107 2.916 -2.425 -5.624 1.00 12.50 H new ATOM 1730 N ASN A 108 1.535 -3.140 -10.290 1.00 11.52 N ATOM 1731 CA ASN A 108 1.228 -3.391 -11.717 1.00 34.14 C ATOM 1732 C ASN A 108 -0.104 -4.159 -11.852 1.00 25.13 C ATOM 1733 O ASN A 108 -0.464 -4.942 -10.976 1.00 14.20 O ATOM 1734 CB ASN A 108 2.398 -4.197 -12.345 1.00 43.00 C ATOM 1735 CG ASN A 108 2.248 -4.486 -13.843 1.00 2.53 C ATOM 1736 OD1 ASN A 108 1.676 -3.702 -14.598 1.00 10.33 O ATOM 1737 ND2 ASN A 108 2.757 -5.621 -14.289 1.00 22.21 N ATOM 0 H ASN A 108 1.402 -3.958 -9.695 1.00 11.52 H new ATOM 0 HA ASN A 108 1.119 -2.444 -12.245 1.00 34.14 H new ATOM 0 HB2 ASN A 108 3.326 -3.647 -12.186 1.00 43.00 H new ATOM 0 HB3 ASN A 108 2.494 -5.144 -11.814 1.00 43.00 H new ATOM 0 HD21 ASN A 108 2.679 -5.861 -15.277 1.00 22.21 H new ATOM 0 HD22 ASN A 108 3.227 -6.257 -13.645 1.00 22.21 H new ATOM 1744 N PHE A 109 -0.830 -3.918 -12.954 1.00 43.15 N ATOM 1745 CA PHE A 109 -2.118 -4.596 -13.238 1.00 50.45 C ATOM 1746 C PHE A 109 -1.919 -6.070 -13.681 1.00 31.00 C ATOM 1747 O PHE A 109 -0.870 -6.433 -14.225 1.00 13.41 O ATOM 1748 CB PHE A 109 -2.919 -3.816 -14.318 1.00 45.13 C ATOM 1749 CG PHE A 109 -2.318 -3.846 -15.734 1.00 2.31 C ATOM 1750 CD1 PHE A 109 -1.207 -3.065 -16.063 1.00 31.32 C ATOM 1751 CD2 PHE A 109 -2.868 -4.651 -16.738 1.00 1.14 C ATOM 1752 CE1 PHE A 109 -0.674 -3.083 -17.336 1.00 3.21 C ATOM 1753 CE2 PHE A 109 -2.330 -4.670 -18.014 1.00 35.01 C ATOM 1754 CZ PHE A 109 -1.233 -3.888 -18.312 1.00 63.10 C ATOM 0 H PHE A 109 -0.549 -3.253 -13.674 1.00 43.15 H new ATOM 0 HA PHE A 109 -2.686 -4.607 -12.308 1.00 50.45 H new ATOM 0 HB2 PHE A 109 -3.929 -4.223 -14.362 1.00 45.13 H new ATOM 0 HB3 PHE A 109 -3.007 -2.777 -14.001 1.00 45.13 H new ATOM 0 HD1 PHE A 109 -0.758 -2.437 -15.308 1.00 31.32 H new ATOM 0 HD2 PHE A 109 -3.726 -5.267 -16.514 1.00 1.14 H new ATOM 0 HE1 PHE A 109 0.182 -2.467 -17.571 1.00 3.21 H new ATOM 0 HE2 PHE A 109 -2.769 -5.297 -18.776 1.00 35.01 H new ATOM 0 HZ PHE A 109 -0.811 -3.904 -19.306 1.00 63.10 H new ATOM 1764 N GLU A 110 -2.953 -6.896 -13.444 1.00 63.10 N ATOM 1765 CA GLU A 110 -2.985 -8.327 -13.847 1.00 54.34 C ATOM 1766 C GLU A 110 -4.467 -8.842 -13.834 1.00 71.24 C ATOM 1767 O GLU A 110 -4.737 -10.035 -13.641 1.00 3.54 O ATOM 1768 CB GLU A 110 -2.056 -9.158 -12.889 1.00 64.24 C ATOM 1769 CG GLU A 110 -1.756 -10.611 -13.325 1.00 22.14 C ATOM 1770 CD GLU A 110 -1.120 -10.717 -14.722 1.00 22.32 C ATOM 1771 OE1 GLU A 110 0.112 -10.527 -14.843 1.00 64.24 O ATOM 1772 OE2 GLU A 110 -1.848 -10.976 -15.708 1.00 61.24 O ATOM 0 H GLU A 110 -3.801 -6.594 -12.964 1.00 63.10 H new ATOM 0 HA GLU A 110 -2.606 -8.447 -14.862 1.00 54.34 H new ATOM 0 HB2 GLU A 110 -1.109 -8.628 -12.785 1.00 64.24 H new ATOM 0 HB3 GLU A 110 -2.517 -9.184 -11.902 1.00 64.24 H new ATOM 0 HG2 GLU A 110 -1.088 -11.070 -12.596 1.00 22.14 H new ATOM 0 HG3 GLU A 110 -2.683 -11.184 -13.313 1.00 22.14 H new ATOM 1832 N GLY A 114 -13.070 -9.435 -14.625 1.00 34.42 N ATOM 1833 CA GLY A 114 -13.855 -8.546 -13.731 1.00 15.44 C ATOM 1834 C GLY A 114 -13.449 -8.641 -12.247 1.00 5.13 C ATOM 1835 O GLY A 114 -13.985 -7.929 -11.395 1.00 34.53 O ATOM 0 HA2 GLY A 114 -13.738 -7.515 -14.065 1.00 15.44 H new ATOM 0 HA3 GLY A 114 -14.912 -8.793 -13.825 1.00 15.44 H new ATOM 1839 N LYS A 115 -12.487 -9.535 -11.955 1.00 74.30 N ATOM 1840 CA LYS A 115 -11.941 -9.778 -10.612 1.00 45.13 C ATOM 1841 C LYS A 115 -10.504 -9.213 -10.564 1.00 3.42 C ATOM 1842 O LYS A 115 -9.571 -9.827 -11.114 1.00 52.51 O ATOM 1843 CB LYS A 115 -11.928 -11.306 -10.347 1.00 24.32 C ATOM 1844 CG LYS A 115 -13.318 -11.980 -10.354 1.00 4.32 C ATOM 1845 CD LYS A 115 -13.231 -13.528 -10.303 1.00 72.33 C ATOM 1846 CE LYS A 115 -12.549 -14.061 -9.028 1.00 54.20 C ATOM 1847 NZ LYS A 115 -13.322 -13.744 -7.806 1.00 73.12 N ATOM 0 H LYS A 115 -12.057 -10.124 -12.669 1.00 74.30 H new ATOM 0 HA LYS A 115 -12.549 -9.291 -9.849 1.00 45.13 H new ATOM 0 HB2 LYS A 115 -11.304 -11.785 -11.101 1.00 24.32 H new ATOM 0 HB3 LYS A 115 -11.457 -11.488 -9.381 1.00 24.32 H new ATOM 0 HG2 LYS A 115 -13.895 -11.624 -9.500 1.00 4.32 H new ATOM 0 HG3 LYS A 115 -13.859 -11.680 -11.251 1.00 4.32 H new ATOM 0 HD2 LYS A 115 -14.237 -13.943 -10.369 1.00 72.33 H new ATOM 0 HD3 LYS A 115 -12.682 -13.883 -11.175 1.00 72.33 H new ATOM 0 HE2 LYS A 115 -12.426 -15.141 -9.108 1.00 54.20 H new ATOM 0 HE3 LYS A 115 -11.550 -13.632 -8.946 1.00 54.20 H new ATOM 0 HZ1 LYS A 115 -12.771 -14.015 -6.967 1.00 73.12 H new ATOM 0 HZ2 LYS A 115 -13.520 -12.723 -7.775 1.00 73.12 H new ATOM 0 HZ3 LYS A 115 -14.219 -14.270 -7.816 1.00 73.12 H new ATOM 1861 N THR A 116 -10.335 -8.061 -9.900 1.00 11.42 N ATOM 1862 CA THR A 116 -9.078 -7.293 -9.941 1.00 22.41 C ATOM 1863 C THR A 116 -7.909 -8.054 -9.307 1.00 41.53 C ATOM 