USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1051 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 65 GLN :FLIP amide:sc= -0.308 F(o=-1.8,f=-0.69) USER MOD Set 1.2: A 68 THR OG1 : rot -106:sc= -0.386 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -159:sc= 1.51 (180deg=1.03) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.01 K(o=-0.01,f=-2.7!) USER MOD Single : A 14 THR OG1 : rot 180:sc=-0.00773 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 163:sc= -0.0688 (180deg=-0.466) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 40:sc= 0.157 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.0862 USER MOD Single : A 41 ASN : amide:sc= -0.0866 K(o=-0.087,f=-1.3) USER MOD Single : A 46 SER OG : rot -111:sc= 0.635 USER MOD Single : A 52 LYS NZ :NH3+ -161:sc= -0.0579 (180deg=-0.354) USER MOD Single : A 56 ASN : amide:sc= 0.86 K(o=0.86,f=-6.7!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= 1.04 K(o=1,f=-3.1!) USER MOD Single : A 76 SER OG : rot 180:sc= -0.458 USER MOD Single : A 84 THR OG1 : rot 3:sc= 1.07 USER MOD Single : A 86 SER OG : rot 174:sc= 1.16 USER MOD Single : A 89 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-7.9!) USER MOD Single : A 95 ASN : amide:sc= 0.0934 K(o=0.093,f=-7.4!) USER MOD Single : A 106 SER OG : rot 180:sc= 0.0697 USER MOD Single : A 108 ASN : amide:sc= -0.0151 X(o=-0.015,f=-0.32) USER MOD Single : A 110 THR OG1 : rot 107:sc= 1.25 USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -0.815 X(o=-0.81,f=-0.8) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 GLN : amide:sc= 0.0732 K(o=0.073,f=-6.3!) USER MOD Single : A 122 MET CE :methyl -167:sc= -1.91 (180deg=-2.11) USER MOD Single : A 123 GLN : amide:sc= -0.0206 K(o=-0.021,f=-0.59) USER MOD Single : A 124 THR OG1 : rot 42:sc= 0.201 USER MOD Single : A 129 GLN : amide:sc= -0.296 K(o=-0.3,f=-3.4!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.851 53.109 56.036 1.00 11.00 N ATOM 2 CA MET A 1 1.020 53.510 57.179 1.00 43.05 C ATOM 3 C MET A 1 -0.105 52.508 57.363 1.00 55.13 C ATOM 4 O MET A 1 0.075 51.519 58.068 1.00 1.55 O ATOM 5 CB MET A 1 0.479 54.938 57.019 1.00 23.04 C ATOM 6 CG MET A 1 1.540 56.028 57.035 1.00 73.43 C ATOM 7 SD MET A 1 0.852 57.663 56.686 1.00 4.11 S ATOM 8 CE MET A 1 2.315 58.688 56.851 1.00 72.35 C ATOM 0 H1 MET A 1 2.788 53.554 56.115 1.00 11.00 H new ATOM 0 H2 MET A 1 1.959 52.075 56.031 1.00 11.00 H new ATOM 0 H3 MET A 1 1.396 53.414 55.152 1.00 11.00 H new ATOM 0 HA MET A 1 1.641 53.514 58.075 1.00 43.05 H new ATOM 0 HB2 MET A 1 -0.071 55.000 56.080 1.00 23.04 H new ATOM 0 HB3 MET A 1 -0.234 55.133 57.820 1.00 23.04 H new ATOM 0 HG2 MET A 1 2.028 56.042 58.010 1.00 73.43 H new ATOM 0 HG3 MET A 1 2.308 55.795 56.298 1.00 73.43 H new ATOM 0 HE1 MET A 1 2.053 59.729 56.664 1.00 72.35 H new ATOM 0 HE2 MET A 1 2.716 58.590 57.860 1.00 72.35 H new ATOM 0 HE3 MET A 1 3.067 58.368 56.129 1.00 72.35 H new ATOM 20 N SER A 2 -1.252 52.718 56.708 1.00 1.11 N ATOM 21 CA SER A 2 -2.312 51.718 56.749 1.00 20.45 C ATOM 22 C SER A 2 -1.918 50.592 55.815 1.00 3.13 C ATOM 23 O SER A 2 -2.258 49.428 56.009 1.00 23.34 O ATOM 24 CB SER A 2 -3.636 52.338 56.322 1.00 65.01 C ATOM 25 OG SER A 2 -3.965 53.435 57.158 1.00 54.24 O ATOM 0 H SER A 2 -1.463 53.551 56.158 1.00 1.11 H new ATOM 0 HA SER A 2 -2.441 51.335 57.761 1.00 20.45 H new ATOM 0 HB2 SER A 2 -3.571 52.670 55.286 1.00 65.01 H new ATOM 0 HB3 SER A 2 -4.426 51.589 56.368 1.00 65.01 H new ATOM 0 HG SER A 2 -4.817 53.823 56.869 1.00 54.24 H new ATOM 31 N ASP A 3 -1.163 50.975 54.822 1.00 0.23 N ATOM 32 CA ASP A 3 -0.577 50.082 53.867 1.00 41.24 C ATOM 33 C ASP A 3 0.691 49.510 54.484 1.00 75.11 C ATOM 34 O ASP A 3 1.402 50.223 55.223 1.00 30.25 O ATOM 35 CB ASP A 3 -0.204 50.864 52.590 1.00 10.31 C ATOM 36 CG ASP A 3 0.916 51.878 52.821 1.00 64.43 C ATOM 37 OD1 ASP A 3 0.716 52.865 53.591 1.00 24.30 O ATOM 38 OD2 ASP A 3 2.027 51.689 52.292 1.00 43.15 O ATOM 0 H ASP A 3 -0.932 51.954 54.652 1.00 0.23 H new ATOM 0 HA ASP A 3 -1.278 49.288 53.610 1.00 41.24 H new ATOM 0 HB2 ASP A 3 0.103 50.161 51.816 1.00 10.31 H new ATOM 0 HB3 ASP A 3 -1.087 51.383 52.217 1.00 10.31 H new ATOM 43 N ASN A 4 0.952 48.247 54.233 1.00 52.34 N ATOM 44 CA ASN A 4 2.165 47.600 54.709 1.00 74.33 C ATOM 45 C ASN A 4 2.308 46.247 54.055 1.00 71.54 C ATOM 46 O ASN A 4 1.366 45.750 53.410 1.00 65.10 O ATOM 47 CB ASN A 4 2.205 47.420 56.256 1.00 70.23 C ATOM 48 CG ASN A 4 1.295 46.318 56.800 1.00 54.15 C ATOM 49 OD1 ASN A 4 0.216 46.056 56.278 1.00 23.12 O ATOM 50 ND2 ASN A 4 1.746 45.647 57.829 1.00 24.13 N ATOM 0 H ASN A 4 0.336 47.637 53.696 1.00 52.34 H new ATOM 0 HA ASN A 4 2.992 48.257 54.439 1.00 74.33 H new ATOM 0 HB2 ASN A 4 3.231 47.205 56.556 1.00 70.23 H new ATOM 0 HB3 ASN A 4 1.927 48.364 56.724 1.00 70.23 H new ATOM 0 HD21 ASN A 4 1.196 44.882 58.219 1.00 24.13 H new ATOM 0 HD22 ASN A 4 2.647 45.889 58.241 1.00 24.13 H new ATOM 57 N ASN A 5 3.474 45.677 54.197 1.00 15.32 N ATOM 58 CA ASN A 5 3.784 44.349 53.717 1.00 15.31 C ATOM 59 C ASN A 5 5.041 43.879 54.404 1.00 71.33 C ATOM 60 O ASN A 5 6.030 44.614 54.478 1.00 65.12 O ATOM 61 CB ASN A 5 3.935 44.284 52.169 1.00 70.13 C ATOM 62 CG ASN A 5 4.980 45.234 51.596 1.00 54.14 C ATOM 63 OD1 ASN A 5 6.162 44.899 51.479 1.00 4.21 O ATOM 64 ND2 ASN A 5 4.550 46.404 51.202 1.00 62.02 N ATOM 0 H ASN A 5 4.259 46.133 54.662 1.00 15.32 H new ATOM 0 HA ASN A 5 2.949 43.691 53.958 1.00 15.31 H new ATOM 0 HB2 ASN A 5 4.194 43.264 51.884 1.00 70.13 H new ATOM 0 HB3 ASN A 5 2.971 44.507 51.713 1.00 70.13 H new ATOM 0 HD21 ASN A 5 5.198 47.071 50.783 1.00 62.02 H new ATOM 0 HD22 ASN A 5 3.566 46.650 51.313 1.00 62.02 H new ATOM 71 N GLY A 6 4.987 42.710 54.967 1.00 53.53 N ATOM 72 CA GLY A 6 6.125 42.175 55.642 1.00 50.41 C ATOM 73 C GLY A 6 6.958 41.342 54.729 1.00 53.20 C ATOM 74 O GLY A 6 6.461 40.840 53.708 1.00 13.43 O ATOM 0 H GLY A 6 4.163 42.108 54.971 1.00 53.53 H new ATOM 0 HA2 GLY A 6 6.727 42.990 56.044 1.00 50.41 H new ATOM 0 HA3 GLY A 6 5.797 41.572 56.489 1.00 50.41 H new ATOM 78 N THR A 7 8.202 41.200 55.056 1.00 42.02 N ATOM 79 CA THR A 7 9.102 40.412 54.276 1.00 63.35 C ATOM 80 C THR A 7 8.945 38.942 54.664 1.00 70.23 C ATOM 81 O THR A 7 8.894 38.625 55.861 1.00 20.01 O ATOM 82 CB THR A 7 10.546 40.859 54.550 1.00 63.51 C ATOM 83 OG1 THR A 7 10.626 42.287 54.391 1.00 45.11 O ATOM 84 CG2 THR A 7 11.522 40.190 53.584 1.00 32.45 C ATOM 0 H THR A 7 8.626 41.631 55.878 1.00 42.02 H new ATOM 0 HA THR A 7 8.878 40.541 53.217 1.00 63.35 H new ATOM 0 HB THR A 7 10.816 40.569 55.565 1.00 63.51 H new ATOM 0 HG1 THR A 7 11.543 42.585 54.565 1.00 45.11 H new ATOM 0 HG21 THR A 7 12.536 40.525 53.801 1.00 32.45 H new ATOM 0 HG22 THR A 7 11.465 39.108 53.700 1.00 32.45 H new ATOM 0 HG23 THR A 7 11.263 40.459 52.560 1.00 32.45 H new ATOM 92 N PRO A 8 8.770 38.041 53.686 1.00 60.12 N ATOM 93 CA PRO A 8 8.757 36.620 53.959 1.00 75.42 C ATOM 94 C PRO A 8 10.137 36.184 54.418 1.00 64.45 C ATOM 95 O PRO A 8 11.143 36.475 53.756 1.00 12.24 O ATOM 96 CB PRO A 8 8.429 35.973 52.603 1.00 23.35 C ATOM 97 CG PRO A 8 7.906 37.078 51.757 1.00 1.43 C ATOM 98 CD PRO A 8 8.558 38.329 52.258 1.00 1.11 C ATOM 0 HA PRO A 8 8.044 36.343 54.736 1.00 75.42 H new ATOM 0 HB2 PRO A 8 9.316 35.523 52.157 1.00 23.35 H new ATOM 0 HB3 PRO A 8 7.690 35.179 52.714 1.00 23.35 H new ATOM 0 HG2 PRO A 8 8.142 36.910 50.706 1.00 1.43 H new ATOM 0 HG3 PRO A 8 6.821 37.147 51.833 1.00 1.43 H new ATOM 0 HD2 PRO A 8 9.497 38.529 51.743 1.00 1.11 H new ATOM 0 HD3 PRO A 8 7.922 39.202 52.112 1.00 1.11 H new ATOM 106 N GLU A 9 10.191 35.518 55.527 1.00 31.55 N ATOM 107 CA GLU A 9 11.433 35.041 56.046 1.00 54.22 C ATOM 108 C GLU A 9 11.765 33.732 55.369 1.00 12.05 C ATOM 109 O GLU A 9 10.873 32.915 55.159 1.00 32.20 O ATOM 110 CB GLU A 9 11.332 34.836 57.557 1.00 41.32 C ATOM 111 CG GLU A 9 11.087 36.114 58.335 1.00 61.04 C ATOM 112 CD GLU A 9 12.250 37.076 58.258 1.00 75.22 C ATOM 113 OE1 GLU A 9 13.216 36.919 59.038 1.00 71.01 O ATOM 114 OE2 GLU A 9 12.227 38.019 57.440 1.00 72.23 O ATOM 0 H GLU A 9 9.377 35.290 56.098 1.00 31.55 H new ATOM 0 HA GLU A 9 12.218 35.772 55.852 1.00 54.22 H new ATOM 0 HB2 GLU A 9 10.524 34.135 57.765 1.00 41.32 H new ATOM 0 HB3 GLU A 9 12.253 34.376 57.914 1.00 41.32 H new ATOM 0 HG2 GLU A 9 10.191 36.602 57.951 1.00 61.04 H new ATOM 0 HG3 GLU A 9 10.893 35.867 59.379 1.00 61.04 H new ATOM 121 N PRO A 10 13.013 33.521 54.962 1.00 24.12 N ATOM 122 CA PRO A 10 13.412 32.263 54.383 1.00 72.03 C ATOM 123 C PRO A 10 13.428 31.192 55.455 1.00 70.42 C ATOM 124 O PRO A 10 14.172 31.297 56.446 1.00 61.45 O ATOM 125 CB PRO A 10 14.833 32.509 53.863 1.00 53.55 C ATOM 126 CG PRO A 10 15.055 33.981 53.963 1.00 31.43 C ATOM 127 CD PRO A 10 14.126 34.474 55.025 1.00 22.32 C ATOM 0 HA PRO A 10 12.736 31.929 53.596 1.00 72.03 H new ATOM 0 HB2 PRO A 10 15.566 31.962 54.456 1.00 53.55 H new ATOM 0 HB3 PRO A 10 14.937 32.167 52.833 1.00 53.55 H new ATOM 0 HG2 PRO A 10 16.091 34.201 54.220 1.00 31.43 H new ATOM 0 HG3 PRO A 10 14.852 34.471 53.011 1.00 31.43 H new ATOM 0 HD2 PRO A 10 14.600 34.476 56.006 1.00 22.32 H new ATOM 0 HD3 PRO A 10 13.795 35.494 54.829 1.00 22.32 H new ATOM 135 N GLN A 11 12.575 30.220 55.299 1.00 42.11 N ATOM 136 CA GLN A 11 12.487 29.128 56.221 1.00 52.24 C ATOM 137 C GLN A 11 13.751 28.327 56.129 1.00 31.43 C ATOM 138 O GLN A 11 14.142 27.915 55.019 1.00 20.21 O ATOM 139 CB GLN A 11 11.259 28.228 55.945 1.00 2.13 C ATOM 140 CG GLN A 11 9.885 28.866 56.218 1.00 43.53 C ATOM 141 CD GLN A 11 9.521 30.012 55.289 1.00 40.34 C ATOM 142 OE1 GLN A 11 9.925 30.052 54.129 1.00 70.51 O ATOM 143 NE2 GLN A 11 8.769 30.943 55.780 1.00 70.20 N ATOM 0 H GLN A 11 11.917 30.164 54.522 1.00 42.11 H new ATOM 0 HA GLN A 11 12.361 29.530 57.226 1.00 52.24 H new ATOM 0 HB2 GLN A 11 11.291 27.912 54.902 1.00 2.13 H new ATOM 0 HB3 GLN A 11 11.348 27.328 56.554 1.00 2.13 H new ATOM 0 HG2 GLN A 11 9.119 28.094 56.138 1.00 43.53 H new ATOM 0 HG3 GLN A 11 9.866 29.229 57.246 1.00 43.53 H new ATOM 0 HE21 GLN A 11 8.449 30.883 56.747 1.00 70.20 H new ATOM 0 HE22 GLN A 11 8.496 31.737 55.201 1.00 70.20 H new ATOM 152 N VAL A 12 14.413 28.158 57.262 1.00 61.40 N ATOM 153 CA VAL A 12 15.658 27.438 57.332 1.00 11.51 C ATOM 154 C VAL A 12 15.512 26.062 56.712 1.00 24.40 C ATOM 155 O VAL A 12 14.577 25.309 57.034 1.00 65.02 O ATOM 156 CB VAL A 12 16.222 27.345 58.788 1.00 41.03 C ATOM 157 CG1 VAL A 12 16.549 28.725 59.331 1.00 12.22 C ATOM 158 CG2 VAL A 12 15.275 26.619 59.737 1.00 72.34 C ATOM 0 H VAL A 12 14.093 28.522 58.160 1.00 61.40 H new ATOM 0 HA