1864 O THR A 116 -7.998 -8.510 -8.177 1.00 33.50 O ATOM 1865 CB THR A 116 -9.218 -5.910 -9.239 1.00 23.14 C ATOM 1866 OG1 THR A 116 -10.244 -5.141 -9.880 1.00 45.51 O ATOM 1867 CG2 THR A 116 -7.894 -5.113 -9.266 1.00 32.51 C ATOM 0 H THR A 116 -11.060 -7.635 -9.322 1.00 11.42 H new ATOM 0 HA THR A 116 -8.865 -7.139 -10.999 1.00 22.41 H new ATOM 0 HB THR A 116 -9.481 -6.097 -8.198 1.00 23.14 H new ATOM 0 HG1 THR A 116 -11.114 -5.567 -9.731 1.00 45.51 H new ATOM 0 HG21 THR A 116 -8.036 -4.155 -8.766 1.00 32.51 H new ATOM 0 HG22 THR A 116 -7.118 -5.679 -8.752 1.00 32.51 H new ATOM 0 HG23 THR A 116 -7.593 -4.942 -10.300 1.00 32.51 H new ATOM 1875 N THR A 117 -6.803 -8.128 -10.046 1.00 63.43 N ATOM 1876 CA THR A 117 -5.558 -8.742 -9.597 1.00 10.42 C ATOM 1877 C THR A 117 -4.440 -7.737 -9.872 1.00 73.34 C ATOM 1878 O THR A 117 -4.250 -7.314 -11.009 1.00 23.33 O ATOM 1879 CB THR A 117 -5.273 -10.107 -10.317 1.00 61.11 C ATOM 1880 OG1 THR A 117 -6.387 -11.003 -10.136 1.00 20.31 O ATOM 1881 CG2 THR A 117 -3.990 -10.782 -9.794 1.00 41.00 C ATOM 0 H THR A 117 -6.748 -7.754 -10.993 1.00 63.43 H new ATOM 0 HA THR A 117 -5.625 -8.976 -8.535 1.00 10.42 H new ATOM 0 HB THR A 117 -5.133 -9.889 -11.376 1.00 61.11 H new ATOM 0 HG1 THR A 117 -6.201 -11.852 -10.590 1.00 20.31 H new ATOM 0 HG21 THR A 117 -3.833 -11.723 -10.321 1.00 41.00 H new ATOM 0 HG22 THR A 117 -3.138 -10.124 -9.964 1.00 41.00 H new ATOM 0 HG23 THR A 117 -4.091 -10.976 -8.726 1.00 41.00 H new ATOM 1889 N VAL A 118 -3.765 -7.290 -8.816 1.00 13.12 N ATOM 1890 CA VAL A 118 -2.658 -6.329 -8.918 1.00 12.51 C ATOM 1891 C VAL A 118 -1.386 -6.969 -8.338 1.00 43.15 C ATOM 1892 O VAL A 118 -1.353 -7.375 -7.175 1.00 50.53 O ATOM 1893 CB VAL A 118 -3.025 -4.967 -8.199 1.00 50.23 C ATOM 1894 CG1 VAL A 118 -1.790 -4.040 -8.005 1.00 12.52 C ATOM 1895 CG2 VAL A 118 -4.134 -4.214 -8.981 1.00 12.22 C ATOM 0 H VAL A 118 -3.967 -7.582 -7.860 1.00 13.12 H new ATOM 0 HA VAL A 118 -2.475 -6.085 -9.964 1.00 12.51 H new ATOM 0 HB VAL A 118 -3.395 -5.229 -7.208 1.00 50.23 H new ATOM 0 HG11 VAL A 118 -2.100 -3.121 -7.508 1.00 12.52 H new ATOM 0 HG12 VAL A 118 -1.045 -4.550 -7.394 1.00 12.52 H new ATOM 0 HG13 VAL A 118 -1.360 -3.799 -8.977 1.00 12.52 H new ATOM 0 HG21 VAL A 118 -4.371 -3.281 -8.469 1.00 12.22 H new ATOM 0 HG22 VAL A 118 -3.784 -3.996 -9.990 1.00 12.22 H new ATOM 0 HG23 VAL A 118 -5.028 -4.836 -9.034 1.00 12.22 H new ATOM 1905 N THR A 119 -0.364 -7.099 -9.182 1.00 2.41 N ATOM 1906 CA THR A 119 0.938 -7.660 -8.800 1.00 71.14 C ATOM 1907 C THR A 119 1.790 -6.574 -8.109 1.00 61.51 C ATOM 1908 O THR A 119 2.300 -5.658 -8.765 1.00 72.11 O ATOM 1909 CB THR A 119 1.675 -8.223 -10.058 1.00 64.52 C ATOM 1910 OG1 THR A 119 0.831 -9.178 -10.724 1.00 55.23 O ATOM 1911 CG2 THR A 119 3.014 -8.890 -9.707 1.00 45.23 C ATOM 0 H THR A 119 -0.413 -6.816 -10.161 1.00 2.41 H new ATOM 0 HA THR A 119 0.783 -8.482 -8.101 1.00 71.14 H new ATOM 0 HB THR A 119 1.889 -7.377 -10.711 1.00 64.52 H new ATOM 0 HG1 THR A 119 1.294 -9.529 -11.513 1.00 55.23 H new ATOM 0 HG21 THR A 119 3.484 -9.264 -10.617 1.00 45.23 H new ATOM 0 HG22 THR A 119 3.671 -8.161 -9.233 1.00 45.23 H new ATOM 0 HG23 THR A 119 2.839 -9.720 -9.022 1.00 45.23 H new ATOM 1919 N SER A 120 1.903 -6.664 -6.773 1.00 64.15 N ATOM 1920 CA SER A 120 2.630 -5.669 -5.961 1.00 21.15 C ATOM 1921 C SER A 120 4.111 -6.083 -5.795 1.00 35.24 C ATOM 1922 O SER A 120 4.415 -7.061 -5.122 1.00 65.12 O ATOM 1923 CB SER A 120 1.940 -5.500 -4.573 1.00 60.04 C ATOM 1924 OG SER A 120 2.182 -6.580 -3.700 1.00 41.53 O ATOM 0 H SER A 120 1.496 -7.423 -6.227 1.00 64.15 H new ATOM 0 HA SER A 120 2.604 -4.709 -6.476 1.00 21.15 H new ATOM 0 HB2 SER A 120 2.292 -4.579 -4.108 1.00 60.04 H new ATOM 0 HB3 SER A 120 0.865 -5.392 -4.719 1.00 60.04 H new ATOM 0 HG SER A 120 3.100 -6.900 -3.822 1.00 41.53 H new ATOM 1930 N THR A 121 5.030 -5.342 -6.426 1.00 64.23 N ATOM 1931 CA THR A 121 6.489 -5.590 -6.318 1.00 11.33 C ATOM 1932 C THR A 121 7.151 -4.442 -5.526 1.00 45.14 C ATOM 1933 O THR A 121 7.289 -3.325 -6.023 1.00 40.14 O ATOM 1934 CB THR A 121 7.143 -5.731 -7.732 1.00 24.21 C ATOM 1935 OG1 THR A 121 6.443 -6.727 -8.498 1.00 4.54 O ATOM 1936 CG2 THR A 121 8.631 -6.118 -7.653 1.00 30.33 C ATOM 0 H THR A 121 4.793 -4.553 -7.027 1.00 64.23 H new ATOM 0 HA THR A 121 6.645 -6.529 -5.787 1.00 11.33 H new ATOM 0 HB THR A 121 7.072 -4.756 -8.215 1.00 24.21 H new ATOM 0 HG1 THR A 121 6.856 -6.809 -9.383 1.00 4.54 H new ATOM 0 HG21 THR A 121 9.039 -6.203 -8.660 1.00 30.33 H new ATOM 0 HG22 THR A 121 9.178 -5.351 -7.104 1.00 30.33 H new ATOM 0 HG23 THR A 121 8.732 -7.074 -7.139 1.00 30.33 H new ATOM 1944 N SER A 122 7.542 -4.731 -4.286 1.00 25.54 N ATOM 1945 CA SER A 122 7.998 -3.704 -3.320 1.00 73.31 C ATOM 1946 C SER A 122 9.430 -3.989 -2.832 1.00 73.11 C ATOM 1947 O SER A 122 9.675 -5.044 -2.237 1.00 32.24 O ATOM 1948 CB SER A 122 7.029 -3.689 -2.121 1.00 13.41 C ATOM 1949 OG SER A 122 5.713 -3.321 -2.516 1.00 63.50 O ATOM 0 H SER A 122 7.556 -5.680 -3.912 1.00 25.54 H new ATOM 0 HA SER A 122 8.005 -2.733 -3.815 1.00 73.31 H new ATOM 0 HB2 SER A 122 7.008 -4.675 -1.657 1.00 13.41 H new ATOM 0 HB3 SER A 122 7.392 -2.990 -1.368 1.00 13.41 H new ATOM 0 HG SER A 122 5.124 -3.323 -1.733 1.00 63.50 H new ATOM 1955 N THR A 123 10.371 -3.038 -3.046 1.00 12.22 N ATOM 1956 CA THR A 123 11.788 -3.232 -2.637 1.00 53.23 C ATOM 1957 C THR A 123 12.080 -2.647 -1.237 1.00 60.23 C ATOM 1958 O THR A 123 11.935 -1.442 -0.983 1.00 1.44 O ATOM 1959 CB THR A 123 12.842 -2.690 -3.676 1.00 24.31 C ATOM 1960 OG1 THR A 123 14.175 -3.022 -3.250 1.00 32.45 O ATOM 1961 CG2 THR A 123 12.774 -1.187 -3.917 1.00 12.34 C ATOM 0 H THR A 123 10.181 -2.141 -3.493 1.00 12.22 H new ATOM 0 HA THR A 123 11.908 -4.315 -2.601 1.00 53.23 H new ATOM 0 HB THR A 123 12.590 -3.177 -4.618 1.00 24.31 H new ATOM 0 HG1 THR A 123 14.821 -2.682 -3.903 1.00 32.45 H new ATOM 0 HG21 THR A 123 13.533 -0.900 -4.645 1.00 12.34 H new ATOM 0 HG22 THR A 123 11.788 -0.924 -4.299 1.00 12.34 H new ATOM 0 HG23 THR A 123 12.952 -0.660 -2.980 1.00 12.34 H new ATOM 1969 N PHE A 124 12.468 -3.551 -0.336 1.00 64.23 N ATOM 1970 CA PHE A 124 13.028 -3.236 0.984 1.00 5.52 C ATOM 1971 C PHE A 124 14.514 -2.768 0.836 1.00 24.02 C ATOM 1972 O PHE A 124 15.119 -2.977 -0.226 1.00 44.20 O ATOM 1973 CB PHE A 124 12.894 -4.502 1.892 1.00 4.52 C ATOM 1974 CG PHE A 124 11.486 -4.738 2.459 1.00 4.52 C ATOM 1975 CD1 PHE A 124 10.464 -5.257 1.661 1.00 45.52 C ATOM 1976 CD2 PHE A 124 11.188 -4.447 3.794 1.00 52.51 C ATOM 1977 CE1 PHE A 124 9.200 -5.475 2.175 1.00 21.54 C ATOM 1978 CE2 PHE A 124 9.920 -4.666 4.305 1.00 44.12 C ATOM 1979 CZ PHE A 124 8.927 -5.181 3.495 1.00 13.54 C ATOM 0 H PHE A 124 12.400 -4.554 -0.508 1.00 64.23 H new ATOM 0 HA PHE A 124 12.483 -2.416 1.451 1.00 5.52 H new ATOM 0 HB2 PHE A 124 13.191 -5.379 1.316 1.00 4.52 H new ATOM 0 HB3 PHE A 124 13.595 -4.413 2.722 1.00 4.52 H new ATOM 0 HD1 PHE A 124 10.665 -5.492 0.626 1.00 45.52 H new ATOM 0 HD2 PHE A 124 11.958 -4.046 4.436 1.00 52.51 H new ATOM 0 HE1 PHE A 124 8.423 -5.877 1.541 1.00 21.54 H new ATOM 0 HE2 PHE A 124 9.707 -4.434 5.338 1.00 44.12 H new ATOM 0 HZ PHE A 124 7.938 -5.353 3.894 1.00 13.54 H new ATOM 1989 N PRO A 125 15.130 -2.139 1.898 1.00 22.42 N ATOM 1990 CA PRO A 125 16.496 -1.542 1.814 1.00 11.34 C ATOM 1991 C PRO A 125 17.649 -2.595 1.833 1.00 5.52 C ATOM 1992 O PRO A 125 18.371 -2.732 2.836 1.00 13.31 O ATOM 1993 CB PRO A 125 16.531 -0.618 3.061 1.00 54.21 C ATOM 1994 CG PRO A 125 15.661 -1.317 4.069 1.00 11.35 C ATOM 1995 CD PRO A 125 14.557 -1.983 3.267 1.00 2.24 C ATOM 0 HA PRO A 125 16.663 -1.023 0.870 1.00 11.34 H new ATOM 0 HB2 PRO A 125 17.548 -0.491 3.433 1.00 54.21 H new ATOM 0 HB3 PRO A 125 16.150 0.377 2.829 1.00 54.21 H new ATOM 0 HG2 PRO A 125 16.232 -2.053 4.636 1.00 11.35 H new ATOM 0 HG3 PRO A 125 15.250 -0.609 4.789 1.00 11.35 H new ATOM 0 HD2 PRO A 125 14.283 -2.947 3.694 1.00 2.24 H new ATOM 0 HD3 PRO A 125 13.654 -1.373 3.252 1.00 2.24 H new ATOM 2003 N THR A 126 17.772 -3.339 0.702 1.00 45.22 N ATOM 2004 CA THR A 126 18.850 -4.344 0.409 1.00 1.04 C ATOM 2005 C THR A 126 19.080 -5.370 1.559 1.00 72.54 C ATOM 2006 O THR A 126 18.232 -5.494 2.453 1.00 14.23 O ATOM 2007 CB THR A 126 20.199 -3.646 -0.058 1.00 34.51 C ATOM 2008 OG1 THR A 126 21.076 -4.614 -0.662 1.00 3.14 O ATOM 2009 CG2 THR A 126 20.962 -2.933 1.073 1.00 15.14 C ATOM 0 H THR A 126 17.103 -3.259 -0.064 1.00 45.22 H new ATOM 0 HA THR A 126 18.483 -4.935 -0.431 1.00 1.04 H new ATOM 0 HB THR A 126 19.897 -2.882 -0.775 1.00 34.51 H new ATOM 0 HG1 THR A 126 21.903 -4.173 -0.948 1.00 3.14 H new ATOM 0 HG21 THR A 126 21.870 -2.483 0.672 1.00 15.14 H new ATOM 0 HG22 THR A 126 20.331 -2.155 1.504 1.00 15.14 H new ATOM 0 HG23 THR A 126 21.226 -3.655 1.846 1.00 15.14 H new ATOM 2017 N GLU A 127 20.172 -6.176 1.473 1.00 33.00 N ATOM 2018 CA GLU A 127 20.640 -7.054 2.589 1.00 61.34 C ATOM 2019 C GLU A 127 19.593 -8.170 2.934 1.00 72.21 C ATOM 2020 O GLU A 127 19.574 -8.730 4.037 1.00 12.02 O ATOM 2021 CB GLU A 127 20.987 -6.144 3.814 1.00 14.44 C ATOM 2022 CG GLU A 127 21.729 -6.823 4.981 1.00 70.35 C ATOM 2023 CD GLU A 127 21.998 -5.871 6.160 1.00 10.20 C ATOM 2024 OE1 GLU A 127 21.020 -5.329 6.729 1.00 53.13 O ATOM 2025 OE2 GLU A 127 23.175 -5.646 6.519 1.00 34.21 O ATOM 0 H GLU A 127 20.752 -6.238 0.636 1.00 33.00 H new ATOM 0 HA GLU A 127 21.537 -7.594 2.286 1.00 61.34 H new ATOM 0 HB2 GLU A 127 21.595 -5.312 3.460 1.00 14.44 H new ATOM 0 HB3 GLU A 127 20.059 -5.720 4.199 1.00 14.44 H new ATOM 0 HG2 GLU A 