VAL A 12 16.389 28.006 56.756 1.00 11.51 H new ATOM 0 HB VAL A 12 17.138 26.757 58.729 1.00 41.03 H new ATOM 0 HG11 VAL A 12 16.939 28.634 60.345 1.00 12.22 H new ATOM 0 HG12 VAL A 12 17.297 29.198 58.695 1.00 12.22 H new ATOM 0 HG13 VAL A 12 15.645 29.335 59.344 1.00 12.22 H new ATOM 0 HG21 VAL A 12 15.715 26.583 60.733 1.00 72.34 H new ATOM 0 HG22 VAL A 12 14.324 27.151 59.780 1.00 72.34 H new ATOM 0 HG23 VAL A 12 15.107 25.604 59.377 1.00 72.34 H new ATOM 168 N GLU A 13 16.381 25.768 55.784 1.00 33.31 N ATOM 169 CA GLU A 13 16.318 24.528 55.077 1.00 13.45 C ATOM 170 C GLU A 13 16.696 23.374 55.980 1.00 5.55 C ATOM 171 O GLU A 13 17.585 23.490 56.827 1.00 15.22 O ATOM 172 CB GLU A 13 17.193 24.559 53.830 1.00 23.12 C ATOM 173 CG GLU A 13 18.666 24.838 54.091 1.00 34.15 C ATOM 174 CD GLU A 13 19.489 24.743 52.839 1.00 53.32 C ATOM 175 OE1 GLU A 13 19.636 25.758 52.122 1.00 43.31 O ATOM 176 OE2 GLU A 13 20.005 23.642 52.538 1.00 11.31 O ATOM 0 H GLU A 13 17.146 26.380 55.501 1.00 33.31 H new ATOM 0 HA GLU A 13 15.288 24.379 54.753 1.00 13.45 H new ATOM 0 HB2 GLU A 13 17.104 23.601 53.317 1.00 23.12 H new ATOM 0 HB3 GLU A 13 16.808 25.321 53.152 1.00 23.12 H new ATOM 0 HG2 GLU A 13 18.775 25.833 54.522 1.00 34.15 H new ATOM 0 HG3 GLU A 13 19.044 24.129 54.827 1.00 34.15 H new ATOM 183 N THR A 14 15.988 22.305 55.852 1.00 60.23 N ATOM 184 CA THR A 14 16.233 21.125 56.621 1.00 13.43 C ATOM 185 C THR A 14 15.942 19.923 55.737 1.00 25.12 C ATOM 186 O THR A 14 14.986 19.939 54.955 1.00 21.01 O ATOM 187 CB THR A 14 15.337 21.118 57.889 1.00 34.33 C ATOM 188 OG1 THR A 14 15.586 22.324 58.643 1.00 42.25 O ATOM 189 CG2 THR A 14 15.627 19.910 58.774 1.00 12.41 C ATOM 0 H THR A 14 15.208 22.221 55.200 1.00 60.23 H new ATOM 0 HA THR A 14 17.270 21.092 56.955 1.00 13.43 H new ATOM 0 HB THR A 14 14.295 21.065 57.572 1.00 34.33 H new ATOM 0 HG1 THR A 14 15.023 22.330 59.445 1.00 42.25 H new ATOM 0 HG21 THR A 14 14.981 19.939 59.652 1.00 12.41 H new ATOM 0 HG22 THR A 14 15.437 18.995 58.214 1.00 12.41 H new ATOM 0 HG23 THR A 14 16.670 19.932 59.090 1.00 12.41 H new ATOM 197 N THR A 15 16.763 18.926 55.818 1.00 24.12 N ATOM 198 CA THR A 15 16.624 17.783 54.997 1.00 5.13 C ATOM 199 C THR A 15 16.341 16.575 55.882 1.00 71.14 C ATOM 200 O THR A 15 17.050 16.338 56.865 1.00 64.03 O ATOM 201 CB THR A 15 17.920 17.578 54.181 1.00 30.23 C ATOM 202 OG1 THR A 15 18.270 18.832 53.549 1.00 43.50 O ATOM 203 CG2 THR A 15 17.716 16.539 53.096 1.00 31.33 C ATOM 0 H THR A 15 17.552 18.889 56.463 1.00 24.12 H new ATOM 0 HA THR A 15 15.796 17.912 54.300 1.00 5.13 H new ATOM 0 HB THR A 15 18.708 17.240 54.854 1.00 30.23 H new ATOM 0 HG1 THR A 15 19.092 18.718 53.028 1.00 43.50 H new ATOM 0 HG21 THR A 15 18.642 16.412 52.535 1.00 31.33 H new ATOM 0 HG22 THR A 15 17.434 15.589 53.550 1.00 31.33 H new ATOM 0 HG23 THR A 15 16.925 16.868 52.421 1.00 31.33 H new ATOM 211 N SER A 16 15.279 15.873 55.569 1.00 23.30 N ATOM 212 CA SER A 16 14.875 14.690 56.308 1.00 15.34 C ATOM 213 C SER A 16 15.961 13.641 56.240 1.00 54.12 C ATOM 214 O SER A 16 16.470 13.164 57.259 1.00 51.11 O ATOM 215 CB SER A 16 13.534 14.162 55.772 1.00 72.01 C ATOM 216 OG SER A 16 13.053 13.065 56.525 1.00 32.24 O ATOM 0 H SER A 16 14.663 16.104 54.790 1.00 23.30 H new ATOM 0 HA SER A 16 14.730 14.949 57.357 1.00 15.34 H new ATOM 0 HB2 SER A 16 12.796 14.964 55.790 1.00 72.01 H new ATOM 0 HB3 SER A 16 13.653 13.862 54.731 1.00 72.01 H new ATOM 0 HG SER A 16 12.199 12.762 56.152 1.00 32.24 H new ATOM 222 N VAL A 17 16.321 13.347 55.059 1.00 71.04 N ATOM 223 CA VAL A 17 17.361 12.414 54.735 1.00 63.40 C ATOM 224 C VAL A 17 18.158 12.919 53.552 1.00 2.24 C ATOM 225 O VAL A 17 17.579 13.401 52.568 1.00 62.22 O ATOM 226 CB VAL A 17 16.816 10.995 54.404 1.00 24.15 C ATOM 227 CG1 VAL A 17 16.412 10.249 55.655 1.00 62.41 C ATOM 228 CG2 VAL A 17 15.635 11.061 53.438 1.00 63.31 C ATOM 0 H VAL A 17 15.887 13.763 54.235 1.00 71.04 H new ATOM 0 HA VAL A 17 17.992 12.331 55.620 1.00 63.40 H new ATOM 0 HB VAL A 17 17.629 10.451 53.924 1.00 24.15 H new ATOM 0 HG11 VAL A 17 16.036 9.262 55.385 1.00 62.41 H new ATOM 0 HG12 VAL A 17 17.277 10.141 56.310 1.00 62.41 H new ATOM 0 HG13 VAL A 17 15.631 10.805 56.174 1.00 62.41 H new ATOM 0 HG21 VAL A 17 15.279 10.052 53.229 1.00 63.31 H new ATOM 0 HG22 VAL A 17 14.830 11.644 53.886 1.00 63.31 H new ATOM 0 HG23 VAL A 17 15.951 11.534 52.509 1.00 63.31 H new ATOM 238 N PHE A 18 19.463 12.867 53.660 1.00 44.34 N ATOM 239 CA PHE A 18 20.316 13.223 52.557 1.00 32.13 C ATOM 240 C PHE A 18 20.237 12.121 51.522 1.00 61.52 C ATOM 241 O PHE A 18 20.649 10.973 51.776 1.00 41.55 O ATOM 242 CB PHE A 18 21.770 13.448 53.013 1.00 22.25 C ATOM 243 CG PHE A 18 22.714 13.816 51.894 1.00 10.15 C ATOM 244 CD1 PHE A 18 22.692 15.088 51.344 1.00 50.52 C ATOM 245 CD2 PHE A 18 23.618 12.889 51.395 1.00 14.34 C ATOM 246 CE1 PHE A 18 23.552 15.429 50.319 1.00 75.22 C ATOM 247 CE2 PHE A 18 24.481 13.224 50.372 1.00 22.44 C ATOM 248 CZ PHE A 18 24.447 14.494 49.833 1.00 62.13 C ATOM 0 H PHE A 18 19.957 12.580 54.505 1.00 44.34 H new ATOM 0 HA PHE A 18 19.976 14.165 52.127 1.00 32.13 H new ATOM 0 HB2 PHE A 18 21.787 14.238 53.763 1.00 22.25 H new ATOM 0 HB3 PHE A 18 22.133 12.541 53.497 1.00 22.25 H new ATOM 0 HD1 PHE A 18 21.994 15.821 51.721 1.00 50.52 H new ATOM 0 HD2 PHE A 18 23.646 11.893 51.812 1.00 14.34 H new ATOM 0 HE1 PHE A 18 23.526 16.423 49.898 1.00 75.22 H new ATOM 0 HE2 PHE A 18 25.181 12.494 49.994 1.00 22.44 H new ATOM 0 HZ PHE A 18 25.120 14.758 49.031 1.00 62.13 H new ATOM 258 N ARG A 19 19.669 12.445 50.406 1.00 62.12 N ATOM 259 CA ARG A 19 19.476 11.507 49.343 1.00 53.03 C ATOM 260 C ARG A 19 20.502 11.742 48.281 1.00 44.41 C ATOM 261 O ARG A 19 20.473 12.766 47.586 1.00 75.13 O ATOM 262 CB ARG A 19 18.085 11.659 48.748 1.00 4.15 C ATOM 263 CG ARG A 19 16.961 11.390 49.714 1.00 11.34 C ATOM 264 CD ARG A 19 15.625 11.574 49.040 1.00 73.35 C ATOM 265 NE ARG A 19 14.518 11.224 49.927 1.00 3.24 N ATOM 266 CZ ARG A 19 13.468 10.484 49.566 1.00 4.13 C ATOM 267 NH1 ARG A 19 13.358 10.040 48.313 1.00 25.33 N ATOM 268 NH2 ARG A 19 12.539 10.181 50.461 1.00 5.42 N ATOM 0 H ARG A 19 19.320 13.382 50.202 1.00 62.12 H new ATOM 0 HA ARG A 19 19.580 10.497 49.740 1.00 53.03 H new ATOM 0 HB2 ARG A 19 17.978 12.672 48.359 1.00 4.15 H new ATOM 0 HB3 ARG A 19 17.990 10.980 47.901 1.00 4.15 H new ATOM 0 HG2 ARG A 19 17.042 10.374 50.101 1.00 11.34 H new ATOM 0 HG3 ARG A 19 17.039 12.063 50.568 1.00 11.34 H new ATOM 0 HD2 ARG A 19 15.520 12.610 48.718 1.00 73.35 H new ATOM 0 HD3 ARG A 19 15.582 10.956 48.143 1.00 73.35 H new ATOM 0 HE ARG A 19 14.550 11.568 50.887 1.00 3.24 H new ATOM 0 HH11 ARG A 19 14.078 10.266 47.627 1.00 25.33 H new ATOM 0 HH12 ARG A 19 12.554 9.475 48.041 1.00 25.33 H new ATOM 0 HH21 ARG A 19 12.628 10.513 51.421 1.00 5.42 H new ATOM 0 HH22 ARG A 19 11.735 9.616 50.190 1.00 5.42 H new ATOM 282 N ALA A 20 21.417 10.835 48.152 1.00 4.10 N ATOM 283 CA ALA A 20 22.423 10.943 47.146 1.00 51.24 C ATOM 284 C ALA A 20 21.945 10.280 45.868 1.00 42.42 C ATOM 285 O ALA A 20 22.427 9.213 45.484 1.00 14.42 O ATOM 286 CB ALA A 20 23.749 10.357 47.623 1.00 4.24 C ATOM 0 H ALA A 20 21.488 10.003 48.738 1.00 4.10 H new ATOM 0 HA ALA A 20 22.601 11.998 46.940 1.00 51.24 H new ATOM 0 HB1 ALA A 20 24.495 10.455 46.834 1.00 4.24 H new ATOM 0 HB2 ALA A 20 24.086 10.894 48.509 1.00 4.24 H new ATOM 0 HB3 ALA A 20 23.614 9.303 47.867 1.00 4.24 H new ATOM 292 N ASP A 21 20.927 10.880 45.259 1.00 34.30 N ATOM 293 CA ASP A 21 20.385 10.394 43.996 1.00 55.24 C ATOM 294 C ASP A 21 21.433 10.552 42.928 1.00 65.14 C ATOM 295 O ASP A 21 21.639 9.656 42.114 1.00 72.34 O ATOM 296 CB ASP A 21 19.102 11.142 43.602 1.00 43.35 C ATOM 297 CG ASP A 21 17.939 10.909 44.549 1.00 13.14 C ATOM 298 OD1 ASP A 21 17.175 9.935 44.362 1.00 71.53 O ATOM 299 OD2 ASP A 21 17.744 11.713 45.475 1.00 42.02 O ATOM 0 H ASP A 21 20.458 11.709 45.623 1.00 34.30 H new ATOM 0 HA ASP A 21 20.120 9.343 44.109 1.00 55.24 H new ATOM 0 HB2 ASP A 21 19.315 12.210 43.559 1.00 43.35 H new ATOM 0 HB3 ASP A 21 18.808 10.835 42.598 1.00 43.35 H new ATOM 304 N LEU A 22 22.084 11.721 42.945 1.00 41.44 N ATOM 305 CA LEU A 22 23.257 12.019 42.115 1.00 30.44 C ATOM 306 C LEU A 22 22.986 11.793 40.629 1.00 52.04 C ATOM 307 O LEU A 22 23.778 11.177 39.915 1.00 23.54 O ATOM 308 CB LEU A 22 24.457 11.184 42.607 1.00 54.25 C ATOM 309 CG LEU A 22 24.909 11.455 44.053 1.00 1.01 C ATOM 310 CD1 LEU A 22 26.020 10.506 44.461 1.00 42.34 C ATOM 311 CD2 LEU A 22 25.364 12.903 44.220 1.00 12.51 C ATOM 0 H LEU A 22 21.807 12.498 43.545 1.00 41.44 H new ATOM 0 HA LEU A 22 23.493 13.078 42.220 1.00 30.44 H new ATOM 0 HB2 LEU A 22 24.203 10.128 42.517 1.00 54.25 H new ATOM 0 HB3 LEU A 22 25.301 11.367 41.942 1.00 54.25 H new ATOM 0 HG LEU A 22 24.053 11.285 44.705 1.00 1.01 H new ATOM 0 HD11 LEU A 22 26.321 10.718 45.487 1.00 42.34 H new ATOM 0 HD12 LEU A 22 25.664 9.478 44.393 1.00 42.34 H new ATOM 0 HD13 LEU A 22 26.874 10.639 43.797 1.00 42.34 H new ATOM 0 HD21 LEU A 22 25.678 13.069 45.250 1.00 12.51 H new ATOM 0 HD22 LEU A 22 26.200 13.101 43.549 1.00 12.51 H new ATOM 0 HD23 LEU A 22 24.539 13.574 43.980 1.00 12.51 H new ATOM 323 N LEU A 23 21.885 12.302 40.170 1.00 41.01 N ATOM 324 CA LEU A 23 21.517 12.167 38.797 1.00 53.04 C ATOM 325 C LEU A 23 21.954 13.436 38.074 1.00 11.20 C ATOM 326 O LEU A 23 21.363 14.508 38.250 1.00 4.03 O ATOM 327 CB LEU A 23 19.986 11.928 38.678 1.00 33.20 C ATOM 328 CG LEU A 23 19.422 11.378 37.332 1.00 24.53 C ATOM 329 CD1 LEU A 23 19.568 12.359 36.178 1.00 11.12 C ATOM 330 CD2 LEU A 23 20.067 10.043 36.985 1.00 50.23 C ATOM 0 H LEU A 23 21.217 12.823 40.738 1.00 41.01 H new ATOM 0 HA LEU A 23 22.007 11.307 38.340 1.00 53.04 H new ATOM 0 HB2 LEU A 23 19.696 11.234 39.467 1.00 33.20 H new ATOM 0 HB3 LEU A 23 19.486 12.874 38.886 1.00 33.20 H new ATOM 0 HG LEU A 23 18.352 11.232 37.482 1.00 24.53 H new ATOM 0 HD11 LEU A 23 19.157 11.917 35.270 1.00 11.12 H new ATOM 0 HD12 LEU A 23 19.029 13.277 36.411 1.00 11.12 H new ATOM 0 HD13 LEU A 23 20.623 12.586 36.025 1.00 11.12 H new ATOM 0 HD21 LEU A 23 19.660 9.676 36.043 1.00 50.23 H new ATOM 0 HD22 LEU A 23 21.145 10.174 36.888 1.00 50.23 H new ATOM 0 HD23 LEU A 23 19.859 9.322 37.775 1.00 50.23 H new ATOM 342 N LYS A 24 23.010 13.327 37.329 1.00 73.13 N ATOM 343 CA LYS A 24 23.514 14.444 36.569 1.00 40.44 C ATOM 344 C LYS A 24 23.096 14.280 35.124 1.00 30.22 C ATOM 345 O LYS A 24 23.143 13.167 34.571 1.00 10.11 O ATOM 346 CB LYS A 24 25.064 14.627 36.702 1.00 53.23 C ATOM 347 CG LYS A 24 25.982 13.581 36.010 1.00 52.22 C ATOM 348 CD LYS A 24 25.841 12.170 36.576 1.00 32.13 C ATOM 349 CE LYS A 24 26.838 11.213 35.936 1.00 24.05 C ATOM 350 NZ LYS A 24 26.685 9.835 36.444 1.00 51.43 N ATOM 0 H LYS A 24 23.550 12.468 37.226 1.00 73.13 H new ATOM 0 HA LYS A 24 23.081 15.357 36.978 1.00 40.44 H new ATOM 0 HB2 LYS A 24 25.320 15.610 36.306 1.00 53.23 H new ATOM 0 HB3 LYS A 24 25.310 14.637 37.764 1.00 53.23 H new ATOM 0 HG2 LYS A 24 25.754 13.560 34.944 1.00 52.22 H new ATOM 0 HG3 LYS A 24 27.020 13.900 36.108 1.00 52.22 H new ATOM 0 HD2 LYS A 24 25.996 12.192 37.655 1.00 32.13 H new ATOM 0 HD3 LYS A 24 24.827 11.808 36.407 1.00 32.13 H new ATOM 0 HE2 LYS A 24 26.703 11.218 34.854 1.00 24.05 H new ATOM 0 HE3 LYS A 24 27.852 11.561 36.132 1.00 24.05 H new ATOM 0 HZ1 LYS A 24 27.382 9.216 35.983 1.00 51.43 H new ATOM 0 HZ2 LYS A 24 26.839 9.825 37.472 1.00 51.43 H new ATOM 0 HZ3 LYS A 24 25.726 9.492 36.235 1.00 51.43 H new ATOM 364 N GLU A 25 22.644 15.335 34.533 1.00 52.14 N ATOM 365 CA GLU A 25 22.220 15.290 33.167 1.00 74.43 C ATOM 366 C GLU A 25 23.211 15.991 32.274 1.00 62.22 C ATOM 367 O GLU A 25 23.926 16.893 32.705 1.00 23.34 O ATOM 368 CB GLU A 25 20.837 15.903 32.991 1.00 72.21 C ATOM 369 CG GLU A 25 19.741 15.193 33.751 1.00 25.21 C ATOM 370 CD GLU A 25 18.390 15.754 33.440 1.00 61.34 C ATOM 371 OE1 GLU A 25 17.748 15.279 32.492 1.00 61.34 O ATOM 372 OE2 GLU A 25 17.937 16.689 34.127 1.00 2.15 O ATOM 0 H GLU A 25 22.557 16.249 34.977 1.00 52.14 H new ATOM 0 HA GLU A 25 22.166 14.240 32.879 1.00 74.43 H new ATOM 0 HB2 GLU A 25 20.870 16.944 33.312 1.00 72.21 H new ATOM 0 HB3 GLU A 25 20.585 15.905 31.930 1.00 72.21 H new ATOM 0 HG2 GLU A 25 19.758 14.131 33.505 1.00 25.21 H new ATOM 0 HG3 GLU A 25 19.930 15.275 34.821 1.00 25.21 H new ATOM 379 N MET A 26 23.259 15.542 31.062 1.00 4.42 N ATOM 380 CA MET A 26 24.067 16.107 30.022 1.00 63.14 C ATOM 381 C MET A 26 23.347 15.828 28.722 1.00 54.34 C ATOM 382 O MET A 26 22.799 14.728 28.548 1.00 53.34 O ATOM 383 CB MET A 26 25.495 15.500 30.017 1.00 64.31 C ATOM 384 CG MET A 26 25.548 13.978 29.880 1.00 11.34 C ATOM 385 SD MET A 26 27.237 13.309 29.850 1.00 15.24 S ATOM 386 CE MET A 26 27.853 13.827 31.456 1.00 22.14 C ATOM 0 H MET A 26 22.714 14.737 30.753 1.00 4.42 H new ATOM 0 HA MET A 26 24.199 17.178 30.174 1.00 63.14 H new ATOM 0 HB2 MET A 26 26.060 15.944 29.197 1.00 64.31 H new ATOM 0 HB3 MET A 26 25.998 15.785 30.941 1.00 64.31 H new ATOM 0 HG2 MET A 26 25.002 13.528 30.709 1.00 11.34 H new ATOM 0 HG3 MET A 26 25.034 13.686 28.964 1.00 11.34 H new ATOM 0 HE1 MET A 26 28.742 13.249 31.708 1.00 22.14 H new ATOM 0 HE2 MET A 26 28.106 14.887 31.424 1.00 22.14 H new ATOM 0 HE3 MET A 26 27.085 13.660 32.211 1.00 22.14 H new ATOM 396 N GLU A 27 23.278 16.802 27.850 1.00 72.44 N ATOM 397 CA GLU A 27 22.579 16.635 26.590 1.00 64.10 C ATOM 398 C GLU A 27 23.335 15.749 25.617 1.00 23.14 C ATOM 399 O GLU A 27 24.143 16.209 24.796 1.00 63.43 O ATOM 400 CB GLU A 27 22.169 17.972 25.979 1.00 62.11 C ATOM 401 CG GLU A 27 21.040 18.644 26.740 1.00 34.24 C ATOM 402 CD GLU A 27 19.787 17.784 26.764 1.00 42.10 C ATOM 403 OE1 GLU A 27 19.086 17.722 25.741 1.00 64.20 O ATOM 404 OE2 GLU A 27 19.509 17.125 27.789 1.00 34.31 O ATOM 0 H GLU A 27 23.696 17.722 27.985 1.00 72.44 H new ATOM 0 HA GLU A 27 21.653 16.105 26.815 1.00 64.10 H new ATOM 0 HB2 GLU A 27 23.033 18.637 25.957 1.00 62.11 H new ATOM 0 HB3 GLU A 27 21.861 17.815 24.945 1.00 62.11 H new ATOM 0 HG2 GLU A 27 21.361 18.848 27.762 1.00 34.24 H new ATOM 0 HG3 GLU A 27 20.813 19.605 26.279 1.00 34.24 H new ATOM 411 N SER A 28 23.082 14.480 25.747 1.00 24.54 N ATOM 412 CA SER A 28 23.725 13.474 24.980 1.00 72.53 C ATOM 413 C SER A 28 22.679 12.765 24.120 1.00 65.12 C ATOM 414 O SER A 28 21.664 12.264 24.636 1.00 50.54 O ATOM 415 CB SER A 28 24.404 12.486 25.950 1.00 51.43 C ATOM 416 OG SER A 28 25.248 11.560 25.285 1.00 74.00 O ATOM 0 H SER A 28 22.401 14.114 26.412 1.00 24.54 H new ATOM 0 HA SER A 28 24.481 13.903 24.322 1.00 72.53 H new ATOM 0 HB2 SER A 28 24.989 13.045 26.681 1.00 51.43 H new ATOM 0 HB3 SER A 28 23.638 11.942 26.503 1.00 51.43 H new ATOM 0 HG SER A 28 25.655 10.958 25.942 1.00 74.00 H new ATOM 422 N SER A 29 22.885 12.776 22.835 1.00 74.13 N ATOM 423 CA SER A 29 22.013 12.104 21.917 1.00 71.22 C ATOM 424 C SER A 29 22.834 11.049 21.193 1.00 54.31 C ATOM 425 O SER A 29 23.655 11.366 20.329 1.00 12.41 O ATOM 426 CB SER A 29 21.384 13.107 20.927 1.00 12.24 C ATOM 427 OG SER A 29 20.396 12.492 20.095 1.00 33.14 O ATOM 0 H SER A 29 23.669 13.255 22.392 1.00 74.13 H new ATOM 0 HA SER A 29 21.188 11.631 22.449 1.00 71.22 H new ATOM 0 HB2 SER A 29 20.930 13.928 21.482 1.00 12.24 H new ATOM 0 HB3 SER A 29 22.166 13.539 20.302 1.00 12.24 H new ATOM 0 HG SER A 29 20.021 13.160 19.484 1.00 33.14 H new ATOM 433 N THR A 30 22.655 9.825 21.586 1.00 3.40 N ATOM 434 CA THR A 30 23.398 8.736 21.035 1.00 53.30 C ATOM 435 C THR A 30 22.553 7.972 20.019 1.00 74.32 C ATOM 436 O THR A 30 21.540 7.346 20.366 1.00 22.32 O ATOM 437 CB THR A 30 23.899 7.798 22.159 1.00 3.31 C ATOM 438 OG1 THR A 30 22.804 7.452 23.039 1.00 24.33 O ATOM 439 CG2 THR A 30 25.003 8.464 22.966 1.00 44.22 C ATOM 0 H THR A 30 21.984 9.553 22.304 1.00 3.40 H new ATOM 0 HA THR A 30 24.269 9.136 20.516 1.00 53.30 H new ATOM 0 HB THR A 30 24.297 6.895 21.696 1.00 3.31 H new ATOM 0 HG1 THR A 30 21.996 7.292 22.508 1.00 24.33 H new ATOM 0 HG21 THR A 30 25.340 7.786 23.750 1.00 44.22 H new ATOM 0 HG22 THR A 30 25.840 8.704 22.310 1.00 44.22 H new ATOM 0 HG23 THR A 30 24.622 9.380 23.417 1.00 44.22 H new ATOM 447 N GLY A 31 22.935 8.062 18.775 1.00 60.25 N ATOM 448 CA GLY A 31 22.213 7.392 17.739 1.00 1.45 C ATOM 449 C GLY A 31 23.063 6.361 17.061 1.00 31.10 C ATOM 450 O GLY A 31 24.079 6.695 16.450 1.00 61.15 O ATOM 0 H GLY A 31 23.745 8.595 18.458 1.00 60.25 H new ATOM 0 HA2 GLY A 31 21.327 6.916 18.160 1.00 1.45 H new ATOM 0 HA3 GLY A 31 21.866 8.120 17.005 1.00 1.45 H new ATOM 454 N THR A 32 22.692 5.126 17.200 1.00 71.10 N ATOM 455 CA THR A 32 23.402 4.052 16.578 1.00 52.23 C ATOM 456 C THR A 32 22.506 3.465 15.477 1.00 0.13 C ATOM 457 O THR A 32 21.292 3.731 15.454 1.00 23.05 O ATOM 458 CB THR A 32 23.826 2.966 17.630 1.00 31.43 C ATOM 459 OG1 THR A 32 24.727 1.999 17.054 1.00 53.15 O ATOM 460 CG2 THR A 32 22.617 2.242 18.214 1.00 63.14 C ATOM 0 H THR A 32 21.885 4.833 17.750 1.00 71.10 H new ATOM 0 HA THR A 32 24.327 4.420 16.135 1.00 52.23 H new ATOM 0 HB THR A 32 24.338 3.497 18.433 1.00 31.43 H new ATOM 0 HG1 THR A 32 24.974 1.337 17.733 1.00 53.15 H new ATOM 0 HG21 THR A 32 22.952 1.499 18.937 1.00 63.14 H new ATOM 0 HG22 THR A 32 21.966 2.962 18.709 1.00 63.14 H new ATOM 0 HG23 THR A 32 22.068 1.747 17.413 1.00 63.14 H new ATOM 468 N ALA A 33 23.082 2.713 14.576 1.00 24.22 N ATOM 469 CA ALA A 33 22.338 2.118 13.493 1.00 71.12 C ATOM 470 C ALA A 33 21.716 0.799 13.941 1.00 5.15 C ATOM 471 O ALA A 33 22.437 -0.143 14.323 1.00 23.34 O ATOM 472 CB ALA A 33 23.235 1.909 12.284 1.00 65.40 C ATOM 0 H ALA A 33 24.078 2.495 14.571 1.00 24.22 H new ATOM 0 HA ALA A 33 21.534 2.796 13.206 1.00 71.12 H new ATOM 0 HB1 ALA A 33 22.658 1.459 11.476 1.00 65.40 H new ATOM 0 HB2 ALA A 33 23.632 2.869 11.955 1.00 65.40 H new ATOM 0 HB3 ALA A 33 24.059 1.248 12.552 1.00 65.40 H new ATOM 478 N PRO A 34 20.380 0.709 13.923 1.00 50.14 N ATOM 479 CA PRO A 34 19.678 -0.493 14.336 1.00 41.04 C ATOM 480 C PRO A 34 19.799 -1.601 13.292 1.00 3.25 C ATOM 481 O PRO A 34 19.853 -1.334 12.081 1.00 31.32 O ATOM 482 CB PRO A 34 18.221 -0.034 14.471 1.00 3.12 C ATOM 483 CG PRO A 34 18.091 1.118 13.534 1.00 54.25 C ATOM 484 CD PRO A 34 19.446 1.778 13.483 1.00 1.41 C ATOM 0 HA PRO A 34 20.083 -0.913 15.257 1.00 41.04 H new ATOM 0 HB2 PRO A 34 17.529 -0.835 14.210 1.00 3.12 H new ATOM 0 HB3 PRO A 34 17.994 0.263 15.495 1.00 3.12 H new ATOM 0 HG2 PRO A 34 17.785 0.781 12.544 1.00 54.25 H new ATOM 0 HG3 PRO A 34 17.331 1.818 13.881 1.00 54.25 H new ATOM 0 HD2 PRO A 34 19.683 2.127 12.478 1.00 1.41 H new ATOM 0 HD3 PRO A 34 19.493 2.646 14.141 1.00 1.41 H new ATOM 492 N ALA A 35 19.868 -2.827 13.738 1.00 11.11 N ATOM 493 CA ALA A 35 19.961 -3.933 12.830 1.00 70.45 C ATOM 494 C ALA A 35 18.571 -4.424 12.477 1.00 61.42 C ATOM 495 O ALA A 35 17.998 -5.267 13.162 1.00 31.35 O ATOM 496 CB ALA A 35 20.819 -5.052 13.398 1.00 74.20 C ATOM 0 H ALA A 35 19.861 -3.083 14.725 1.00 11.11 H new ATOM 0 HA ALA A 35 20.453 -3.593 11.919 1.00 70.45 H new ATOM 0 HB1 ALA A 35 20.867 -5.873 12.683 1.00 74.20 H new ATOM 0 HB2 ALA A 35 21.825 -4.678 13.589 1.00 74.20 H new ATOM 0 HB3 ALA A 35 20.381 -5.408 14.331 1.00 74.20 H new ATOM 502 N SER A 36 18.006 -3.832 11.459 1.00 72.11 N ATOM 503 CA SER A 36 16.682 -4.183 10.990 1.00 2.45 C ATOM 504 C SER A 36 16.784 -5.145 9.802 1.00 33.22 C ATOM 505 O SER A 36 15.832 -5.339 9.030 1.00 73.32 O ATOM 506 CB SER A 36 15.958 -2.901 10.606 1.00 31.22 C ATOM 507 OG SER A 36 15.970 -1.999 11.710 1.00 21.35 O ATOM 0 H SER A 36 18.451 -3.086 10.924 1.00 72.11 H new ATOM 0 HA SER A 36 16.120 -4.692 11.773 1.00 2.45 H new ATOM 0 HB2 SER A 36 16.441 -2.443 9.743 1.00 31.22 H new ATOM 0 HB3 SER A 36 14.931 -3.124 10.316 1.00 31.22 H new ATOM 0 HG SER A 36 15.505 -1.173 11.462 1.00 21.35 H new ATOM 513 N THR A 37 17.925 -5.753 9.688 1.00 62.32 N ATOM 514 CA THR A 37 18.218 -6.686 8.660 1.00 34.14 C ATOM 515 C THR A 37 17.932 -8.113 9.137 1.00 22.22 C ATOM 516 O THR A 37 17.974 -8.397 10.346 1.00 61.42 O ATOM 517 CB THR A 37 19.688 -6.523 8.276 1.00 1.21 C ATOM 518 OG1 THR A 37 20.456 -6.302 9.474 1.00 2.14 O ATOM 519 CG2 THR A 37 19.875 -5.349 7.339 1.00 33.21 C ATOM 0 H THR A 37 18.700 -5.603 10.334 1.00 62.32 H new ATOM 0 HA THR A 37 17.588 -6.500 7.790 1.00 34.14 H new ATOM 0 HB THR A 37 20.023 -7.426 7.766 1.00 1.21 H new ATOM 0 HG1 THR A 37 21.402 -6.197 9.241 1.00 2.14 H new ATOM 0 HG21 THR A 37 20.930 -5.254 7.081 1.00 33.21 H new ATOM 0 HG22 THR A 37 19.292 -5.511 6.432 1.00 33.21 H new ATOM 0 HG23 THR A 37 19.538 -4.435 7.829 1.00 33.21 H new ATOM 527 N GLY A 38 17.621 -8.989 8.213 1.00 0.11 N ATOM 528 CA GLY A 38 17.341 -10.359 8.563 1.00 31.23 C ATOM 529 C GLY A 38 15.911 -10.743 8.270 1.00 70.02 C ATOM 530 O GLY A 38 15.541 -11.914 8.349 1.00 1.33 O ATOM 0 H GLY A 38 17.556 -8.779 7.217 1.00 0.11 H new ATOM 0 HA2 GLY A 38 18.012 -11.017 8.011 1.00 31.23 H new ATOM 0 HA3 GLY A 38 17.546 -10.510 9.623 1.00 31.23 H new ATOM 534 N ALA A 39 15.095 -9.763 7.931 1.00 14.54 N ATOM 535 CA ALA A 39 13.695 -10.009 7.610 1.00 20.32 C ATOM 536 C ALA A 39 13.577 -10.640 