127 21.142 -7.671 5.333 1.00 70.35 H new ATOM 0 HG3 GLU A 127 22.677 -7.220 4.619 1.00 70.35 H new ATOM 2032 N SER A 128 18.736 -8.493 1.934 1.00 70.43 N ATOM 2033 CA SER A 128 17.624 -9.477 2.055 1.00 24.44 C ATOM 2034 C SER A 128 16.590 -9.087 3.141 1.00 73.23 C ATOM 2035 O SER A 128 15.867 -9.945 3.638 1.00 65.14 O ATOM 2036 CB SER A 128 18.168 -10.917 2.286 1.00 11.00 C ATOM 2037 OG SER A 128 18.929 -11.377 1.181 1.00 73.32 O ATOM 0 H SER A 128 18.796 -8.073 1.006 1.00 70.43 H new ATOM 0 HA SER A 128 17.093 -9.461 1.103 1.00 24.44 H new ATOM 0 HB2 SER A 128 18.786 -10.932 3.184 1.00 11.00 H new ATOM 0 HB3 SER A 128 17.334 -11.597 2.461 1.00 11.00 H new ATOM 0 HG SER A 128 19.255 -12.283 1.363 1.00 73.32 H new ATOM 2043 N ALA A 129 16.490 -7.774 3.450 1.00 15.21 N ATOM 2044 CA ALA A 129 15.518 -7.223 4.446 1.00 1.05 C ATOM 2045 C ALA A 129 14.060 -7.663 4.152 1.00 63.34 C ATOM 2046 O ALA A 129 13.248 -7.859 5.062 1.00 62.41 O ATOM 2047 CB ALA A 129 15.622 -5.686 4.464 1.00 14.44 C ATOM 0 H ALA A 129 17.077 -7.059 3.020 1.00 15.21 H new ATOM 0 HA ALA A 129 15.777 -7.625 5.426 1.00 1.05 H new ATOM 0 HB1 ALA A 129 14.915 -5.282 5.189 1.00 14.44 H new ATOM 0 HB2 ALA A 129 16.634 -5.393 4.742 1.00 14.44 H new ATOM 0 HB3 ALA A 129 15.390 -5.294 3.474 1.00 14.44 H new ATOM 2053 N ALA A 130 13.770 -7.814 2.857 1.00 53.04 N ATOM 2054 CA ALA A 130 12.482 -8.320 2.349 1.00 51.12 C ATOM 2055 C ALA A 130 12.294 -9.828 2.611 1.00 0.42 C ATOM 2056 O ALA A 130 11.213 -10.278 3.002 1.00 22.04 O ATOM 2057 CB ALA A 130 12.417 -8.027 0.857 1.00 60.42 C ATOM 0 H ALA A 130 14.432 -7.585 2.115 1.00 53.04 H new ATOM 0 HA ALA A 130 11.674 -7.816 2.880 1.00 51.12 H new ATOM 0 HB1 ALA A 130 11.472 -8.392 0.455 1.00 60.42 H new ATOM 0 HB2 ALA A 130 12.489 -6.952 0.694 1.00 60.42 H new ATOM 0 HB3 ALA A 130 13.243 -8.527 0.352 1.00 60.42 H new ATOM 2063 N GLN A 131 13.367 -10.599 2.372 1.00 10.43 N ATOM 2064 CA GLN A 131 13.383 -12.056 2.598 1.00 52.11 C ATOM 2065 C GLN A 131 13.128 -12.398 4.081 1.00 72.43 C ATOM 2066 O GLN A 131 12.249 -13.211 4.383 1.00 42.45 O ATOM 2067 CB GLN A 131 14.732 -12.655 2.133 1.00 40.15 C ATOM 2068 CG GLN A 131 14.909 -14.161 2.409 1.00 64.45 C ATOM 2069 CD GLN A 131 13.877 -15.037 1.688 1.00 1.10 C ATOM 2070 OE1 GLN A 131 14.058 -15.407 0.532 1.00 60.53 O ATOM 2071 NE2 GLN A 131 12.803 -15.403 2.374 1.00 4.21 N ATOM 0 H GLN A 131 14.249 -10.231 2.016 1.00 10.43 H new ATOM 0 HA GLN A 131 12.577 -12.496 2.010 1.00 52.11 H new ATOM 0 HB2 GLN A 131 14.838 -12.483 1.062 1.00 40.15 H new ATOM 0 HB3 GLN A 131 15.541 -12.114 2.624 1.00 40.15 H new ATOM 0 HG2 GLN A 131 15.910 -14.464 2.102 1.00 64.45 H new ATOM 0 HG3 GLN A 131 14.838 -14.337 3.482 1.00 64.45 H new ATOM 0 HE21 GLN A 131 12.677 -15.081 3.334 1.00 4.21 H new ATOM 0 HE22 GLN A 131 12.103 -16.006 1.942 1.00 4.21 H new ATOM 2080 N GLN A 132 13.893 -11.757 4.991 1.00 43.02 N ATOM 2081 CA GLN A 132 13.759 -11.983 6.454 1.00 42.41 C ATOM 2082 C GLN A 132 12.305 -11.739 6.960 1.00 41.12 C ATOM 2083 O GLN A 132 11.859 -12.379 7.919 1.00 40.10 O ATOM 2084 CB GLN A 132 14.758 -11.096 7.270 1.00 55.00 C ATOM 2085 CG GLN A 132 16.216 -11.616 7.344 1.00 4.15 C ATOM 2086 CD GLN A 132 17.026 -11.454 6.059 1.00 61.23 C ATOM 2087 OE1 GLN A 132 17.029 -12.318 5.189 1.00 2.45 O ATOM 2088 NE2 GLN A 132 17.722 -10.338 5.931 1.00 33.45 N ATOM 0 H GLN A 132 14.612 -11.077 4.742 1.00 43.02 H new ATOM 0 HA GLN A 132 14.004 -13.032 6.620 1.00 42.41 H new ATOM 0 HB2 GLN A 132 14.770 -10.098 6.832 1.00 55.00 H new ATOM 0 HB3 GLN A 132 14.377 -10.993 8.286 1.00 55.00 H new ATOM 0 HG2 GLN A 132 16.732 -11.093 8.149 1.00 4.15 H new ATOM 0 HG3 GLN A 132 16.196 -12.672 7.612 1.00 4.15 H new ATOM 0 HE21 GLN A 132 17.701 -9.636 6.671 1.00 33.45 H new ATOM 0 HE22 GLN A 132 18.280 -10.178 5.092 1.00 33.45 H new ATOM 2097 N ALA A 133 11.587 -10.805 6.301 1.00 53.53 N ATOM 2098 CA ALA A 133 10.169 -10.507 6.605 1.00 24.43 C ATOM 2099 C ALA A 133 9.258 -11.729 6.326 1.00 12.22 C ATOM 2100 O ALA A 133 8.339 -12.030 7.094 1.00 55.25 O ATOM 2101 CB ALA A 133 9.710 -9.283 5.791 1.00 11.44 C ATOM 0 H ALA A 133 11.971 -10.237 5.546 1.00 53.53 H new ATOM 0 HA ALA A 133 10.086 -10.280 7.668 1.00 24.43 H new ATOM 0 HB1 ALA A 133 8.666 -9.066 6.017 1.00 11.44 H new ATOM 0 HB2 ALA A 133 10.324 -8.421 6.052 1.00 11.44 H new ATOM 0 HB3 ALA A 133 9.815 -9.494 4.727 1.00 11.44 H new ATOM 2107 N ILE A 134 9.539 -12.425 5.211 1.00 71.22 N ATOM 2108 CA ILE A 134 8.805 -13.646 4.789 1.00 42.21 C ATOM 2109 C ILE A 134 9.047 -14.806 5.786 1.00 42.03 C ATOM 2110 O ILE A 134 8.107 -15.513 6.169 1.00 71.32 O ATOM 2111 CB ILE A 134 9.248 -14.084 3.344 1.00 10.43 C ATOM 2112 CG1 ILE A 134 9.072 -12.901 2.341 1.00 54.23 C ATOM 2113 CG2 ILE A 134 8.492 -15.354 2.858 1.00 