6.228 1.00 74.15 C ATOM 537 O ALA A 39 12.685 -11.425 5.965 1.00 5.14 O ATOM 538 CB ALA A 39 12.884 -8.722 7.698 1.00 2.11 C ATOM 0 H ALA A 39 15.375 -8.784 7.870 1.00 14.54 H new ATOM 0 HA ALA A 39 13.287 -10.706 8.342 1.00 20.32 H new ATOM 0 HB1 ALA A 39 11.842 -8.931 7.454 1.00 2.11 H new ATOM 0 HB2 ALA A 39 12.946 -8.321 8.710 1.00 2.11 H new ATOM 0 HB3 ALA A 39 13.282 -7.992 6.993 1.00 2.11 H new ATOM 544 N GLU A 40 14.541 -10.325 5.371 1.00 70.55 N ATOM 545 CA GLU A 40 14.622 -10.852 3.997 1.00 63.25 C ATOM 546 C GLU A 40 14.830 -12.383 3.966 1.00 41.40 C ATOM 547 O GLU A 40 14.724 -13.019 2.910 1.00 30.45 O ATOM 548 CB GLU A 40 15.745 -10.150 3.226 1.00 0.40 C ATOM 549 CG GLU A 40 17.089 -10.183 3.933 1.00 32.31 C ATOM 550 CD GLU A 40 18.196 -9.601 3.098 1.00 75.35 C ATOM 551 OE1 GLU A 40 18.368 -8.364 3.074 1.00 73.32 O ATOM 552 OE2 GLU A 40 18.924 -10.375 2.453 1.00 4.12 O ATOM 0 H GLU A 40 15.303 -9.689 5.606 1.00 70.55 H new ATOM 0 HA GLU A 40 13.666 -10.646 3.516 1.00 63.25 H new ATOM 0 HB2 GLU A 40 15.849 -10.618 2.247 1.00 0.40 H new ATOM 0 HB3 GLU A 40 15.461 -9.112 3.054 1.00 0.40 H new ATOM 0 HG2 GLU A 40 17.016 -9.630 4.870 1.00 32.31 H new ATOM 0 HG3 GLU A 40 17.335 -11.213 4.189 1.00 32.31 H new ATOM 559 N ASN A 41 15.139 -12.951 5.114 1.00 12.34 N ATOM 560 CA ASN A 41 15.382 -14.377 5.248 1.00 42.05 C ATOM 561 C ASN A 41 14.105 -15.202 5.215 1.00 24.41 C ATOM 562 O ASN A 41 14.167 -16.424 5.093 1.00 5.40 O ATOM 563 CB ASN A 41 16.194 -14.702 6.506 1.00 62.24 C ATOM 564 CG ASN A 41 17.651 -14.276 6.402 1.00 10.24 C ATOM 565 OD1 ASN A 41 18.020 -13.154 6.765 1.00 3.23 O ATOM 566 ND2 ASN A 41 18.493 -15.164 5.935 1.00 74.11 N ATOM 0 H ASN A 41 15.230 -12.434 5.988 1.00 12.34 H new ATOM 0 HA ASN A 41 15.971 -14.657 4.375 1.00 42.05 H new ATOM 0 HB2 ASN A 41 15.737 -14.208 7.364 1.00 62.24 H new ATOM 0 HB3 ASN A 41 16.148 -15.775 6.694 1.00 62.24 H new ATOM 0 HD21 ASN A 41 19.485 -14.938 5.863 1.00 74.11 H new ATOM 0 HD22 ASN A 41 18.157 -16.082 5.644 1.00 74.11 H new ATOM 573 N LEU A 42 12.952 -14.546 5.359 1.00 51.41 N ATOM 574 CA LEU A 42 11.661 -15.227 5.337 1.00 1.14 C ATOM 575 C LEU A 42 11.429 -15.974 3.998 1.00 12.30 C ATOM 576 O LEU A 42 11.966 -15.564 2.959 1.00 3.40 O ATOM 577 CB LEU A 42 10.509 -14.227 5.669 1.00 12.34 C ATOM 578 CG LEU A 42 10.273 -12.996 4.744 1.00 62.13 C ATOM 579 CD1 LEU A 42 9.638 -13.368 3.404 1.00 0.41 C ATOM 580 CD2 LEU A 42 9.419 -11.968 5.454 1.00 64.32 C ATOM 0 H LEU A 42 12.889 -13.537 5.493 1.00 51.41 H new ATOM 0 HA LEU A 42 11.665 -15.991 6.114 1.00 1.14 H new ATOM 0 HB2 LEU A 42 9.580 -14.797 5.698 1.00 12.34 H new ATOM 0 HB3 LEU A 42 10.684 -13.850 6.677 1.00 12.34 H new ATOM 0 HG LEU A 42 11.254 -12.576 4.523 1.00 62.13 H new ATOM 0 HD11 LEU A 42 9.499 -12.468 2.805 1.00 0.41 H new ATOM 0 HD12 LEU A 42 10.290 -14.061 2.872 1.00 0.41 H new ATOM 0 HD13 LEU A 42 8.671 -13.841 3.578 1.00 0.41 H new ATOM 0 HD21 LEU A 42 9.260 -11.112 4.799 1.00 64.32 H new ATOM 0 HD22 LEU A 42 8.457 -12.410 5.713 1.00 64.32 H new ATOM 0 HD23 LEU A 42 9.924 -11.641 6.363 1.00 64.32 H new ATOM 592 N PRO A 43 10.671 -17.095 4.001 1.00 15.24 N ATOM 593 CA PRO A 43 10.397 -17.857 2.775 1.00 5.01 C ATOM 594 C PRO A 43 9.505 -17.083 1.787 1.00 62.25 C ATOM 595 O PRO A 43 10.000 -16.543 0.791 1.00 2.13 O ATOM 596 CB PRO A 43 9.695 -19.142 3.271 1.00 75.32 C ATOM 597 CG PRO A 43 9.925 -19.169 4.748 1.00 13.44 C ATOM 598 CD PRO A 43 10.056 -17.735 5.180 1.00 53.41 C ATOM 0 HA PRO A 43 11.312 -18.062 2.220 1.00 5.01 H new ATOM 0 HB2 PRO A 43 8.630 -19.124 3.039 1.00 75.32 H new ATOM 0 HB3 PRO A 43 10.111 -20.028 2.791 1.00 75.32 H new ATOM 0 HG2 PRO A 43 9.096 -19.656 5.262 1.00 13.44 H new ATOM 0 HG3 PRO A 43 10.826 -19.732 4.991 1.00 13.44 H new ATOM 0 HD2 PRO A 43 9.088 -17.295 5.421 1.00 53.41 H new ATOM 0 HD3 PRO A 43 10.681 -17.635 6.067 1.00 53.41 H new ATOM 606 N ALA A 44 8.205 -17.006 2.091 1.00 34.42 N ATOM 607 CA ALA A 44 7.230 -16.308 1.268 1.00 33.10 C ATOM 608 C ALA A 44 5.918 -16.237 2.022 1.00 41.31 C ATOM 609 O ALA A 44 5.747 -16.927 3.041 1.00 71.30 O ATOM 610 CB ALA A 44 7.024 -17.014 -0.071 1.00 61.55 C ATOM 0 H ALA A 44 7.803 -17.433 2.925 1.00 34.42 H new ATOM 0 HA ALA A 44 7.600 -15.305 1.058 1.00 33.10 H new ATOM 0 HB1 ALA A 44 6.289 -16.467 -0.662 1.00 61.55 H new ATOM 0 HB2 ALA A 44 7.970 -17.051 -0.612 1.00 61.55 H new ATOM 0 HB3 ALA A 44 6.666 -18.028 0.104 1.00 61.55 H new ATOM 616 N GLY A 45 5.009 -15.430 1.536 1.00 33.44 N ATOM 617 CA GLY A 45 3.731 -15.252 2.181 1.00 64.31 C ATOM 618 C GLY A 45 3.357 -13.806 2.168 1.00 10.14 C ATOM 619 O GLY A 45 3.145 -13.191 3.218 1.00 53.02 O ATOM 0 H GLY A 45 5.132 -14.880 0.686 1.00 33.44 H new ATOM 0 HA2 GLY A 45 2.969 -15.839 1.668 1.00 64.31 H new ATOM 0 HA3 GLY A 45 3.777 -15.616 3.207 1.00 64.31 H new ATOM 623 N SER A 46 3.268 -13.274 0.989 1.00 24.24 N ATOM 624 CA SER A 46 3.050 -11.878 0.785 1.00 63.32 C ATOM 625 C SER A 46 1.572 -11.533 0.681 1.00 51.42 C ATOM 626 O SER A 46 0.716 -12.399 0.466 1.00 55.31 O ATOM 627 CB SER A 46 3.765 -11.460 -0.489 1.00 11.30 C ATOM 628 OG SER A 46 5.149 -11.765 -0.412 1.00 1.14 O ATOM 0 H SER A 46 3.347 -13.810 0.125 1.00 24.24 H new ATOM 0 HA SER A 46 3.443 -11.340 1.648 1.00 63.32 H new ATOM 0 HB2 SER A 46 3.322 -11.970 -1.344 1.00 11.30 H new ATOM 0 HB3 SER A 46 3.632 -10.391 -0.652 1.00 11.30 H new ATOM 0 HG SER A 46 5.665 -10.933 -0.362 1.00 1.14 H new ATOM 634 N ALA A 47 1.297 -10.266 0.832 1.00 3.43 N ATOM 635 CA ALA A 47 -0.021 -9.718 0.702 1.00 45.01 C ATOM 636 C ALA A 47 0.068 -8.584 -0.299 1.00 21.40 C ATOM 637 O ALA A 47 1.182 -8.138 -0.599 1.00 71.24 O ATOM 638 CB ALA A 47 -0.518 -9.242 2.043 1.00 3.42 C ATOM 0 H ALA A 47 2.006 -9.568 1.055 1.00 3.43 H new ATOM 0 HA ALA A 47 -0.732 -10.466 0.351 1.00 45.01 H new ATOM 0 HB1 ALA A 47 -1.520 -8.827 1.933 1.00 3.42 H new ATOM 0 HB2 ALA A 47 -0.546 -10.080 2.739 1.00 3.42 H new ATOM 0 HB3 ALA A 47 0.152 -8.474 2.428 1.00 3.42 H new ATOM 644 N LEU A 48 -1.043 -8.101 -0.803 1.00 25.34 N ATOM 645 CA LEU A 48 -0.991 -7.111 -1.859 1.00 51.11 C ATOM 646 C LEU A 48 -1.853 -5.903 -1.581 1.00 25.33 C ATOM 647 O LEU A 48 -2.873 -5.989 -0.902 1.00 71.35 O ATOM 648 CB LEU A 48 -1.288 -7.751 -3.253 1.00 54.23 C ATOM 649 CG LEU A 48 -2.635 -8.497 -3.463 1.00 51.35 C ATOM 650 CD1 LEU A 48 -3.820 -7.546 -3.609 1.00 74.21 C ATOM 651 CD2 LEU A 48 -2.543 -9.426 -4.661 1.00 55.10 C ATOM 0 H LEU A 48 -1.981 -8.370 -0.507 1.00 25.34 H new ATOM 0 HA LEU A 48 0.032 -6.735 -1.886 1.00 51.11 H new ATOM 0 HB2 LEU A 48 -1.230 -6.958 -3.999 1.00 54.23 H new ATOM 0 HB3 LEU A 48 -0.484 -8.454 -3.471 1.00 54.23 H new ATOM 0 HG LEU A 48 -2.816 -9.086 -2.564 1.00 51.35 H new ATOM 0 HD11 LEU A 48 -4.734 -8.123 -3.753 1.00 74.21 H new ATOM 0 HD12 LEU A 48 -3.912 -6.939 -2.708 1.00 74.21 H new ATOM 0 HD13 LEU A 48 -3.661 -6.896 -4.470 1.00 74.21 H new ATOM 0 HD21 LEU A 48 -3.494 -9.942 -4.796 1.00 55.10 H new ATOM 0 HD22 LEU A 48 -2.315 -8.845 -5.555 1.00 55.10 H new ATOM 0 HD23 LEU A 48 -1.754 -10.159 -4.493 1.00 55.10 H new ATOM 663 N LEU A 49 -1.444 -4.791 -2.104 1.00 10.14 N ATOM 664 CA LEU A 49 -2.185 -3.582 -1.955 1.00 71.00 C ATOM 665 C LEU A 49 -2.596 -3.065 -3.311 1.00 12.02 C ATOM 666 O LEU A 49 -1.892 -3.283 -4.301 1.00 62.30 O ATOM 667 CB LEU A 49 -1.402 -2.531 -1.121 1.00 34.20 C ATOM 668 CG LEU A 49 -0.006 -2.081 -1.608 1.00 53.04 C ATOM 669 CD1 LEU A 49 -0.096 -1.082 -2.755 1.00 64.14 C ATOM 670 CD2 LEU A 49 0.801 -1.504 -0.454 1.00 25.20 C ATOM 0 H LEU A 49 -0.586 -4.697 -2.647 1.00 10.14 H new ATOM 0 HA LEU A 49 -3.094 -3.789 -1.390 1.00 71.00 H new ATOM 0 HB2 LEU A 49 -2.026 -1.641 -1.042 1.00 34.20 H new ATOM 0 HB3 LEU A 49 -1.287 -2.930 -0.113 1.00 34.20 H new ATOM 0 HG LEU A 49 0.507 -2.964 -1.989 1.00 53.04 H new ATOM 0 HD11 LEU A 49 0.908 -0.793 -3.065 1.00 64.14 H new ATOM 0 HD12 LEU A 49 -0.618 -1.539 -3.595 1.00 64.14 H new ATOM 0 HD13 LEU A 49 -0.642 -0.198 -2.426 1.00 64.14 H new ATOM 0 HD21 LEU A 49 1.781 -1.192 -0.815 1.00 25.20 H new ATOM 0 HD22 LEU A 49 0.277 -0.643 -0.038 1.00 25.20 H new ATOM 0 HD23 LEU A 49 0.924 -2.262 0.319 1.00 25.20 H new ATOM 682 N VAL A 50 -3.730 -2.429 -3.361 1.00 53.11 N ATOM 683 CA VAL A 50 -4.254 -1.861 -4.575 1.00 53.04 C ATOM 684 C VAL A 50 -4.525 -0.389 -4.318 1.00 30.23 C ATOM 685 O VAL A 50 -5.216 -0.040 -3.359 1.00 74.33 O ATOM 686 CB VAL A 50 -5.589 -2.551 -5.012 1.00 32.55 C ATOM 687 CG1 VAL A 50 -6.089 -1.995 -6.338 1.00 42.33 C ATOM 688 CG2 VAL A 50 -5.444 -4.069 -5.090 1.00 1.45 C ATOM 0 H VAL A 50 -4.329 -2.287 -2.548 1.00 53.11 H new ATOM 0 HA VAL A 50 -3.527 -2.007 -5.374 1.00 53.04 H new ATOM 0 HB VAL A 50 -6.329 -2.326 -4.244 1.00 32.55 H new ATOM 0 HG11 VAL A 50 -7.018 -2.494 -6.615 1.00 42.33 H new ATOM 0 HG12 VAL A 50 -6.268 -0.924 -6.239 1.00 42.33 H new ATOM 0 HG13 VAL A 50 -5.340 -2.168 -7.111 1.00 42.33 H new ATOM 0 HG21 VAL A 50 -6.393 -4.510 -5.397 1.00 1.45 H new ATOM 0 HG22 VAL A 50 -4.673 -4.324 -5.817 1.00 1.45 H new ATOM 0 HG23 VAL A 50 -5.162 -4.458 -4.112 1.00 1.45 H new ATOM 698 N VAL A 51 -3.977 0.464 -5.128 1.00 72.40 N ATOM 699 CA VAL A 51 -4.206 1.881 -4.974 1.00 23.11 C ATOM 700 C VAL A 51 -5.376 2.273 -5.848 1.00 74.04 C ATOM 701 O VAL A 51 -5.334 2.097 -7.064 1.00 55.14 O ATOM 702 CB VAL A 51 -2.952 2.711 -5.360 1.00 53.52 C ATOM 703 CG1 VAL A 51 -3.181 4.196 -5.118 1.00 12.04 C ATOM 704 CG2 VAL A 51 -1.729 2.234 -4.589 1.00 33.21 C ATOM 0 H VAL A 51 -3.367 0.211 -5.905 1.00 72.40 H new ATOM 0 HA VAL A 51 -4.422 2.092 -3.927 1.00 23.11 H new ATOM 0 HB VAL A 51 -2.772 2.562 -6.425 1.00 53.52 H new ATOM 0 HG11 VAL A 51 -2.286 4.752 -5.397 1.00 12.04 H new ATOM 0 HG12 VAL A 51 -4.023 4.537 -5.720 1.00 12.04 H new ATOM 0 HG13 VAL A 51 -3.398 4.364 -4.063 1.00 12.04 H new ATOM 0 HG21 VAL A 51 -0.863 2.830 -4.876 1.00 33.21 H new ATOM 0 HG22 VAL A 51 -1.907 2.344 -3.519 1.00 33.21 H new ATOM 0 HG23 VAL A 51 -1.540 1.185 -4.819 1.00 33.21 H new ATOM 714 N LYS A 52 -6.431 2.761 -5.222 1.00 22.43 N ATOM 715 CA LYS A 52 -7.635 3.145 -5.939 1.00 71.54 C ATOM 716 C LYS A 52 -7.487 4.549 -6.486 1.00 33.02 C ATOM 717 O LYS A 52 -7.998 4.877 -7.563 1.00 51.12 O ATOM 718 CB LYS A 52 -8.852 3.050 -5.025 1.00 44.15 C ATOM 719 CG LYS A 52 -9.168 1.641 -4.565 1.00 55.23 C ATOM 720 CD LYS A 52 -10.357 1.630 -3.622 1.00 64.24 C ATOM 721 CE LYS A 52 -10.797 0.213 -3.291 1.00 73.32 C ATOM 722 NZ LYS A 52 -11.263 -0.516 -4.495 1.00 53.52 N ATOM 0 H LYS A 52 -6.479 2.902 -4.213 1.00 22.43 H new ATOM 0 HA LYS A 52 -7.781 2.460 -6.774 1.00 71.54 H new ATOM 0 HB2 LYS A 52 -8.687 3.678 -4.150 1.00 44.15 H new ATOM 0 HB3 LYS A 52 -9.719 3.454 -5.548 1.00 44.15 H new ATOM 0 HG2 LYS A 52 -9.379 1.011 -5.429 1.00 55.23 H new ATOM 0 HG3 LYS A 52 -8.299 1.214 -4.065 1.00 55.23 H new ATOM 0 HD2 LYS A 52 -10.098 2.155 -2.703 1.00 64.24 H new ATOM 0 HD3 LYS A 52 -11.187 2.172 -4.076 1.00 64.24 H new ATOM 0 HE2 LYS A 52 -9.967 -0.328 -2.837 1.00 73.32 H new ATOM 0 HE3 LYS A 52 -11.598 0.245 -2.553 1.00 73.32 H new ATOM 0 HZ1 LYS A 52 -11.841 -1.330 -4.206 1.00 53.52 H new ATOM 0 HZ2 LYS A 52 -11.833 0.121 -5.087 1.00 53.52 H new ATOM 0 HZ3 LYS A 52 -10.441 -0.851 -5.038 1.00 53.52 H new ATOM 736 N ARG A 53 -6.791 5.366 -5.743 1.00 41.24 N ATOM 737 CA ARG A 53 -6.490 6.713 -6.156 1.00 42.04 C ATOM 738 C ARG A 53 -5.253 7.169 -5.448 1.00 34.22 C ATOM 739 O ARG A 53 -5.174 7.086 -4.225 1.00 74.52 O ATOM 740 CB ARG A 53 -7.645 7.706 -5.903 1.00 12.23 C ATOM 741 CG ARG A 53 -7.293 9.098 -6.402 1.00 11.43 C ATOM 742 CD ARG A 53 -8.374 10.135 -6.185 1.00 63.42 C ATOM 743 NE ARG A 53 -7.915 11.439 -6.682 1.00 51.31 N ATOM 744 CZ ARG A 53 -8.527 12.613 -6.530 1.00 34.25 C ATOM 745 NH1 ARG A 53 -9.749 12.686 -5.985 1.00 72.22 N ATOM 746 NH2 ARG A 53 -7.920 13.715 -6.956 1.00 42.12 N ATOM 0 H ARG A 53 -6.414 5.116 -4.829 1.00 41.24 H new ATOM 0 HA ARG A 53 -6.338 6.698 -7.235 1.00 42.04 H new ATOM 0 HB2 ARG A 53 -8.547 7.354 -6.404 1.00 12.23 H new ATOM 0 HB3 ARG A 53 -7.868 7.745 -4.837 1.00 12.23 H new ATOM 0 HG2 ARG A 53 -6.383 9.430 -5.902 1.00 11.43 H new ATOM 0 HG3 ARG A 53 -7.069 9.042 -7.467 1.00 11.43 H new ATOM 0 HD2 ARG A 53 -9.286 9.838 -6.703 1.00 63.42 H new ATOM 0 HD3 ARG A 53 -8.618 10.204 -5.125 1.00 63.42 H new ATOM 0 HE ARG A 53 -7.035 11.447 -7.198 1.00 51.31 H new ATOM 0 HH11 ARG A 53 -10.223 11.836 -5.680 1.00 72.22 H new ATOM 0 HH12 ARG A 53 -10.205 13.592 -5.875 1.00 72.22 H new ATOM 0 HH21 ARG A 53 -7.000 13.654 -7.392 1.00 42.12 H new ATOM 0 HH22 ARG A 53 -8.374 14.622 -6.848 1.00 42.12 H new ATOM 760 N GLY A 54 -4.294 7.613 -6.201 1.00 52.35 N ATOM 761 CA GLY A 54 -3.074 8.062 -5.642 1.00 55.44 C ATOM 762 C GLY A 54 -1.941 7.965 -6.630 1.00 74.20 C ATOM 763 O GLY A 54 -1.492 6.854 -6.940 1.00 52.42 O ATOM 0 H GLY A 54 -4.343 7.671 -7.218 1.00 52.35 H new ATOM 0 HA2 GLY A 54 -3.183 9.095 -5.313 1.00 55.44 H new ATOM 0 HA3 GLY A 54 -2.838 7.469 -4.758 1.00 55.44 H new ATOM 767 N PRO A 55 -1.431 9.126 -7.132 1.00 61.14 N ATOM 768 CA PRO A 55 -0.282 9.203 -8.085 1.00 13.41 C ATOM 769 C PRO A 55 1.000 8.560 -7.527 1.00 21.11 C ATOM 770 O PRO A 55 2.017 8.443 -8.220 1.00 33.15 O ATOM 771 CB PRO A 55 -0.079 10.706 -8.279 1.00 4.14 C ATOM 772 CG PRO A 55 -1.402 11.301 -7.966 1.00 21.01 C ATOM 773 CD PRO A 55 -1.964 10.476 -6.853 1.00 34.25 C ATOM 0 HA PRO A 55 -0.490 8.661 -9.007 1.00 13.41 H new ATOM 0 HB2 PRO A 55 0.696 11.091 -7.617 1.00 4.14 H new ATOM 0 HB3 PRO A 55 0.229 10.937 -9.299 1.00 4.14 H new ATOM 0 HG2 PRO A 55 -1.301 12.344 -7.667 1.00 21.01 H new ATOM 0 HG3 PRO A 55 -2.056 11.281 -8.837 1.00 21.01 H new ATOM 0 HD2 PRO A 55 -1.643 10.842 -5.878 1.00 34.25 H new ATOM 0 HD3 PRO A 55 -3.054 10.487 -6.854 1.00 34.25 H new ATOM 781 N ASN A 56 0.939 8.209 -6.251 1.00 51.31 N ATOM 782 CA ASN A 56 1.978 7.477 -5.527 1.00 60.20 C ATOM 783 C ASN A 56 2.341 6.196 -6.314 1.00 71.42 C ATOM 784 O ASN A 56 3.493 5.781 -6.369 1.00 50.01 O ATOM 785 CB ASN A 56 1.421 7.010 -4.165 1.00 40.45 C ATOM 786 CG ASN A 56 0.830 8.114 -3.302 1.00 23.43 C ATOM 787 OD1 ASN A 56 1.212 9.268 -3.381 1.00 35.25 O ATOM 788 ND2 ASN A 56 -0.087 7.759 -2.454 1.00 10.53 N ATOM 0 H ASN A 56 0.135 8.433 -5.665 1.00 51.31 H new ATOM 0 HA ASN A 56 2.843 8.129 -5.401 1.00 60.20 H new ATOM 0 HB2 ASN A 56 0.653 6.257 -4.342 1.00 40.45 H new ATOM 0 HB3 ASN A 56 2.222 6.524 -3.609 1.00 40.45 H new ATOM 0 HD21 ASN A 56 -0.505 8.453 -1.834 1.00 10.53 H new ATOM 0 HD22 ASN A 56 -0.390 6.786 -2.408 1.00 10.53 H new ATOM 795 N ALA A 57 1.321 5.579 -6.917 1.00 12.51 N ATOM 796 CA ALA A 57 1.497 4.362 -7.693 1.00 53.34 C ATOM 797 C ALA A 57 0.319 4.175 -8.635 1.00 44.13 C ATOM 798 O ALA A 57 0.470 4.214 -9.851 1.00 42.21 O ATOM 799 CB ALA A 57 1.646 3.144 -6.776 1.00 43.21 C ATOM 0 H ALA A 57 0.358 5.912 -6.878 1.00 12.51 H new ATOM 0 HA ALA A 57 2.411 4.455 -8.279 1.00 53.34 H new ATOM 0 HB1 ALA A 57 1.776 2.247 -7.381 1.00 43.21 H new ATOM 0 HB2 ALA A 57 2.516 3.277 -6.133 1.00 43.21 H new ATOM 0 HB3 ALA A 57 0.752 3.040 -6.161 1.00 43.21 H new ATOM 805 N GLY A 58 -0.862 4.000 -8.060 1.00 74.42 N ATOM 806 CA GLY A 58 -2.061 3.808 -8.851 1.00 22.21 C ATOM 807 C GLY A 58 -2.102 2.437 -9.492 1.00 54.44 C ATOM 808 O GLY A 58 -2.604 2.278 -10.596 1.00 60.42 O ATOM 0 H GLY A 58 -1.012 3.988 -7.051 1.00 74.42 H new ATOM 0 HA2 GLY A 58 -2.938 3.939 -8.218 1.00 22.21 H new ATOM 0 HA3 GLY A 58 -2.111 4.573 -9.626 1.00 22.21 H new ATOM 812 N ALA A 59 -1.574 1.458 -8.798 1.00 23.24 N ATOM 813 CA ALA A 59 -1.502 0.107 -9.288 1.00 63.53 C ATOM 814 C ALA A 59 -1.579 -0.830 -8.101 1.00 1.20 C ATOM 815 O ALA A 59 -1.814 -0.370 -6.967 1.00 5.12 O ATOM 816 CB ALA A 59 -0.188 -0.096 -10.041 1.00 52.02 C ATOM 0 H ALA A 59 -1.178 1.581 -7.866 1.00 23.24 H new ATOM 0 HA ALA A 59 -2.325 -0.096 -9.973 1.00 63.53 H new ATOM 0 HB1 ALA A 59 -0.135 -1.120 -10.411 1.00 52.02 H new ATOM 0 HB2 ALA A 59 -0.139 0.597 -10.881 1.00 52.02 H new ATOM 0 HB3 ALA A 59 0.649 0.090 -9.368 1.00 52.02 H new ATOM 822 N ARG A 60 -1.405 -2.108 -8.333 1.00 34.05 N ATOM 823 CA ARG A 60 -1.372 -3.057 -7.255 1.00 62.14 C ATOM 824 C ARG A 60 -0.024 -3.753 -7.269 1.00 43.42 C ATOM 825 O ARG A 60 0.598 -3.877 -8.329 1.00 33.44 O ATOM 826 CB ARG A 60 -2.488 -4.132 -7.372 1.00 42.35 C ATOM 827 CG ARG A 60 -2.163 -5.292 -8.322 1.00 45.24 C ATOM 828 CD ARG A 60 -3.149 -6.438 -8.173 1.00 20.31 C ATOM 829 NE ARG A 60 -2.617 -7.680 -8.757 1.00 32.41 N ATOM 830 CZ ARG A 60 -3.086 -8.923 -8.517 1.00 5.21 C ATOM 831 NH1 ARG A 60 -4.228 -9.103 -7.853 1.00 51.42 N ATOM 832 NH2 ARG A 60 -2.429 -9.976 -8.979 1.00 13.45 N ATOM 0 H ARG A 60 -1.284 -2.512 -9.262 1.00 34.05 H new ATOM 0 HA ARG A 60 -1.536 -2.512 -6.326 1.00 62.14 H new ATOM 0 HB2 ARG A 60 -2.688 -4.538 -6.380 1.00 42.35 H new ATOM 0 HB3 ARG A 60 -3.405 -3.649 -7.710 1.00 42.35 H new ATOM 0 HG2 ARG A 60 -2.176 -4.933 -9.351 1.00 45.24 H new ATOM 0 HG3 ARG A 60 -1.154 -5.653 -8.123 1.00 45.24 H new ATOM 0 HD2 ARG A 60 -3.370 -6.595 -7.117 1.00 20.31 H new ATOM 0 HD3 ARG A 60 -4.089 -6.178 -8.660 1.00 20.31 H new ATOM 0 HE ARG A 60 -1.827 -7.594 -9.397 1.00 32.41 H new ATOM 0 HH11 ARG A 60 -4.757 -8.297 -7.521 1.00 51.42 H new ATOM 0 HH12 ARG A 60 -4.573 -10.047 -7.678 1.00 51.42 H new ATOM 0 HH21 ARG A 60 -1.571 -9.847 -9.515 1.00 13.45 H new ATOM 0 HH22 ARG A 60 -2.781 -10.916 -8.799 1.00 13.45 H new ATOM 846 N PHE A 61 0.440 -4.164 -6.121 1.00 1.23 N ATOM 847 CA PHE A 61 1.635 -4.965 -6.035 1.00 72.24 C ATOM 848 C PHE A 61 1.632 -5.740 -4.743 1.00 13.14 C ATOM 849 O PHE A 61 0.997 -5.314 -3.757 1.00 34.24 O ATOM 850 CB PHE A 61 2.937 -4.137 -6.191 1.00 53.15 C ATOM 851 CG PHE A 61 3.239 -3.142 -5.101 1.00 0.12 C ATOM 852 CD1 PHE A 61 2.736 -1.858 -5.154 1.00 33.22 C ATOM 853 CD2 PHE A 61 4.054 -3.494 -4.032 1.00 42.41 C ATOM 854 CE1 PHE A 61 3.035 -0.946 -4.166 1.00 34.21 C ATOM 855 CE2 PHE A 61 4.352 -2.589 -3.042 1.00 41.41 C ATOM 856 CZ PHE A 61 3.843 -1.313 -3.106 1.00 53.11 C ATOM 0 H PHE A 61 0.005 -3.956 -5.222 1.00 1.23 H new ATOM 0 HA PHE A 61 1.625 -5.659 -6.876 1.00 72.24 H new ATOM 0 HB2 PHE A 61 3.775 -4.830 -6.261 1.00 53.15 H new ATOM 0 HB3 PHE A 61 2.888 -3.600 -7.138 1.00 53.15 H new ATOM 0 HD1 PHE A 61 2.102 -1.565 -5.978 1.00 33.22 H new ATOM 0 HD2 PHE A 61 4.459 -4.494 -3.979 1.00 42.41 H new ATOM 0 HE1 PHE A 61 2.638 0.057 -4.219 1.00 34.21 H new ATOM 0 HE2 PHE A 61 4.984 -2.879 -2.216 1.00 41.41 H new ATOM 0 HZ PHE A 61 4.074 -0.599 -2.329 1.00 53.11 H new ATOM 866 N LEU A 62 2.276 -6.875 -4.748 1.00 14.14 N ATOM 867 CA LEU A 62 2.421 -7.667 -3.568 1.00 62.13 C ATOM 868 C LEU A 62 3.657 -7.220 -2.829 1.00 45.42 C ATOM 869 O LEU A 62 4.652 -6.830 -3.456 1.00 33.53 O ATOM 870 CB LEU A 62 2.396 -9.200 -3.882 1.00 22.13 C ATOM 871 CG LEU A 62 3.457 -9.797 -4.844 1.00 24.14 C ATOM 872 CD1 LEU A 62 4.825 -9.947 -4.187 1.00 32.25 C ATOM 873 CD2 LEU A 62 2.984 -11.131 -5.390 1.00 22.34 C ATOM 0 H LEU A 62 2.715 -7.274 -5.577 1.00 14.14 H new ATOM 0 HA LEU A 62 1.564 -7.510 -2.913 1.00 62.13 H new ATOM 0 HB2 LEU A 62 2.480 -9.730 -2.933 1.00 22.13 H new ATOM 0 HB3 LEU A 62 1.414 -9.434 -4.292 1.00 22.13 H new ATOM 0 HG LEU A 62 3.574 -9.091 -5.666 1.00 24.14 H new ATOM 0 HD11 LEU A 62 5.529 -10.369 -4.904 1.00 32.25 H new ATOM 0 HD12 LEU A 62 5.181 -8.970 -3.861 1.00 32.25 H new ATOM 0 HD13 LEU A 62 4.744 -10.610 -3.325 1.00 32.25 H new ATOM 0 HD21 LEU A 62 3.739 -11.537 -6.063 1.00 22.34 H new ATOM 0 HD22 LEU A 62 2.822 -11.825 -4.565 1.00 22.34 H new ATOM 0 HD23 LEU A 62 2.050 -10.991 -5.935 1.00 22.34 H new ATOM 885 N LEU A 63 3.590 -7.176 -1.528 1.00 25.11 N ATOM 886 CA LEU A 63 4.735 -6.766 -0.774 1.00 2.03 C ATOM 887 C LEU A 63 5.779 -7.867 -0.838 1.00 45.02 C ATOM 888 O LEU A 63 5.587 -8.969 -0.318 1.00 23.30 O ATOM 889 CB LEU A 63 4.349 -6.474 0.682 1.00 63.21 C ATOM 890 CG LEU A 63 3.297 -5.381 0.909 1.00 15.12 C ATOM 891 CD1 LEU A 63 2.984 -5.252 2.390 1.00 74.31 C ATOM 892 CD2 LEU A 63 3.777 -4.046 0.358 1.00 72.01 C ATOM 0 H LEU A 63 2.766 -7.416 -0.976 1.00 25.11 H new ATOM 0 HA LEU A 63 5.142 -5.848 -1.199 1.00 2.03 H new ATOM 0 HB2 LEU A 63 3.982 -7.398 1.129 1.00 63.21 H new ATOM 0 HB3 LEU A 63 5.252 -6.195 1.224 1.00 63.21 H new ATOM 0 HG LEU A 63 2.389 -5.666 0.378 1.00 15.12 H new ATOM 0 HD11 LEU A 63 2.236 -4.473 2.537 1.00 74.31 H new ATOM 0 HD12 LEU A 63 2.599 -6.200 2.764 1.00 74.31 H new ATOM 0 HD13 LEU A 63 3.892 -4.990 2.932 1.00 74.31 H new ATOM 0 HD21 LEU A 63 3.015 -3.286 0.530 1.00 72.01 H new ATOM 0 HD22 LEU A 63 4.699 -3.755 0.861 1.00 72.01 H new ATOM 0 HD23 LEU A 63 3.961 -4.139 -0.712 1.00 72.01 H new ATOM 904 N ASP A 64 6.859 -7.554 -1.488 1.00 2.42 N ATOM 905 CA ASP A 64 7.965 -8.476 -1.680 1.00 34.23 C ATOM 906 C ASP A 64 9.147 -8.016 -0.878 1.00 4.42 C ATOM 907 O ASP A 64 9.927 -8.816 -0.360 1.00 41.32 O ATOM 908 CB ASP A 64 8.331 -8.540 -3.169 1.00 41.24 C ATOM 909 CG ASP A 64 9.534 -9.414 -3.458 1.00 4.23 C ATOM 910 OD1 ASP A 64 9.368 -10.644 -3.664 1.00 43.34 O ATOM 911 OD2 ASP A 64 10.665 -8.891 -3.503 1.00 13.24 O ATOM 0 H ASP A 64 7.010 -6.638 -1.911 1.00 2.42 H new ATOM 0 HA ASP A 64 7.672 -9.471 -1.344 1.00 34.23 H new ATOM 0 HB2 ASP A 64 7.475 -8.916 -3.730 1.00 41.24 H new ATOM 0 HB3 