72.34 C ATOM 2114 CD1 ILE A 134 7.638 -12.497 2.053 1.00 53.32 C ATOM 0 H ILE A 134 10.285 -12.160 4.568 1.00 71.22 H new ATOM 0 HA ILE A 134 7.741 -13.411 4.778 1.00 42.21 H new ATOM 0 HB ILE A 134 10.305 -14.348 3.388 1.00 10.43 H new ATOM 0 HG12 ILE A 134 9.604 -12.034 2.732 1.00 54.23 H new ATOM 0 HG13 ILE A 134 9.551 -13.171 1.400 1.00 54.23 H new ATOM 0 HG21 ILE A 134 8.831 -15.618 1.856 1.00 72.34 H new ATOM 0 HG22 ILE A 134 8.694 -16.181 3.539 1.00 72.34 H new ATOM 0 HG23 ILE A 134 7.421 -15.154 2.838 1.00 72.34 H new ATOM 0 HD11 ILE A 134 7.629 -11.668 1.346 1.00 53.32 H new ATOM 0 HD12 ILE A 134 7.100 -13.344 1.627 1.00 53.32 H new ATOM 0 HD13 ILE A 134 7.154 -12.189 2.980 1.00 53.32 H new ATOM 2126 N ASP A 135 10.317 -14.961 6.206 1.00 34.22 N ATOM 2127 CA ASP A 135 10.724 -15.961 7.218 1.00 45.12 C ATOM 2128 C ASP A 135 10.080 -15.669 8.605 1.00 63.44 C ATOM 2129 O ASP A 135 9.848 -16.588 9.399 1.00 65.33 O ATOM 2130 CB ASP A 135 12.268 -15.998 7.323 1.00 70.25 C ATOM 2131 CG ASP A 135 12.945 -16.473 6.022 1.00 23.43 C ATOM 2132 OD1 ASP A 135 12.899 -17.689 5.728 1.00 23.25 O ATOM 2133 OD2 ASP A 135 13.511 -15.643 5.280 1.00 74.42 O ATOM 0 H ASP A 135 11.091 -14.398 5.855 1.00 34.22 H new ATOM 0 HA ASP A 135 10.364 -16.939 6.898 1.00 45.12 H new ATOM 0 HB2 ASP A 135 12.634 -15.003 7.575 1.00 70.25 H new ATOM 0 HB3 ASP A 135 12.556 -16.660 8.140 1.00 70.25 H new ATOM 2138 N MET A 136 9.798 -14.376 8.877 1.00 11.51 N ATOM 2139 CA MET A 136 9.061 -13.932 10.090 1.00 65.20 C ATOM 2140 C MET A 136 7.546 -14.270 9.969 1.00 74.41 C ATOM 2141 O MET A 136 6.883 -14.577 10.969 1.00 73.41 O ATOM 2142 CB MET A 136 9.294 -12.401 10.290 1.00 63.01 C ATOM 2143 CG MET A 136 8.696 -11.785 11.571 1.00 72.30 C ATOM 2144 SD MET A 136 6.898 -11.585 11.529 1.00 10.43 S ATOM 2145 CE MET A 136 6.686 -10.366 10.227 1.00 31.32 C ATOM 0 H MET A 136 10.073 -13.608 8.265 1.00 11.51 H new ATOM 0 HA MET A 136 9.436 -14.463 10.965 1.00 65.20 H new ATOM 0 HB2 MET A 136 10.368 -12.214 10.289 1.00 63.01 H new ATOM 0 HB3 MET A 136 8.878 -11.876 9.430 1.00 63.01 H new ATOM 0 HG2 MET A 136 8.960 -12.414 12.421 1.00 72.30 H new ATOM 0 HG3 MET A 136 9.155 -10.811 11.741 1.00 72.30 H new ATOM 0 HE1 MET A 136 5.696 -9.917 10.306 1.00 31.32 H new ATOM 0 HE2 MET A 136 7.445 -9.590 10.328 1.00 31.32 H new ATOM 0 HE3 MET A 136 6.788 -10.850 9.256 1.00 31.32 H new ATOM 2155 N GLY A 137 7.033 -14.262 8.725 1.00 55.22 N ATOM 2156 CA GLY A 137 5.611 -14.536 8.446 1.00 11.11 C ATOM 2157 C GLY A 137 4.786 -13.268 8.182 1.00 64.12 C ATOM 2158 O GLY A 137 3.643 -13.156 8.639 1.00 70.11 O ATOM 0 H GLY A 137 7.587 -14.067 7.891 1.00 55.22 H new ATOM 0 HA2 GLY A 137 5.539 -15.194 7.580 1.00 11.11 H new ATOM 0 HA3 GLY A 137 5.179 -15.072 9.291 1.00 11.11 H new ATOM 2162 N VAL A 138 5.362 -12.317 7.414 1.00 75.30 N ATOM 2163 CA VAL A 138 4.675 -11.046 7.040 1.00 70.13 C ATOM 2164 C VAL A 138 3.503 -11.286 6.044 1.00 11.10 C ATOM 2165 O VAL A 138 2.600 -10.455 5.939 1.00 72.55 O ATOM 2166 CB VAL A 138 5.701 -10.006 6.436 1.00 22.12 C ATOM 2167 CG1 VAL A 138 6.176 -10.423 5.017 1.00 3.41 C ATOM 2168 CG2 VAL A 138 5.140 -8.559 6.446 1.00 51.44 C ATOM 0 H VAL A 138 6.306 -12.400 7.036 1.00 75.30 H new ATOM 0 HA VAL A 138 4.252 -10.633 7.956 1.00 70.13 H new ATOM 0 HB VAL A 138 6.575 -10.013 7.087 1.00 22.12 H new ATOM 0 HG11 VAL A 138 6.880 -9.683 4.637 1.00 3.41 H new ATOM 0 HG12 VAL A 138 6.665 -11.396 5.068 1.00 3.41 H new ATOM 0 HG13 VAL A 138 5.317 -10.484 4.349 1.00 3.41 H new ATOM 0 HG21 VAL A 138 5.879 -7.879 6.022 1.00 51.44 H new ATOM 0 HG22 VAL A 138 4.227 -8.519 5.852 1.00 51.44 H new ATOM 0 HG23 VAL A 138 4.919 -8.261 7.471 1.00 51.44 H new ATOM 2178 N GLU A 139 3.524 -12.453 5.350 1.00 22.13 N ATOM 2179 CA GLU A 139 2.523 -12.828 4.318 1.00 45.44 C ATOM 2180 C GLU A 139 1.081 -12.739 4.883 1.00 33.33 C ATOM 2181 O GLU A 139 0.251 -12.019 4.336 1.00 44.40 O ATOM 2182 CB GLU A 139 2.842 -14.270 3.791 1.00 52.42 C ATOM 2183 CG GLU A 139 2.103 -14.729 2.498 1.00 21.42 C ATOM 2184 CD GLU A 139 0.576 -14.953 2.639 1.00 3.20 C ATOM 2185 OE1 GLU A 139 0.168 -15.820 3.447 1.00 2.32 O ATOM 2186 OE2 GLU A 139 -0.213 -14.255 1.966 1.00 42.43 O ATOM 0 H GLU A 139 4.241 -13.165 5.492 1.00 22.13 H new ATOM 0 HA GLU A 139 2.583 -12.126 3.486 1.00 45.44 H new ATOM 0 HB2 GLU A 139 3.915 -14.335 3.609 1.00 52.42 H new ATOM 0 HB3 GLU A 139 2.609 -14.980 4.585 1.00 52.42 H new ATOM 0 HG2 GLU A 139 2.272 -13.983 1.721 1.00 21.42 H new ATOM 0 HG3 GLU A 139 2.557 -15.658 2.152 1.00 21.42 H new ATOM 2193 N THR A 140 0.832 -13.430 6.016 1.00 14.42 N ATOM 2194 CA THR A 140 -0.516 -13.502 6.644 1.00 72.55 C ATOM 2195 C THR A 140 -0.975 -12.135 7.214 1.00 21.33 C ATOM 2196 O THR A 140 -2.173 -11.825 7.212 1.00 15.43 O ATOM 2197 