ASP A 64 8.530 -7.531 -3.530 1.00 41.24 H new ATOM 916 N GLN A 65 9.266 -6.718 -0.766 1.00 23.30 N ATOM 917 CA GLN A 65 10.338 -6.113 -0.027 1.00 72.00 C ATOM 918 C GLN A 65 9.974 -6.198 1.443 1.00 74.31 C ATOM 919 O GLN A 65 8.916 -5.678 1.824 1.00 61.30 O ATOM 920 CB GLN A 65 10.537 -4.629 -0.421 1.00 53.43 C ATOM 921 CG GLN A 65 10.707 -4.343 -1.926 1.00 50.04 C ATOM 922 CD GLN A 65 9.408 -4.444 -2.744 1.00 61.12 C ATOM 923 OE1 GLN A 65 8.273 -4.124 -2.139 1.00 60.13 O flip ATOM 924 NE2 GLN A 65 9.430 -4.798 -3.924 1.00 2.14 N flip ATOM 0 H GLN A 65 8.619 -6.051 -1.187 1.00 23.30 H new ATOM 0 HA GLN A 65 11.270 -6.635 -0.244 1.00 72.00 H new ATOM 0 HB2 GLN A 65 9.681 -4.060 -0.058 1.00 53.43 H new ATOM 0 HB3 GLN A 65 11.416 -4.250 0.101 1.00 53.43 H new ATOM 0 HG2 GLN A 65 11.122 -3.343 -2.048 1.00 50.04 H new ATOM 0 HG3 GLN A 65 11.435 -5.043 -2.336 1.00 50.04 H new ATOM 0 HE21 GLN A 65 10.316 -5.039 -4.368 1.00 2.14 H new ATOM 0 HE22 GLN A 65 8.562 -4.850 -4.457 1.00 2.14 H new ATOM 933 N PRO A 66 10.833 -6.842 2.290 1.00 22.04 N ATOM 934 CA PRO A 66 10.559 -7.050 3.725 1.00 1.23 C ATOM 935 C PRO A 66 10.173 -5.760 4.442 1.00 1.12 C ATOM 936 O PRO A 66 9.414 -5.768 5.405 1.00 43.02 O ATOM 937 CB PRO A 66 11.876 -7.610 4.288 1.00 35.15 C ATOM 938 CG PRO A 66 12.888 -7.446 3.202 1.00 42.51 C ATOM 939 CD PRO A 66 12.130 -7.415 1.907 1.00 44.34 C ATOM 0 HA PRO A 66 9.711 -7.719 3.872 1.00 1.23 H new ATOM 0 HB2 PRO A 66 12.177 -7.072 5.187 1.00 35.15 H new ATOM 0 HB3 PRO A 66 11.768 -8.658 4.566 1.00 35.15 H new ATOM 0 HG2 PRO A 66 13.457 -6.527 3.339 1.00 42.51 H new ATOM 0 HG3 PRO A 66 13.603 -8.268 3.212 1.00 42.51 H new ATOM 0 HD2 PRO A 66 12.635 -6.803 1.159 1.00 44.34 H new ATOM 0 HD3 PRO A 66 12.020 -8.412 1.481 1.00 44.34 H new ATOM 947 N THR A 67 10.712 -4.667 3.992 1.00 42.53 N ATOM 948 CA THR A 67 10.333 -3.391 4.478 1.00 43.41 C ATOM 949 C THR A 67 10.142 -2.471 3.279 1.00 62.13 C ATOM 950 O THR A 67 11.101 -1.955 2.717 1.00 31.22 O ATOM 951 CB THR A 67 11.388 -2.828 5.455 1.00 10.14 C ATOM 952 OG1 THR A 67 11.673 -3.843 6.445 1.00 62.00 O ATOM 953 CG2 THR A 67 10.858 -1.580 6.160 1.00 61.55 C ATOM 0 H THR A 67 11.433 -4.644 3.271 1.00 42.53 H new ATOM 0 HA THR A 67 9.402 -3.468 5.039 1.00 43.41 H new ATOM 0 HB THR A 67 12.287 -2.558 4.901 1.00 10.14 H new ATOM 0 HG1 THR A 67 12.343 -3.506 7.076 1.00 62.00 H new ATOM 0 HG21 THR A 67 11.616 -1.199 6.844 1.00 61.55 H new ATOM 0 HG22 THR A 67 10.621 -0.817 5.419 1.00 61.55 H new ATOM 0 HG23 THR A 67 9.958 -1.833 6.721 1.00 61.55 H new ATOM 961 N THR A 68 8.915 -2.334 2.866 1.00 65.45 N ATOM 962 CA THR A 68 8.569 -1.517 1.742 1.00 13.25 C ATOM 963 C THR A 68 8.245 -0.124 2.257 1.00 52.33 C ATOM 964 O THR A 68 7.336 0.043 3.067 1.00 51.33 O ATOM 965 CB THR A 68 7.344 -2.125 1.011 1.00 12.24 C ATOM 966 OG1 THR A 68 7.649 -3.478 0.583 1.00 71.55 O ATOM 967 CG2 THR A 68 6.954 -1.293 -0.204 1.00 4.35 C ATOM 0 H THR A 68 8.118 -2.793 3.307 1.00 65.45 H new ATOM 0 HA THR A 68 9.396 -1.467 1.034 1.00 13.25 H new ATOM 0 HB THR A 68 6.507 -2.132 1.709 1.00 12.24 H new ATOM 0 HG1 THR A 68 7.784 -3.491 -0.388 1.00 71.55 H new ATOM 0 HG21 THR A 68 6.092 -1.746 -0.694 1.00 4.35 H new ATOM 0 HG22 THR A 68 6.700 -0.282 0.114 1.00 4.35 H new ATOM 0 HG23 THR A 68 7.790 -1.255 -0.902 1.00 4.35 H new ATOM 975 N THR A 69 8.989 0.855 1.839 1.00 22.12 N ATOM 976 CA THR A 69 8.782 2.170 2.344 1.00 21.31 C ATOM 977 C THR A 69 8.159 3.087 1.302 1.00 70.51 C ATOM 978 O THR A 69 8.708 3.298 0.197 1.00 5.43 O ATOM 979 CB THR A 69 10.089 2.785 2.878 1.00 24.15 C ATOM 980 OG1 THR A 69 10.696 1.870 3.810 1.00 4.33 O ATOM 981 CG2 THR A 69 9.803 4.105 3.593 1.00 13.20 C ATOM 0 H THR A 69 9.739 0.765 1.154 1.00 22.12 H new ATOM 0 HA THR A 69 8.082 2.076 3.174 1.00 21.31 H new ATOM 0 HB THR A 69 10.760 2.972 2.039 1.00 24.15 H new ATOM 0 HG1 THR A 69 11.529 2.256 4.152 1.00 4.33 H new ATOM 0 HG21 THR A 69 10.737 4.527 3.965 1.00 13.20 H new ATOM 0 HG22 THR A 69 9.341 4.804 2.896 1.00 13.20 H new ATOM 0 HG23 THR A 69 9.127 3.927 4.429 1.00 13.20 H new ATOM 989 N ALA A 70 7.018 3.607 1.646 1.00 12.51 N ATOM 990 CA ALA A 70 6.357 4.574 0.851 1.00 33.35 C ATOM 991 C ALA A 70 6.685 5.922 1.439 1.00 10.44 C ATOM 992 O ALA A 70 6.190 6.283 2.503 1.00 42.25 O ATOM 993 CB ALA A 70 4.860 4.332 0.857 1.00 51.33 C ATOM 0 H ALA A 70 6.521 3.361 2.502 1.00 12.51 H new ATOM 0 HA ALA A 70 6.686 4.518 -0.187 1.00 33.35 H new ATOM 0 HB1 ALA A 70 4.367 5.084 0.241 1.00 51.33 H new ATOM 0 HB2 ALA A 70 4.650 3.340 0.456 1.00 51.33 H new ATOM 0 HB3 ALA A 70 4.485 4.397 1.878 1.00 51.33 H new ATOM 999 N GLY A 71 7.570 6.622 0.804 1.00 23.32 N ATOM 1000 CA GLY A 71 7.972 7.893 1.319 1.00 24.42 C ATOM 1001 C GLY A 71 9.382 7.856 1.810 1.00 51.24 C ATOM 1002 O GLY A 71 9.644 7.876 3.010 1.00 30.42 O ATOM 0 H GLY A 71 8.025 6.339 -0.064 1.00 23.32 H new ATOM 0 HA2 GLY A 71 7.875 8.651 0.541 1.00 24.42 H new ATOM 0 HA3 GLY A 71 7.308 8.185 2.133 1.00 24.42 H new ATOM 1006 N ARG A 72 10.268 7.746 0.876 1.00 40.45 N ATOM 1007 CA ARG A 72 11.693 7.730 1.085 1.00 15.10 C ATOM 1008 C ARG A 72 12.252 8.303 -0.176 1.00 50.31 C ATOM 1009 O ARG A 72 12.952 7.631 -0.907 1.00 3.21 O ATOM 1010 CB ARG A 72 12.184 6.283 1.253 1.00 42.42 C ATOM 1011 CG ARG A 72 12.758 5.947 2.612 1.00 2.33 C ATOM 1012 CD ARG A 72 13.980 6.779 2.925 1.00 71.04 C ATOM 1013 NE ARG A 72 14.605 6.359 4.173 1.00 23.44 N ATOM 1014 CZ ARG A 72 15.339 7.136 4.961 1.00 25.44 C ATOM 1015 NH1 ARG A 72 15.463 8.429 4.698 1.00 2.53 N ATOM 1016 NH2 ARG A 72 15.926 6.616 6.030 1.00 20.14 N ATOM 0 H ARG A 72 10.012 7.660 -0.108 1.00 40.45 H new ATOM 0 HA ARG A 72 11.992 8.283 1.975 1.00 15.10 H new ATOM 0 HB2 ARG A 72 11.351 5.609 1.052 1.00 42.42 H new ATOM 0 HB3 ARG A 72 12.944 6.085 0.497 1.00 42.42 H new ATOM 0 HG2 ARG A 72 12.000 6.112 3.378 1.00 2.33 H new ATOM 0 HG3 ARG A 72 13.020 4.889 2.645 1.00 2.33 H new ATOM 0 HD2 ARG A 72 14.699 6.693 2.110 1.00 71.04 H new ATOM 0 HD3 ARG A 72 13.699 7.830 2.993 1.00 71.04 H new ATOM 0 HE ARG A 72 14.468 5.391 4.464 1.00 23.44 H new ATOM 0 HH11 ARG A 72 14.993 8.832 3.887 1.00 2.53 H new ATOM 0 HH12 ARG A 72 16.028 9.021 5.307 1.00 2.53 H new ATOM 0 HH21 ARG A 72 15.812 5.625 6.243 1.00 20.14 H new ATOM 0 HH22 ARG A 72 16.491 7.207 6.640 1.00 20.14 H new ATOM 1030 N HIS A 73 11.875 9.536 -0.438 1.00 22.43 N ATOM 1031 CA HIS A 73 12.064 10.231 -1.730 1.00 11.45 C ATOM 1032 C HIS A 73 13.416 9.948 -2.492 1.00 73.41 C ATOM 1033 O HIS A 73 13.377 9.756 -3.705 1.00 24.42 O ATOM 1034 CB HIS A 73 11.740 11.737 -1.583 1.00 43.01 C ATOM 1035 CG HIS A 73 11.596 12.499 -2.873 1.00 62.11 C ATOM 1036 ND1 HIS A 73 10.379 12.780 -3.471 1.00 44.15 N ATOM 1037 CD2 HIS A 73 12.536 13.049 -3.671 1.00 51.24 C ATOM 1038 CE1 HIS A 73 10.615 13.463 -4.587 1.00 1.13 C ATOM 1039 NE2 HIS A 73 11.915 13.661 -4.759 1.00 43.34 N ATOM 0 H HIS A 73 11.409 10.119 0.257 1.00 22.43 H new ATOM 0 HA HIS A 73 11.339 9.779 -2.407 1.00 11.45 H new ATOM 0 HB2 HIS A 73 10.814 11.838 -1.017 1.00 43.01 H new ATOM 0 HB3 HIS A 73 12.528 12.204 -0.992 1.00 43.01 H new ATOM 0 HD1 HIS A 73 9.461 12.510 -3.117 1.00 44.15 H new ATOM 0 HD2 HIS A 73 13.601 13.020 -3.494 1.00 51.24 H new ATOM 0 HE1 HIS A 73 9.849 13.811 -5.264 1.00 1.13 H new ATOM 1047 N PRO A 74 14.622 9.925 -1.833 1.00 12.30 N ATOM 1048 CA PRO A 74 15.874 9.560 -2.535 1.00 53.45 C ATOM 1049 C PRO A 74 15.844 8.128 -3.135 1.00 62.11 C ATOM 1050 O PRO A 74 16.303 7.905 -4.263 1.00 12.11 O ATOM 1051 CB PRO A 74 16.943 9.656 -1.436 1.00 61.21 C ATOM 1052 CG PRO A 74 16.365 10.596 -0.443 1.00 10.22 C ATOM 1053 CD PRO A 74 14.892 10.315 -0.434 1.00 54.45 C ATOM 0 HA PRO A 74 16.054 10.212 -3.389 1.00 53.45 H new ATOM 0 HB2 PRO A 74 17.145 8.682 -0.991 1.00 61.21 H new ATOM 0 HB3 PRO A 74 17.888 10.027 -1.832 1.00 61.21 H new ATOM 0 HG2 PRO A 74 16.800 10.440 0.544 1.00 10.22 H new ATOM 0 HG3 PRO A 74 16.565 11.631 -0.720 1.00 10.22 H new ATOM 0 HD2 PRO A 74 14.637 9.518 0.264 1.00 54.45 H new ATOM 0 HD3 PRO A 74 14.315 11.192 -0.141 1.00 54.45 H new ATOM 1061 N GLU A 75 15.277 7.176 -2.397 1.00 34.32 N ATOM 1062 CA GLU A 75 15.198 5.782 -2.831 1.00 5.42 C ATOM 1063 C GLU A 75 13.949 5.150 -2.237 1.00 74.12 C ATOM 1064 O GLU A 75 13.974 4.637 -1.119 1.00 32.21 O ATOM 1065 CB GLU A 75 16.424 4.953 -2.389 1.00 21.25 C ATOM 1066 CG GLU A 75 17.780 5.462 -2.851 1.00 53.05 C ATOM 1067 CD GLU A 75 18.894 4.559 -2.418 1.00 12.00 C ATOM 1068 OE1 GLU A 75 19.261 4.577 -1.226 1.00 43.00 O ATOM 1069 OE2 GLU A 75 19.402 3.771 -3.244 1.00 72.42 O ATOM 0 H GLU A 75 14.860 7.348 -1.482 1.00 34.32 H new ATOM 0 HA GLU A 75 15.168 5.781 -3.921 1.00 5.42 H new ATOM 0 HB2 GLU A 75 16.429 4.903 -1.300 1.00 21.25 H new ATOM 0 HB3 GLU A 75 16.298 3.934 -2.754 1.00 21.25 H new ATOM 0 HG2 GLU A 75 17.784 5.548 -3.938 1.00 53.05 H new ATOM 0 HG3 GLU A 75 17.948 6.462 -2.451 1.00 53.05 H new ATOM 1076 N SER A 76 12.854 5.270 -2.929 1.00 54.13 N ATOM 1077 CA SER A 76 11.608 4.702 -2.468 1.00 42.10 C ATOM 1078 C SER A 76 11.315 3.418 -3.196 1.00 3.32 C ATOM 1079 O SER A 76 11.758 3.226 -4.332 1.00 34.52 O ATOM 1080 CB SER A 76 10.448 5.661 -2.726 1.00 54.23 C ATOM 1081 OG SER A 76 10.612 6.888 -2.070 1.00 3.13 O ATOM 0 H SER A 76 12.792 5.759 -3.822 1.00 54.13 H new ATOM 0 HA SER A 76 11.709 4.517 -1.399 1.00 42.10 H new ATOM 0 HB2 SER A 76 10.356 5.835 -3.798 1.00 54.23 H new ATOM 0 HB3 SER A 76 9.518 5.198 -2.397 1.00 54.23 H new ATOM 0 HG SER A 76 9.847 7.468 -2.266 1.00 3.13 H new ATOM 1087 N ASP A 77 10.589 2.537 -2.543 1.00 12.31 N ATOM 1088 CA ASP A 77 10.081 1.351 -3.200 1.00 33.21 C ATOM 1089 C ASP A 77 8.974 1.822 -4.123 1.00 61.04 C ATOM 1090 O ASP A 77 8.881 1.422 -5.294 1.00 11.31 O ATOM 1091 CB ASP A 77 9.532 0.351 -2.174 1.00 41.35 C ATOM 1092 CG ASP A 77 10.576 -0.101 -1.179 1.00 21.50 C ATOM 1093 OD1 ASP A 77 10.791 0.601 -0.169 1.00 74.13 O ATOM 1094 OD2 ASP A 77 11.201 -1.144 -1.385 1.00 74.11 O ATOM 0 H ASP A 77 10.337 2.619 -1.558 1.00 12.31 H new ATOM 0 HA ASP A 77 10.870 0.839 -3.750 1.00 33.21 H new ATOM 0 HB2 ASP A 77 8.700 0.807 -1.638 1.00 41.35 H new ATOM 0 HB3 ASP A 77 9.135 -0.519 -2.698 1.00 41.35 H new ATOM 1099 N ILE A 78 8.153 2.710 -3.584 1.00 34.31 N ATOM 1100 CA ILE A 78 7.139 3.415 -4.336 1.00 23.22 C ATOM 1101 C ILE A 78 7.237 4.891 -4.009 1.00 25.33 C ATOM 1102 O ILE A 78 7.328 5.276 -2.828 1.00 75.14 O ATOM 1103 CB ILE A 78 5.685 2.905 -4.095 1.00 71.35 C ATOM 1104 CG1 ILE A 78 5.320 2.886 -2.598 1.00 34.55 C ATOM 1105 CG2 ILE A 78 5.488 1.538 -4.727 1.00 14.13 C ATOM 1106 CD1 ILE A 78 3.869 2.539 -2.323 