CB THR A 140 -0.580 -14.602 7.762 1.00 45.31 C ATOM 2198 OG1 THR A 140 -1.914 -14.690 8.300 1.00 43.10 O ATOM 2199 CG2 THR A 140 0.413 -14.348 8.913 1.00 35.44 C ATOM 0 H THR A 140 1.549 -13.951 6.521 1.00 14.42 H new ATOM 0 HA THR A 140 -1.205 -13.780 5.846 1.00 72.55 H new ATOM 0 HB THR A 140 -0.299 -15.541 7.286 1.00 45.31 H new ATOM 0 HG1 THR A 140 -1.942 -15.380 8.995 1.00 43.10 H new ATOM 0 HG21 THR A 140 0.321 -15.142 9.654 1.00 35.44 H new ATOM 0 HG22 THR A 140 1.430 -14.334 8.520 1.00 35.44 H new ATOM 0 HG23 THR A 140 0.191 -13.388 9.380 1.00 35.44 H new ATOM 2207 N GLY A 141 -0.004 -11.319 7.675 1.00 31.13 N ATOM 2208 CA GLY A 141 -0.286 -9.966 8.180 1.00 51.34 C ATOM 2209 C GLY A 141 -0.773 -9.015 7.077 1.00 14.01 C ATOM 2210 O GLY A 141 -1.787 -8.323 7.237 1.00 2.43 O ATOM 0 H GLY A 141 0.982 -11.577 7.706 1.00 31.13 H new ATOM 0 HA2 GLY A 141 -1.041 -10.025 8.964 1.00 51.34 H new ATOM 0 HA3 GLY A 141 0.616 -9.557 8.636 1.00 51.34 H new ATOM 2214 N MET A 142 -0.047 -9.016 5.939 1.00 31.24 N ATOM 2215 CA MET A 142 -0.417 -8.239 4.733 1.00 32.31 C ATOM 2216 C MET A 142 -1.717 -8.785 4.098 1.00 43.14 C ATOM 2217 O MET A 142 -2.528 -8.021 3.601 1.00 44.14 O ATOM 2218 CB MET A 142 0.733 -8.262 3.686 1.00 51.41 C ATOM 2219 CG MET A 142 2.048 -7.617 4.157 1.00 45.54 C ATOM 2220 SD MET A 142 3.322 -7.601 2.870 1.00 1.01 S ATOM 2221 CE MET A 142 3.551 -9.349 2.532 1.00 32.33 C ATOM 0 H MET A 142 0.812 -9.555 5.829 1.00 31.24 H new ATOM 0 HA MET A 142 -0.588 -7.209 5.045 1.00 32.31 H new ATOM 0 HB2 MET A 142 0.932 -9.297 3.408 1.00 51.41 H new ATOM 0 HB3 MET A 142 0.396 -7.749 2.785 1.00 51.41 H new ATOM 0 HG2 MET A 142 1.851 -6.595 4.479 1.00 45.54 H new ATOM 0 HG3 MET A 142 2.422 -8.159 5.026 1.00 45.54 H new ATOM 0 HE1 MET A 142 4.609 -9.553 2.370 1.00 32.33 H new ATOM 0 HE2 MET A 142 3.195 -9.933 3.380 1.00 32.33 H new ATOM 0 HE3 MET A 142 2.988 -9.624 1.640 1.00 32.33 H new ATOM 2231 N ASN A 143 -1.899 -10.116 4.154 1.00 33.42 N ATOM 2232 CA ASN A 143 -3.079 -10.814 3.584 1.00 25.21 C ATOM 2233 C ASN A 143 -4.376 -10.402 4.331 1.00 4.41 C ATOM 2234 O ASN A 143 -5.430 -10.244 3.717 1.00 43.24 O ATOM 2235 CB ASN A 143 -2.844 -12.354 3.653 1.00 53.14 C ATOM 2236 CG ASN A 143 -3.804 -13.204 2.805 1.00 34.14 C ATOM 2237 OD1 ASN A 143 -4.974 -12.883 2.621 1.00 62.32 O ATOM 2238 ND2 ASN A 143 -3.305 -14.307 2.270 1.00 44.23 N ATOM 0 H ASN A 143 -1.231 -10.747 4.597 1.00 33.42 H new ATOM 0 HA ASN A 143 -3.205 -10.525 2.541 1.00 25.21 H new ATOM 0 HB2 ASN A 143 -1.823 -12.564 3.335 1.00 53.14 H new ATOM 0 HB3 ASN A 143 -2.926 -12.671 4.693 1.00 53.14 H new ATOM 0 HD21 ASN A 143 -3.895 -14.907 1.694 1.00 44.23 H new ATOM 0 HD22 ASN A 143 -2.330 -14.557 2.434 1.00 44.23 H new ATOM 2245 N SER A 144 -4.270 -10.211 5.663 1.00 52.44 N ATOM 2246 CA SER A 144 -5.410 -9.772 6.515 1.00 13.20 C ATOM 2247 C SER A 144 -5.733 -8.270 6.311 1.00 4.14 C ATOM 2248 O SER A 144 -6.904 -7.889 6.292 1.00 63.31 O ATOM 2249 CB SER A 144 -5.109 -10.054 8.008 1.00 41.32 C ATOM 2250 OG SER A 144 -4.924 -11.443 8.244 1.00 5.32 O ATOM 0 H SER A 144 -3.403 -10.354 6.180 1.00 52.44 H new ATOM 0 HA SER A 144 -6.286 -10.346 6.212 1.00 13.20 H new ATOM 0 HB2 SER A 144 -4.214 -9.509 8.310 1.00 41.32 H new ATOM 0 HB3 SER A 144 -5.930 -9.685 8.623 1.00 41.32 H new ATOM 0 HG SER A 144 -4.032 -11.711 7.940 1.00 5.32 H new ATOM 2256 N THR A 145 -4.689 -7.430 6.152 1.00 34.11 N ATOM 2257 CA THR A 145 -4.843 -5.972 5.862 1.00 20.53 C ATOM 2258 C THR A 145 -5.451 -5.743 4.450 1.00 32.51 C ATOM 2259 O THR A 145 -6.264 -4.839 4.239 1.00 40.52 O ATOM 2260 CB THR A 145 -3.463 -5.231 5.992 1.00 70.53 C ATOM 2261 OG1 THR A 145 -2.972 -5.364 7.336 1.00 23.22 O ATOM 2262 CG2 THR A 145 -3.527 -3.732 5.633 1.00 35.21 C ATOM 0 H THR A 145 -3.717 -7.732 6.219 1.00 34.11 H new ATOM 0 HA THR A 145 -5.531 -5.556 6.598 1.00 20.53 H new ATOM 0 HB THR A 145 -2.793 -5.704 5.274 1.00 70.53 H new ATOM 0 HG1 THR A 145 -2.557 -6.245 7.447 1.00 23.22 H new ATOM 0 HG21 THR A 145 -2.538 -3.288 5.746 1.00 35.21 H new ATOM 0 HG22 THR A 145 -3.859 -3.619 4.601 1.00 35.21 H new ATOM 0 HG23 THR A 145 -4.229 -3.228 6.298 1.00 35.21 H new ATOM 2270 N LEU A 146 -5.050 -6.593 3.494 1.00 33.51 N ATOM 2271 CA LEU A 146 -5.594 -6.605 2.118 1.00 22.43 C ATOM 2272 C LEU A 146 -6.984 -7.275 2.063 1.00 34.23 C ATOM 2273 O LEU A 146 -7.775 -7.010 1.159 1.00 64.04 O ATOM 2274 CB LEU A 146 -4.560 -7.257 1.162 1.00 24.24 C ATOM 2275 CG LEU A 146 -3.275 -6.386 0.956 1.00 32.31 C ATOM 2276 CD1 LEU A 146 -2.155 -7.142 0.235 1.00 34.35 C ATOM 2277 CD2 LEU A 146 -3.618 -5.093 0.208 1.00 54.21 C ATOM 0 H LEU A 146 -4.332 -7.301 3.650 1.00 33.51 H new ATOM 0 HA LEU A 146 -5.756 -5.581 1.781 1.00 22.43 H new ATOM 0 HB2 LEU A 146 -4.271 -8.230 1.559 1.00 24.24 