1.00 12.24 C ATOM 0 H ILE A 78 8.177 2.962 -2.596 1.00 34.31 H new ATOM 0 HA ILE A 78 7.336 3.226 -5.391 1.00 23.22 H new ATOM 0 HB ILE A 78 5.005 3.608 -4.577 1.00 71.35 H new ATOM 0 HG12 ILE A 78 5.959 2.165 -2.088 1.00 34.55 H new ATOM 0 HG13 ILE A 78 5.537 3.864 -2.169 1.00 34.55 H new ATOM 0 HG21 ILE A 78 4.468 1.198 -4.549 1.00 14.13 H new ATOM 0 HG22 ILE A 78 5.666 1.604 -5.800 1.00 14.13 H new ATOM 0 HG23 ILE A 78 6.189 0.829 -4.286 1.00 14.13 H new ATOM 0 HD11 ILE A 78 3.691 2.546 -1.248 1.00 12.24 H new ATOM 0 HD12 ILE A 78 3.222 3.273 -2.803 1.00 12.24 H new ATOM 0 HD13 ILE A 78 3.650 1.548 -2.720 1.00 12.24 H new ATOM 1118 N PHE A 79 7.275 5.705 -5.023 1.00 23.14 N ATOM 1119 CA PHE A 79 7.431 7.129 -4.841 1.00 35.20 C ATOM 1120 C PHE A 79 6.083 7.783 -4.730 1.00 73.24 C ATOM 1121 O PHE A 79 5.302 7.763 -5.669 1.00 54.43 O ATOM 1122 CB PHE A 79 8.223 7.748 -6.006 1.00 10.14 C ATOM 1123 CG PHE A 79 9.651 7.277 -6.105 1.00 61.34 C ATOM 1124 CD1 PHE A 79 9.969 6.101 -6.766 1.00 54.45 C ATOM 1125 CD2 PHE A 79 10.674 8.011 -5.531 1.00 70.23 C ATOM 1126 CE1 PHE A 79 11.276 5.669 -6.851 1.00 52.24 C ATOM 1127 CE2 PHE A 79 11.985 7.580 -5.612 1.00 62.43 C ATOM 1128 CZ PHE A 79 12.284 6.409 -6.273 1.00 52.24 C ATOM 0 H PHE A 79 7.200 5.409 -5.996 1.00 23.14 H new ATOM 0 HA PHE A 79 7.989 7.298 -3.920 1.00 35.20 H new ATOM 0 HB2 PHE A 79 7.711 7.518 -6.941 1.00 10.14 H new ATOM 0 HB3 PHE A 79 8.217 8.833 -5.898 1.00 10.14 H new ATOM 0 HD1 PHE A 79 9.183 5.516 -7.220 1.00 54.45 H new ATOM 0 HD2 PHE A 79 10.446 8.931 -5.014 1.00 70.23 H new ATOM 0 HE1 PHE A 79 11.509 4.751 -7.370 1.00 52.24 H new ATOM 0 HE2 PHE A 79 12.774 8.161 -5.158 1.00 62.43 H new ATOM 0 HZ PHE A 79 13.308 6.071 -6.338 1.00 52.24 H new ATOM 1138 N LEU A 80 5.821 8.376 -3.588 1.00 30.41 N ATOM 1139 CA LEU A 80 4.566 9.044 -3.334 1.00 45.25 C ATOM 1140 C LEU A 80 4.409 10.284 -4.217 1.00 45.44 C ATOM 1141 O LEU A 80 5.335 10.697 -4.906 1.00 51.51 O ATOM 1142 CB LEU A 80 4.445 9.437 -1.848 1.00 22.53 C ATOM 1143 CG LEU A 80 4.446 8.289 -0.824 1.00 31.42 C ATOM 1144 CD1 LEU A 80 4.371 8.825 0.590 1.00 64.40 C ATOM 1145 CD2 LEU A 80 3.302 7.329 -1.069 1.00 45.44 C ATOM 0 H LEU A 80 6.475 8.409 -2.806 1.00 30.41 H new ATOM 0 HA LEU A 80 3.767 8.344 -3.579 1.00 45.25 H new ATOM 0 HB2 LEU A 80 5.269 10.108 -1.606 1.00 22.53 H new ATOM 0 HB3 LEU A 80 3.523 10.005 -1.721 1.00 22.53 H new ATOM 0 HG LEU A 80 5.384 7.747 -0.948 1.00 31.42 H new ATOM 0 HD11 LEU A 80 4.373 7.994 1.295 1.00 64.40 H new ATOM 0 HD12 LEU A 80 5.231 9.466 0.782 1.00 64.40 H new ATOM 0 HD13 LEU A 80 3.454 9.402 0.712 1.00 64.40 H new ATOM 0 HD21 LEU A 80 3.332 6.530 -0.328 1.00 45.44 H new ATOM 0 HD22 LEU A 80 2.355 7.863 -0.988 1.00 45.44 H new ATOM 0 HD23 LEU A 80 3.393 6.901 -2.067 1.00 45.44 H new ATOM 1157 N ASP A 81 3.242 10.868 -4.174 1.00 33.43 N ATOM 1158 CA ASP A 81 2.925 12.080 -4.941 1.00 12.20 C ATOM 1159 C ASP A 81 3.601 13.300 -4.326 1.00 23.13 C ATOM 1160 O ASP A 81 3.697 14.353 -4.944 1.00 13.20 O ATOM 1161 CB ASP A 81 1.398 12.282 -4.987 1.00 3.34 C ATOM 1162 CG ASP A 81 0.978 13.548 -5.707 1.00 41.45 C ATOM 1163 OD1 ASP A 81 1.066 13.596 -6.947 1.00 30.41 O ATOM 1164 OD2 ASP A 81 0.574 14.510 -5.043 1.00 22.52 O ATOM 0 H ASP A 81 2.467 10.527 -3.606 1.00 33.43 H new ATOM 0 HA ASP A 81 3.301 11.959 -5.957 1.00 12.20 H new ATOM 0 HB2 ASP A 81 0.940 11.424 -5.480 1.00 3.34 H new ATOM 0 HB3 ASP A 81 1.012 12.308 -3.968 1.00 3.34 H new ATOM 1169 N ASP A 82 4.115 13.109 -3.119 1.00 3.15 N ATOM 1170 CA ASP A 82 4.749 14.185 -2.327 1.00 14.53 C ATOM 1171 C ASP A 82 3.861 15.400 -2.144 1.00 4.31 C ATOM 1172 O ASP A 82 3.952 16.383 -2.878 1.00 73.23 O ATOM 1173 CB ASP A 82 6.138 14.612 -2.835 1.00 32.21 C ATOM 1174 CG ASP A 82 7.299 13.769 -2.320 1.00 40.22 C ATOM 1175 OD1 ASP A 82 7.645 12.747 -2.938 1.00 22.11 O ATOM 1176 OD2 ASP A 82 7.914 14.160 -1.292 1.00 2.12 O ATOM 0 H ASP A 82 4.110 12.204 -2.649 1.00 3.15 H new ATOM 0 HA ASP A 82 4.896 13.724 -1.350 1.00 14.53 H new ATOM 0 HB2 ASP A 82 6.137 14.575 -3.924 1.00 32.21 H new ATOM 0 HB3 ASP A 82 6.309 15.650 -2.551 1.00 32.21 H new ATOM 1181 N VAL A 83 2.934 15.281 -1.234 1.00 31.02 N ATOM 1182 CA VAL A 83 2.088 16.406 -0.846 1.00 45.23 C ATOM 1183 C VAL A 83 2.756 17.071 0.351 1.00 53.11 C ATOM 1184 O VAL A 83 2.803 18.290 0.486 1.00 23.31 O ATOM 1185 CB VAL A 83 0.673 15.917 -0.422 1.00 41.34 C ATOM 1186 CG1 VAL A 83 -0.252 17.082 -0.106 1.00 63.12 C ATOM 1187 CG2 VAL A 83 0.067 15.031 -1.493 1.00 10.13 C ATOM 0 H VAL A 83 2.734 14.414 -0.736 1.00 31.02 H new ATOM 0 HA VAL A 83 1.973 17.092 -1.685 1.00 45.23 H new ATOM 0 HB VAL A 83 0.789 15.331 0.489 1.00 41.34 H new ATOM 0 HG11 VAL A 83 -1.231 16.701 0.186 1.00 63.12 H new ATOM 0 HG12 VAL A 83 0.168 17.668 0.711 1.00 63.12 H new ATOM 0 HG13 VAL A 83 -0.357 17.713 -0.989 1.00 63.12 H new ATOM 0 HG21 VAL A 83 -0.922 14.701 -1.175 1.00 10.13 H new ATOM 0 HG22 VAL A 83 -0.019 15.592 -2.423 1.00 10.13 H new ATOM 0 HG23 VAL A 83 0.706 14.162 -1.651 1.00 10.13 H new ATOM 1197 N THR A 84 3.318 16.209 1.160 1.00 52.44 N ATOM 1198 CA THR A 84 4.019 16.477 2.410 1.00 62.12 C ATOM 1199 C THR A 84 4.472 15.119 2.920 1.00 43.10 C ATOM 1200 O THR A 84 3.755 14.433 3.637 1.00 42.13 O ATOM 1201 CB THR A 84 3.151 17.204 3.517 1.00 33.41 C ATOM 1202 OG1 THR A 84 2.747 18.506 3.064 1.00 32.15 O ATOM 1203 CG2 THR A 84 3.938 17.371 4.815 1.00 60.35 C ATOM 0 H THR A 84 3.300 15.211 0.950 1.00 52.44 H new ATOM 0 HA THR A 84 4.837 17.169 2.211 1.00 62.12 H new ATOM 0 HB THR A 84 2.276 16.581 3.701 1.00 33.41 H new ATOM 0 HG1 THR A 84 3.064 18.646 2.147 1.00 32.15 H new ATOM 0 HG21 THR A 84 3.316 17.873 5.556 1.00 60.35 H new ATOM 0 HG22 THR A 84 4.231 16.391 5.192 1.00 60.35 H new ATOM 0 HG23 THR A 84 4.830 17.968 4.625 1.00 60.35 H new ATOM 1211 N VAL A 85 5.582 14.693 2.431 1.00 20.30 N ATOM 1212 CA VAL A 85 6.117 13.408 2.748 1.00 63.01 C ATOM 1213 C VAL A 85 7.250 13.557 3.740 1.00 0.21 C ATOM 1214 O VAL A 85 8.080 14.462 3.622 1.00 73.22 O ATOM 1215 CB VAL A 85 6.537 12.651 1.452 1.00 22.10 C ATOM 1216 CG1 VAL A 85 7.274 11.359 1.758 1.00 53.15 C ATOM 1217 CG2 VAL A 85 5.290 12.334 0.653 1.00 23.13 C ATOM 0 H VAL A 85 6.158 15.235 1.787 1.00 20.30 H new ATOM 0 HA VAL A 85 5.350 12.796 3.223 1.00 63.01 H new ATOM 0 HB VAL A 85 7.215 13.292 0.888 1.00 22.10 H new ATOM 0 HG11 VAL A 85 7.547 10.866 0.825 1.00 53.15 H new ATOM 0 HG12 VAL A 85 8.176 11.581 2.328 1.00 53.15 H new ATOM 0 HG13 VAL A 85 6.629 10.701 2.341 1.00 53.15 H new ATOM 0 HG21 VAL A 85 5.567 11.804 -0.258 1.00 23.13 H new ATOM 0 HG22 VAL A 85 4.625 11.709 1.249 1.00 23.13 H new ATOM 0 HG23 VAL A 85 4.779 13.261 0.392 1.00 23.13 H new ATOM 1227 N SER A 86 7.244 12.700 4.719 1.00 24.21 N ATOM 1228 CA SER A 86 8.181 12.721 5.806 1.00 72.32 C ATOM 1229 C SER A 86 9.581 12.211 5.348 1.00 42.14 C ATOM 1230 O SER A 86 9.789 11.879 4.165 1.00 14.20 O ATOM 1231 CB SER A 86 7.585 11.855 6.927 1.00 65.14 C ATOM 1232 OG SER A 86 8.313 11.905 8.144 1.00 1.41 O ATOM 0 H SER A 86 6.565 11.942 4.786 1.00 24.21 H new ATOM 0 HA SER A 86 8.341 13.737 6.167 1.00 72.32 H new ATOM 0 HB2 SER A 86 6.561 12.177 7.115 1.00 65.14 H new ATOM 0 HB3 SER A 86 7.537 10.821 6.587 1.00 65.14 H new ATOM 0 HG SER A 86 7.828 11.409 8.836 1.00 1.41 H new ATOM 1238 N ARG A 87 10.535 12.187 6.280 1.00 12.23 N ATOM 1239 CA ARG A 87 11.905 11.711 6.023 1.00 62.44 C ATOM 1240 C ARG A 87 11.832 10.201 5.773 1.00 32.32 C ATOM 1241 O ARG A 87 12.590 9.629 5.001 1.00 71.41 O ATOM 1242 CB ARG A 87 12.767 12.049 7.243 1.00 33.20 C ATOM 1243 CG ARG A 87 14.274 11.932 7.068 1.00 4.51 C ATOM 1244 CD ARG A 87 14.945 12.452 8.327 1.00 1.32 C ATOM 1245 NE ARG A 87 16.403 12.529 8.251 1.00 52.31 N ATOM 1246 CZ ARG A 87 17.153 13.256 9.100 1.00 41.33 C ATOM 1247 NH1 ARG A 87 16.574 13.996 10.056 1.00 21.31 N ATOM 1248 NH2 ARG A 87 18.472 13.249 8.991 1.00 21.10 N ATOM 0 H ARG A 87 10.384 12.497 7.240 1.00 12.23 H new ATOM 0 HA ARG A 87 12.353 12.188 5.151 1.00 62.44 H new ATOM 0 HB2 ARG A 87 12.538 13.070 7.549 1.00 33.20 H new ATOM 0 HB3 ARG A 87 12.468 11.396 8.063 1.00 33.20 H new ATOM 0 HG2 ARG A 87 14.556 10.894 6.889 1.00 4.51 H new ATOM 0 HG3 ARG A 87 14.601 12.505 6.200 1.00 4.51 H new ATOM 0 HD2 ARG A 87 14.553 13.444 8.549 1.00 1.32 H new ATOM 0 HD3 ARG A 87 14.671 11.807 9.162 1.00 1.32 H new ATOM 0 HE ARG A 87 16.877 12.004 7.516 1.00 52.31 H new ATOM 0 HH11 ARG A 87 15.558 14.011 10.144 1.00 21.31 H new ATOM 0 HH12 ARG A 87 17.150 14.544 10.695 1.00 21.31 H new ATOM 0 HH21 ARG A 87 18.921 12.693 8.263 1.00 21.10 H new ATOM 0 HH22 ARG A 87 19.040 13.800 9.635 1.00 21.10 H new ATOM 1262 N ARG A 88 10.909 9.592 6.475 1.00 43.02 N ATOM 1263 CA ARG A 88 10.454 8.242 6.257 1.00 74.23 C ATOM 1264 C ARG A 88 8.981 8.394 6.464 1.00 42.51 C ATOM 1265 O ARG A 88 8.592 8.972 7.471 1.00 74.51 O ATOM 1266 CB ARG A 88 10.993 7.195 7.283 1.00 34.52 C ATOM 1267 CG ARG A 88 12.511 7.092 7.451 1.00 4.50 C ATOM 1268 CD ARG A 88 13.044 8.108 8.458 1.00 22.41 C ATOM 1269 NE ARG A 88 12.447 7.905 9.794 1.00 41.12 N ATOM 1270 CZ ARG A 88 12.529 8.769 10.830 1.00 41.00 C ATOM 1271 NH1 ARG A 88 13.361 9.801 10.785 1.00 43.20 N ATOM 1272 NH2 ARG A 88 11.841 8.542 11.937 1.00 21.20 N ATOM 0 H ARG A 88 10.431 10.047 7.253 1.00 43.02 H new ATOM 0 HA ARG A 88 10.786 7.866 5.289 1.00 74.23 H new ATOM 0 HB2 ARG A 88 10.561 7.424 8.257 1.00 34.52 H new ATOM 0 HB3 ARG A 88 10.619 6.214 6.991 1.00 34.52 H new ATOM 0 HG2 ARG A 88 12.772 6.086 7.778 1.00 4.50 H new ATOM 0 HG3 ARG A 88 12.994 7.249 6.487 1.00 4.50 H new ATOM 0 HD2 ARG A 88 14.128 8.022 8.525 1.00 22.41 H new ATOM 0 HD3 ARG A 88 12.826 9.117 8.109 1.00 22.41 H new ATOM 0 HE ARG A 88 11.929 7.040 9.947 1.00 41.12 H new ATOM 0 HH11 ARG A 88 13.947 9.948 9.963 1.00 43.20 H new ATOM 0 HH12 ARG A 88 13.415 10.447 11.572 1.00 43.20 H new ATOM 0 HH21 ARG A 88 11.249 7.715 12.009 1.00 21.20 H new ATOM 0 HH22 ARG A 88 11.903 9.194 12.719 1.00 21.20 H new ATOM 1286 N HIS A 89 8.167 7.994 5.533 1.00 61.52 N ATOM 1287 CA HIS A 89 6.752 8.265 5.685 1.00 2.10 C ATOM 1288 C HIS A 89 5.975 7.045 6.179 1.00 54.33 C ATOM 1289 O HIS A 89 5.663 6.943 7.365 1.00 35.33 O ATOM 1290 CB HIS A 89 6.180 8.818 4.386 1.00 32.05 C ATOM 1291 CG HIS A 89 4.873 9.523 4.530 1.00 42.31 C ATOM 1292 ND1 HIS A 89 4.810 10.889 4.481 1.00 61.13 N ATOM 1293 CD2 HIS A 89 3.623 9.024 4.682 1.00 21.33 C ATOM 1294 CE1 HIS A 89 3.533 11.186 4.599 1.00 54.33 C ATOM 1295 NE2 HIS A 89 2.779 10.093 4.726 1.00 73.51 N ATOM 0 H HIS A 89 8.436 7.495 4.685 1.00 61.52 H new ATOM 0 HA HIS A 89 