H new ATOM 0 HB3 LEU A 146 -5.030 -7.434 0.195 1.00 24.24 H new ATOM 0 HG LEU A 146 -2.899 -6.139 1.949 1.00 32.31 H new ATOM 0 HD11 LEU A 146 -1.290 -6.489 0.120 1.00 34.35 H new ATOM 0 HD12 LEU A 146 -1.873 -8.018 0.819 1.00 34.35 H new ATOM 0 HD13 LEU A 146 -2.504 -7.458 -0.748 1.00 34.35 H new ATOM 0 HD21 LEU A 146 -2.714 -4.500 0.073 1.00 54.21 H new ATOM 0 HD22 LEU A 146 -4.040 -5.338 -0.767 1.00 54.21 H new ATOM 0 HD23 LEU A 146 -4.345 -4.521 0.785 1.00 54.21 H new ATOM 2289 N ASN A 147 -7.275 -8.144 3.041 1.00 55.32 N ATOM 2290 CA ASN A 147 -8.641 -8.666 3.264 1.00 72.12 C ATOM 2291 C ASN A 147 -9.580 -7.520 3.738 1.00 55.02 C ATOM 2292 O ASN A 147 -10.770 -7.513 3.418 1.00 15.13 O ATOM 2293 CB ASN A 147 -8.616 -9.809 4.302 1.00 72.04 C ATOM 2294 CG ASN A 147 -9.946 -10.543 4.423 1.00 21.44 C ATOM 2295 OD1 ASN A 147 -10.826 -10.159 5.194 1.00 1.31 O ATOM 2296 ND2 ASN A 147 -10.109 -11.601 3.657 1.00 13.34 N ATOM 0 H ASN A 147 -6.582 -8.505 3.696 1.00 55.32 H new ATOM 0 HA ASN A 147 -9.023 -9.064 2.324 1.00 72.12 H new ATOM 0 HB2 ASN A 147 -7.839 -10.522 4.028 1.00 72.04 H new ATOM 0 HB3 ASN A 147 -8.345 -9.401 5.275 1.00 72.04 H new ATOM 0 HD21 ASN A 147 -10.982 -12.127 3.692 1.00 13.34 H new ATOM 0 HD22 ASN A 147 -9.362 -11.895 3.028 1.00 13.34 H new ATOM 2303 N GLN A 148 -9.022 -6.557 4.512 1.00 45.45 N ATOM 2304 CA GLN A 148 -9.756 -5.326 4.918 1.00 33.33 C ATOM 2305 C GLN A 148 -10.015 -4.423 3.689 1.00 13.44 C ATOM 2306 O GLN A 148 -11.038 -3.738 3.614 1.00 31.41 O ATOM 2307 CB GLN A 148 -8.987 -4.520 6.008 1.00 42.12 C ATOM 2308 CG GLN A 148 -8.539 -5.322 7.252 1.00 43.41 C ATOM 2309 CD GLN A 148 -9.642 -6.186 7.874 1.00 45.41 C ATOM 2310 OE1 GLN A 148 -10.398 -5.737 8.723 1.00 15.15 O ATOM 2311 NE2 GLN A 148 -9.722 -7.447 7.474 1.00 34.53 N ATOM 0 H GLN A 148 -8.068 -6.606 4.869 1.00 45.45 H new ATOM 0 HA GLN A 148 -10.707 -5.645 5.345 1.00 33.33 H new ATOM 0 HB2 GLN A 148 -8.104 -4.076 5.548 1.00 42.12 H new ATOM 0 HB3 GLN A 148 -9.621 -3.698 6.339 1.00 42.12 H new ATOM 0 HG2 GLN A 148 -7.703 -5.964 6.975 1.00 43.41 H new ATOM 0 HG3 GLN A 148 -8.170 -4.626 8.005 1.00 43.41 H new ATOM 0 HE21 GLN A 148 -9.080 -7.799 6.764 1.00 34.53 H new ATOM 0 HE22 GLN A 148 -10.426 -8.066 7.876 1.00 34.53 H new ATOM 2320 N LEU A 149 -9.059 -4.441 2.731 1.00 55.44 N ATOM 2321 CA LEU A 149 -9.204 -3.779 1.419 1.00 33.13 C ATOM 2322 C LEU A 149 -10.359 -4.411 0.604 1.00 72.03 C ATOM 2323 O LEU A 149 -11.094 -3.709 -0.087 1.00 73.21 O ATOM 2324 CB LEU A 149 -7.851 -3.841 0.642 1.00 4.12 C ATOM 2325 CG LEU A 149 -7.829 -3.183 -0.773 1.00 34.41 C ATOM 2326 CD1 LEU A 149 -8.267 -1.716 -0.706 1.00 44.35 C ATOM 2327 CD2 LEU A 149 -6.443 -3.305 -1.444 1.00 10.04 C ATOM 0 H LEU A 149 -8.165 -4.917 2.849 1.00 55.44 H new ATOM 0 HA LEU A 149 -9.460 -2.731 1.577 1.00 33.13 H new ATOM 0 HB2 LEU A 149 -7.085 -3.363 1.252 1.00 4.12 H new ATOM 0 HB3 LEU A 149 -7.566 -4.888 0.536 1.00 4.12 H new ATOM 0 HG LEU A 149 -8.543 -3.729 -1.390 1.00 34.41 H new ATOM 0 HD11 LEU A 149 -8.242 -1.283 -1.706 1.00 44.35 H new ATOM 0 HD12 LEU A 149 -9.281 -1.657 -0.310 1.00 44.35 H new ATOM 0 HD13 LEU A 149 -7.590 -1.164 -0.054 1.00 44.35 H new ATOM 0 HD21 LEU A 149 -6.472 -2.834 -2.427 1.00 10.04 H new ATOM 0 HD22 LEU A 149 -5.695 -2.809 -0.826 1.00 10.04 H new ATOM 0 HD23 LEU A 149 -6.183 -4.358 -1.554 1.00 10.04 H new ATOM 2339 N GLU A 150 -10.528 -5.744 0.718 1.00 73.51 N ATOM 2340 CA GLU A 150 -11.679 -6.456 0.105 1.00 42.34 C ATOM 2341 C GLU A 150 -13.024 -5.966 0.704 1.00 61.35 C ATOM 2342 O GLU A 150 -13.949 -5.637 -0.036 1.00 14.30 O ATOM 2343 CB GLU A 150 -11.539 -7.991 0.293 1.00 2.51 C ATOM 2344 CG GLU A 150 -12.652 -8.824 -0.377 1.00 44.43 C ATOM 2345 CD GLU A 150 -12.507 -10.335 -0.127 1.00 4.52 C ATOM 2346 OE1 GLU A 150 -11.836 -11.022 -0.928 1.00 25.43 O ATOM 2347 OE2 GLU A 150 -13.047 -10.837 0.884 1.00 74.31 O ATOM 0 H GLU A 150 -9.886 -6.352 1.227 1.00 73.51 H new ATOM 0 HA GLU A 150 -11.677 -6.232 -0.962 1.00 42.34 H new ATOM 0 HB2 GLU A 150 -10.576 -8.307 -0.108 1.00 2.51 H new ATOM 0 HB3 GLU A 150 -11.529 -8.214 1.360 1.00 2.51 H new ATOM 0 HG2 GLU A 150 -13.621 -8.491 -0.005 1.00 44.43 H new ATOM 0 HG3 GLU A 150 -12.642 -8.637 -1.451 1.00 44.43 H new ATOM 2354 N LYS A 151 -13.104 -5.888 2.054 1.00 53.32 N ATOM 2355 CA LYS A 151 -14.327 -5.414 2.767 1.00 2.34 C ATOM 2356 C LYS A 151 -14.669 -3.951 2.365 1.00 1.54 C ATOM 2357 O LYS A 151 -15.838 -3.585 2.207 1.00 4.40 O ATOM 2358 CB LYS A 151 -14.133 -5.483 4.310 1.00 14.44 C ATOM 2359 CG LYS A 151 -13.616 -6.818 4.914 1.00 61.42 C ATOM 2360 CD LYS A 151 -14.584 -8.032 4.780 1.00 63.41 C ATOM 2361 CE LYS A 151 -14.350 -8.862 3.503 1.00 24.13 C ATOM 2362 NZ LYS A 151 -12.976 -9.428 3.439 1.00 11.33 N ATOM 0 H LYS A 151 -12.338 -6.146 2.676 1.00 53.32 H new ATOM 0 HA LYS A 151 -15.148 -6.070 2.478 1.00 2.34 H new ATOM 0 HB2 LYS A 151 -13.438 -4.694 4.596 1.00 14.44 H new ATOM 0 HB3 LYS A 151 -15.089 -5.251 4.779 1.00 14.44 H new ATOM 0 HG2 LYS A 151 -12.672 -7.073 4.433 1.00 61.42 H new ATOM 0 HG3 LYS A 151 -13.403 -6.660 5.971 1.00 61.42 H new ATOM 0 HD2 LYS A 151 -14.468 -8.678 5.651 1.00 63.41 H new ATOM 0 HD3 LYS A 151 -15.612 -7.670 4.786 1.00 63.41 H new ATOM 0 HE2 LYS A 151 -15.077 -9.673 3.462 1.00 24.13 H new ATOM 0 HE3 LYS A 151 -14.523 -8.235 2.628 1.00 24.13 H new ATOM 0 HZ1 LYS A 151 -12.923 -10.123 2.668 1.00 11.33 H new ATOM 0 HZ2 LYS A 151 -12.293 -8.663 3.264 1.00 11.33 H new ATOM 0 HZ3 LYS A 151 -12.750 -9.894 4.341 1.00 11.33 H new ATOM 2376 N LEU A 152 -13.605 -3.142 2.212 1.00 61.22 N ATOM 2377 CA LEU A 152 -13.674 -1.725 1.789 1.00 55.25 C ATOM 2378 C LEU A 152 -14.306 -1.564 0.379 1.00 0.55 C ATOM 2379 O LEU A 152 -15.323 -0.891 0.221 1.00 3.04 O ATOM 2380 CB LEU A 152 -12.232 -1.132 1.804 1.00 71.44 C ATOM 2381 CG LEU A 152 -12.020 0.231 1.071 1.00 3.31 C ATOM 2382 CD1 LEU A 152 -12.863 1.351 1.694 1.00 13.43 C ATOM 2383 CD2 LEU A 152 -10.531 0.607 1.029 1.00 42.22 C ATOM 0 H LEU A 152 -12.651 -3.459 2.382 1.00 61.22 H new ATOM 0 HA LEU A 152 -14.316 -1.187 2.486 1.00 55.25 H new ATOM 0 HB2 LEU A 152 -11.927 -1.009 2.843 1.00 71.44 H new ATOM 0 HB3 LEU A 152 -11.559 -1.865 1.358 1.00 71.44 H new ATOM 0 HG LEU A 152 -12.364 0.107 0.044 1.00 3.31 H new ATOM 0 HD11 LEU A 152 -12.686 2.282 1.155 1.00 13.43 H new ATOM 0 HD12 LEU A 152 -13.919 1.090 1.630 1.00 13.43 H new ATOM 0 HD13 LEU A 152 -12.583 1.478 2.740 1.00 13.43 H new ATOM 0 HD21 LEU A 152 -10.411 1.560 0.513 1.00 42.22 H new ATOM 0 HD22 LEU A 152 -10.149 0.694 2.046 1.00 42.22 H new ATOM 0 HD23 LEU A 152 -9.975 -0.166 0.498 1.00 42.22 H new ATOM 2395 N LEU A 153 -13.694 -2.209 -0.623 1.00 73.33 N ATOM 2396 CA LEU A 153 -14.065 -2.046 -2.054 1.00 64.44 C ATOM 2397 C LEU A 153 -15.435 -2.678 -2.379 1.00 42.41 C ATOM 2398 O LEU A 153 -16.094 -2.299 -3.345 1.00 62.33 O ATOM 2399 CB LEU A 153 -12.946 -2.656 -2.928 1.00 54.32 C ATOM 2400 CG LEU A 153 -11.543 -2.004 -2.724 1.00 4.24 C ATOM 2401 CD1 LEU A 153 -10.443 -2.808 -3.427 1.00 70.24 C ATOM 2402 CD2 LEU A 153 -11.538 -0.520 -3.160 1.00 41.32 C ATOM 0 H LEU A 153 -12.925 -2.862 -0.474 1.00 73.33 H new ATOM 0 HA LEU A 153 -14.165 -0.982 -2.271 1.00 64.44 H new ATOM 0 HB2 LEU A 153 -12.873 -3.722 -2.712 1.00 54.32 H new ATOM 0 HB3 LEU A 153 -13.228 -2.562 -3.977 1.00 54.32 H new ATOM 0 HG LEU A 153 -11.324 -2.025 -1.656 1.00 4.24 H new ATOM 0 HD11 LEU A 153 -9.479 -2.326 -3.264 1.00 70.24 H new ATOM 0 HD12 LEU A 153 -10.416 -3.819 -3.021 1.00 70.24 H new ATOM 0 HD13 LEU A 153 -10.651 -2.852 -4.496 1.00 70.24 H new ATOM 0 HD21 LEU A 153 -10.545 -0.098 -3.004 1.00 41.32 H new ATOM 0 HD22 LEU A 153 -11.800 -0.450 -4.216 1.00 41.32 H new ATOM 0 HD23 LEU A 153 -12.265 0.036 -2.568 1.00 41.32 H new ATOM 2414 N ASN A 154 -15.840 -3.654 -1.561 1.00 32.34 N ATOM 2415 CA ASN A 154 -17.186 -4.251 -1.617 1.00 40.32 C ATOM 2416 C ASN A 154 -18.231 -3.351 -0.902 1.00 70.14 C ATOM 2417 O ASN A 154 -19.387 -3.302 -1.330 1.00 22.10 O ATOM 2418 CB ASN A 154 -17.143 -5.671 -1.011 1.00 74.54 C ATOM 2419 CG ASN A 154 -16.565 -6.708 -1.981 1.00 33.32 C ATOM 2420 OD1 ASN A 154 -17.276 -7.559 -2.489 1.00 35.10 O ATOM 2421 ND2 ASN A 154 -15.288 -6.611 -2.285 1.00 42.02 N ATOM 0 H ASN A 154 -15.245 -4.057 -0.837 1.00 32.34 H new ATOM 0 HA ASN A 154 -17.500 -4.327 -2.658 1.00 40.32 H new ATOM 0 HB2 ASN A 154 -16.543 -5.656 -0.101 1.00 74.54 H new ATOM 0 HB3 ASN A 154 -18.151 -5.970 -0.723 1.00 74.54 H new ATOM 0 HD21 ASN A 154 -14.874 -7.256 -2.958 1.00 42.02 H new ATOM 0 HD22 ASN A 154 -14.713 -5.891 -1.847 1.00 42.02 H new ATOM 2428 N GLN A 155 -17.787 -2.624 0.164 1.00 5.32 N ATOM 2429 CA GLN A 155 -18.629 -1.711 1.004 1.00 32.31 C ATOM 2430 C GLN A 155 -19.730 -2.470 1.798 1.00 21.44 C ATOM 2431 O GLN A 155 -19.712 -2.509 3.031 1.00 13.54 O ATOM 2432 CB GLN A 155 -19.252 -0.549 0.165 1.00 63.21 C ATOM 2433 CG GLN A 155 -18.241 0.475 -0.393 1.00 23.03 C ATOM 2434 CD GLN A 155 -17.562 1.337 0.686 1.00 52.13 C ATOM 2435 OE1 GLN A 155 -18.136 1.625 1.734 1.00 24.22 O ATOM 2436 NE2 GLN A 155 -16.336 1.755 0.438 1.00 30.02 N ATOM 0 H GLN A 155 -16.815 -2.655 0.472 1.00 5.32 H new ATOM 0 HA GLN A 155 -17.950 -1.271 1.735 1.00 32.31 H new ATOM 0 HB2 GLN A 155 -19.805 -0.981 -0.669 1.00 63.21 H new ATOM 0 HB3 GLN A 155 -19.974 -0.020 0.787 1.00 63.21 H new ATOM 0 HG2 GLN A 155 -17.473 -0.057 -0.955 1.00 23.03 H new ATOM 0 HG3 GLN A 155 -18.754 1.130 -1.097 1.00 23.03 H new ATOM 0 HE21 GLN A 155 -15.879 1.504 -0.439 1.00 30.02 H new ATOM 0 HE22 GLN A 155 -15.845 2.330 1.123 1.00 30.02 H new