6.639 9.024 6.459 1.00 2.10 H new ATOM 0 HB2 HIS A 89 6.903 9.508 3.951 1.00 32.05 H new ATOM 0 HB3 HIS A 89 6.058 7.997 3.680 1.00 32.05 H new ATOM 0 HD2 HIS A 89 3.349 7.982 4.754 1.00 21.33 H new ATOM 0 HE1 HIS A 89 3.143 12.193 4.594 1.00 54.33 H new ATOM 0 HE2 HIS A 89 1.765 10.063 4.835 1.00 73.51 H new ATOM 1303 N ALA A 90 5.676 6.130 5.295 1.00 52.44 N ATOM 1304 CA ALA A 90 4.928 4.964 5.666 1.00 23.44 C ATOM 1305 C ALA A 90 5.737 3.731 5.385 1.00 73.02 C ATOM 1306 O ALA A 90 5.972 3.368 4.220 1.00 41.52 O ATOM 1307 CB ALA A 90 3.590 4.922 4.936 1.00 40.12 C ATOM 0 H ALA A 90 5.941 6.172 4.311 1.00 52.44 H new ATOM 0 HA ALA A 90 4.717 5.005 6.734 1.00 23.44 H new ATOM 0 HB1 ALA A 90 3.041 4.029 5.234 1.00 40.12 H new ATOM 0 HB2 ALA A 90 3.008 5.808 5.192 1.00 40.12 H new ATOM 0 HB3 ALA A 90 3.763 4.900 3.860 1.00 40.12 H new ATOM 1313 N GLU A 91 6.204 3.115 6.426 1.00 4.42 N ATOM 1314 CA GLU A 91 6.973 1.911 6.288 1.00 33.23 C ATOM 1315 C GLU A 91 6.061 0.724 6.455 1.00 11.13 C ATOM 1316 O GLU A 91 5.309 0.643 7.431 1.00 22.10 O ATOM 1317 CB GLU A 91 8.083 1.847 7.333 1.00 70.00 C ATOM 1318 CG GLU A 91 9.050 3.012 7.293 1.00 40.33 C ATOM 1319 CD GLU A 91 10.142 2.870 8.312 1.00 12.54 C ATOM 1320 OE1 GLU A 91 9.965 3.315 9.460 1.00 14.12 O ATOM 1321 OE2 GLU A 91 11.212 2.302 7.982 1.00 31.44 O ATOM 0 H GLU A 91 6.067 3.426 7.388 1.00 4.42 H new ATOM 0 HA GLU A 91 7.432 1.901 5.299 1.00 33.23 H new ATOM 0 HB2 GLU A 91 7.630 1.801 8.323 1.00 70.00 H new ATOM 0 HB3 GLU A 91 8.642 0.922 7.195 1.00 70.00 H new ATOM 0 HG2 GLU A 91 9.489 3.085 6.298 1.00 40.33 H new ATOM 0 HG3 GLU A 91 8.507 3.940 7.470 1.00 40.33 H new ATOM 1328 N PHE A 92 6.098 -0.170 5.523 1.00 3.54 N ATOM 1329 CA PHE A 92 5.325 -1.368 5.617 1.00 50.34 C ATOM 1330 C PHE A 92 6.290 -2.513 5.773 1.00 15.44 C ATOM 1331 O PHE A 92 7.055 -2.820 4.849 1.00 23.34 O ATOM 1332 CB PHE A 92 4.496 -1.585 4.338 1.00 52.31 C ATOM 1333 CG PHE A 92 3.649 -0.410 3.920 1.00 43.43 C ATOM 1334 CD1 PHE A 92 2.483 -0.101 4.590 1.00 50.50 C ATOM 1335 CD2 PHE A 92 4.020 0.373 2.841 1.00 20.11 C ATOM 1336 CE1 PHE A 92 1.701 0.967 4.196 1.00 14.04 C ATOM 1337 CE2 PHE A 92 3.245 1.444 2.443 1.00 54.54 C ATOM 1338 CZ PHE A 92 2.083 1.741 3.120 1.00 62.42 C ATOM 0 H PHE A 92 6.662 -0.093 4.677 1.00 3.54 H new ATOM 0 HA PHE A 92 4.639 -1.301 6.462 1.00 50.34 H new ATOM 0 HB2 PHE A 92 5.174 -1.833 3.522 1.00 52.31 H new ATOM 0 HB3 PHE A 92 3.846 -2.447 4.486 1.00 52.31 H new ATOM 0 HD1 PHE A 92 2.178 -0.702 5.434 1.00 50.50 H new ATOM 0 HD2 PHE A 92 4.928 0.143 2.303 1.00 20.11 H new ATOM 0 HE1 PHE A 92 0.791 1.196 4.730 1.00 14.04 H new ATOM 0 HE2 PHE A 92 3.550 2.048 1.601 1.00 54.54 H new ATOM 0 HZ PHE A 92 1.473 2.577 2.810 1.00 62.42 H new ATOM 1348 N ARG A 93 6.294 -3.134 6.910 1.00 31.24 N ATOM 1349 CA ARG A 93 7.166 -4.250 7.101 1.00 25.31 C ATOM 1350 C ARG A 93 6.353 -5.502 7.015 1.00 70.11 C ATOM 1351 O ARG A 93 5.374 -5.689 7.763 1.00 12.31 O ATOM 1352 CB ARG A 93 7.992 -4.171 8.409 1.00 64.43 C ATOM 1353 CG ARG A 93 9.019 -5.304 8.535 1.00 64.32 C ATOM 1354 CD ARG A 93 9.985 -5.111 9.698 1.00 72.41 C ATOM 1355 NE ARG A 93 9.324 -5.120 11.004 1.00 32.23 N ATOM 1356 CZ ARG A 93 9.957 -4.991 12.185 1.00 53.40 C ATOM 1357 NH1 ARG A 93 11.284 -4.876 12.233 1.00 75.31 N ATOM 1358 NH2 ARG A 93 9.260 -4.978 13.303 1.00 53.03 N ATOM 0 H ARG A 93 5.711 -2.892 7.711 1.00 31.24 H new ATOM 0 HA ARG A 93 7.917 -4.243 6.311 1.00 25.31 H new ATOM 0 HB2 ARG A 93 8.509 -3.212 8.449 1.00 64.43 H new ATOM 0 HB3 ARG A 93 7.315 -4.204 9.263 1.00 64.43 H new ATOM 0 HG2 ARG A 93 8.493 -6.250 8.661 1.00 64.32 H new ATOM 0 HG3 ARG A 93 9.587 -5.376 7.607 1.00 64.32 H new ATOM 0 HD2 ARG A 93 10.736 -5.900 9.673 1.00 72.41 H new ATOM 0 HD3 ARG A 93 10.512 -4.165 9.571 1.00 72.41 H new ATOM 0 HE ARG A 93 8.310 -5.232 11.020 1.00 32.23 H new ATOM 0 HH11 ARG A 93 11.828 -4.885 11.370 1.00 75.31 H new ATOM 0 HH12 ARG A 93 11.755 -4.779 13.132 1.00 75.31 H new ATOM 0 HH21 ARG A 93 8.244 -5.066 13.272 1.00 53.03 H new ATOM 0 HH22 ARG A 93 9.736 -4.880 14.200 1.00 53.03 H new ATOM 1372 N ILE A 94 6.752 -6.358 6.138 1.00 62.01 N ATOM 1373 CA ILE A 94 6.006 -7.521 5.844 1.00 43.21 C ATOM 1374 C ILE A 94 6.794 -8.734 6.243 1.00 3.41 C ATOM 1375 O ILE A 94 7.916 -8.963 5.792 1.00 24.14 O ATOM 1376 CB ILE A 94 5.566 -7.551 4.313 1.00 21.44 C ATOM 1377 CG1 ILE A 94 4.683 -8.785 3.916 1.00 12.21 C ATOM 1378 CG2 ILE A 94 6.756 -7.414 3.373 1.00 12.41 C ATOM 1379 CD1 ILE A 94 5.400 -10.125 3.739 1.00 24.43 C ATOM 0 H ILE A 94 7.615 -6.264 5.602 1.00 62.01 H new ATOM 0 HA ILE A 94 5.082 -7.516 6.423 1.00 43.21 H new ATOM 0 HB ILE A 94 4.927 -6.676 4.196 1.00 21.44 H new ATOM 0 HG12 ILE A 94 3.914 -8.910 4.678 1.00 12.21 H new ATOM 0 HG13 ILE A 94 4.171 -8.549 2.983 1.00 12.21 H new ATOM 0 HG21 ILE A 94 6.409 -7.440 2.340 1.00 12.41 H new ATOM 0 HG22 ILE A 94 7.262 -6.467 3.562 1.00 12.41 H new ATOM 0 HG23 ILE A 94 7.450 -8.237 3.543 1.00 12.41 H new ATOM 0 HD11 ILE A 94 4.675 -10.892 3.466 1.00 24.43 H new ATOM 0 HD12 ILE A 94 6.149 -10.036 2.952 1.00 24.43 H new ATOM 0 HD13 ILE A 94 5.888 -10.403 4.673 1.00 24.43 H new ATOM 1391 N ASN A 95 6.240 -9.430 7.164 1.00 62.20 N ATOM 1392 CA ASN A 95 6.727 -10.691 7.574 1.00 41.15 C ATOM 1393 C ASN A 95 5.591 -11.614 7.260 1.00 32.22 C ATOM 1394 O ASN A 95 4.433 -11.199 7.365 1.00 25.43 O ATOM 1395 CB ASN A 95 7.052 -10.667 9.089 1.00 4.12 C ATOM 1396 CG ASN A 95 7.670 -11.954 9.646 1.00 22.14 C ATOM 1397 OD1 ASN A 95 7.406 -13.057 9.179 1.00 42.54 O ATOM 1398 ND2 ASN A 95 8.488 -11.813 10.648 1.00 61.11 N ATOM 0 H ASN A 95 5.408 -9.127 7.670 1.00 62.20 H new ATOM 0 HA ASN A 95 7.651 -10.992 7.080 1.00 41.15 H new ATOM 0 HB2 ASN A 95 7.736 -9.841 9.284 1.00 4.12 H new ATOM 0 HB3 ASN A 95 6.134 -10.457 9.638 1.00 4.12 H new ATOM 0 HD21 ASN A 95 8.929 -12.633 11.066 1.00 61.11 H new ATOM 0 HD22 ASN A 95 8.689 -10.883 11.015 1.00 61.11 H new ATOM 1405 N GLU A 96 5.871 -12.817 6.850 1.00 30.21 N ATOM 1406 CA GLU A 96 4.817 -13.733 6.484 1.00 63.12 C ATOM 1407 C GLU A 96 3.949 -14.128 7.686 1.00 12.43 C ATOM 1408 O GLU A 96 2.828 -14.636 7.527 1.00 22.33 O ATOM 1409 CB GLU A 96 5.356 -14.920 5.652 1.00 35.02 C ATOM 1410 CG GLU A 96 6.520 -15.719 6.253 1.00 61.14 C ATOM 1411 CD GLU A 96 6.114 -16.612 7.393 1.00 52.34 C ATOM 1412 OE1 GLU A 96 5.546 -17.688 7.129 1.00 64.13 O ATOM 1413 OE2 GLU A 96 6.351 -16.256 8.552 1.00 13.24 O ATOM 0 H GLU A 96 6.816 -13.191 6.759 1.00 30.21 H new ATOM 0 HA GLU A 96 4.131 -13.211 5.817 1.00 63.12 H new ATOM 0 HB2 GLU A 96 4.531 -15.608 5.470 1.00 35.02 H new ATOM 0 HB3 GLU A 96 5.673 -14.538 4.682 1.00 35.02 H new ATOM 0 HG2 GLU A 96 6.974 -16.327 5.471 1.00 61.14 H new ATOM 0 HG3 GLU A 96 7.285 -15.025 6.601 1.00 61.14 H new ATOM 1420 N GLY A 97 4.468 -13.864 8.877 1.00 12.41 N ATOM 1421 CA GLY A 97 3.730 -14.077 10.084 1.00 32.32 C ATOM 1422 C GLY A 97 2.930 -12.853 10.507 1.00 34.20 C ATOM 1423 O GLY A 97 1.746 -12.964 10.849 1.00 32.23 O ATOM 0 H GLY A 97 5.410 -13.498 9.019 1.00 12.41 H new ATOM 0 HA2 GLY A 97 3.052 -14.919 9.947 1.00 32.32 H new ATOM 0 HA3 GLY A 97 4.419 -14.350 10.883 1.00 32.32 H new ATOM 1427 N GLU A 98 3.546 -11.681 10.459 1.00 10.50 N ATOM 1428 CA GLU A 98 2.897 -10.455 10.902 1.00 62.11 C ATOM 1429 C GLU A 98 3.154 -9.327 9.932 1.00 12.03 C ATOM 1430 O GLU A 98 4.260 -9.170 9.411 1.00 14.23 O ATOM 1431 CB GLU A 98 3.391 -10.039 12.278 1.00 23.35 C ATOM 1432 CG GLU A 98 3.036 -10.986 13.406 1.00 24.44 C ATOM 1433 CD GLU A 98 3.649 -10.555 14.704 1.00 40.24 C ATOM 1434 OE1 GLU A 98 3.090 -9.659 15.374 1.00 42.45 O ATOM 1435 OE2 GLU A 98 4.712 -11.089 15.073 1.00 15.51 O ATOM 0 H GLU A 98 4.498 -11.553 10.116 1.00 10.50 H new ATOM 0 HA GLU A 98 1.827 -10.658 10.949 1.00 62.11 H new ATOM 0 HB2 GLU A 98 4.475 -9.935 12.241 1.00 23.35 H new ATOM 0 HB3 GLU A 98 2.984 -9.055 12.510 1.00 23.35 H new ATOM 0 HG2 GLU A 98 1.952 -11.034 13.513 1.00 24.44 H new ATOM 0 HG3 GLU A 98 3.377 -11.991 13.158 1.00 24.44 H new ATOM 1442 N PHE A 99 2.155 -8.536 9.713 1.00 3.24 N ATOM 1443 CA PHE A 99 2.248 -7.410 8.821 1.00 63.24 C ATOM 1444 C PHE A 99 2.137 -6.156 9.669 1.00 0.22 C ATOM 1445 O PHE A 99 1.196 -6.028 10.449 1.00 72.33 O ATOM 1446 CB PHE A 99 1.100 -7.455 7.790 1.00 75.24 C ATOM 1447 CG PHE A 99 1.027 -8.727 6.969 1.00 70.14 C ATOM 1448 CD1 PHE A 99 0.349 -9.847 7.443 1.00 14.34 C ATOM 1449 CD2 PHE A 99 1.628 -8.800 5.731 1.00 41.11 C ATOM 1450 CE1 PHE A 99 0.281 -11.006 6.695 1.00 44.24 C ATOM 1451 CE2 PHE A 99 1.562 -9.959 4.977 1.00 31.11 C ATOM 1452 CZ PHE A 99 0.889 -11.062 5.459 1.00 45.41 C ATOM 0 H PHE A 99 1.240 -8.648 10.149 1.00 3.24 H new ATOM 0 HA PHE A 99 3.191 -7.426 8.275 1.00 63.24 H new ATOM 0 HB2 PHE A 99 0.154 -7.325 8.316 1.00 75.24 H new ATOM 0 HB3 PHE A 99 1.207 -6.608 7.112 1.00 75.24 H new ATOM 0 HD1 PHE A 99 -0.131 -9.809 8.410 1.00 14.34 H new ATOM 0 HD2 PHE A 99 2.157 -7.942 5.344 1.00 41.11 H new ATOM 0 HE1 PHE A 99 -0.247 -11.867 7.078 1.00 44.24 H new ATOM 0 HE2 PHE A 99 2.039 -10.000 4.009 1.00 31.11 H new ATOM 0 HZ PHE A 99 0.838 -11.966 4.870 1.00 45.41 H new ATOM 1462 N GLU A 100 3.080 -5.254 9.567 1.00 2.24 N ATOM 1463 CA GLU A 100 3.024 -4.049 10.375 1.00 13.33 C ATOM 1464 C GLU A 100 3.275 -2.793 9.552 1.00 70.11 C ATOM 1465 O GLU A 100 4.141 -2.764 8.667 1.00 73.10 O ATOM 1466 CB GLU A 100 3.944 -4.097 11.593 1.00 43.43 C ATOM 1467 CG GLU A 100 5.395 -3.959 11.257 1.00 53.12 C ATOM 1468 CD GLU A 100 6.272 -3.956 12.471 1.00 74.54 C ATOM 1469 OE1 GLU A 100 6.629 -5.041 12.967 1.00 24.44 O ATOM 1470 OE2 GLU A 100 6.624 -2.877 12.963 1.00 20.34 O ATOM 0 H GLU A 100 3.886 -5.322 8.945 1.00 2.24 H new ATOM 0 HA GLU A 100 2.003 -4.003 10.754 1.00 13.33 H new ATOM 0 HB2 GLU A 100 3.662 -3.300 12.282 1.00 43.43 H new ATOM 0 HB3 GLU A 100 3.790 -5.040 12.117 1.00 43.43 H new ATOM 0 HG2 GLU A 100 5.691 -4.778 10.602 1.00 53.12 H new ATOM 0 HG3 GLU A 100 5.549 -3.034 10.701 1.00 53.12 H new ATOM 1477 N VAL A 101 2.503 -1.796 9.822 1.00 33.23 N ATOM 1478 CA VAL A 101 2.607 -0.528 9.148 1.00 44.34 C ATOM 1479 C VAL A 101 3.010 0.554 10.152 1.00 35.51 C ATOM 1480 O VAL A 101 2.395 0.694 11.226 1.00 3.30 O ATOM 1481 CB VAL A 101 1.287 -0.151 8.384 1.00 2.43 C ATOM 1482 CG1 VAL A 101 0.070 -0.225 9.290 1.00 55.54 C ATOM 1483 CG2 VAL A 101 1.390 1.238 7.757 1.00 15.43 C ATOM 0 H VAL A 101 1.767 -1.830 10.527 1.00 33.23 H new ATOM 0 HA VAL A 101 3.382 -0.607 8.386 1.00 44.34 H new ATOM 0 HB VAL A 101 1.161 -0.885 7.589 1.00 2.43 H new ATOM 0 HG11 VAL A 101 -0.822 0.043 8.724 1.00 55.54 H new ATOM 0 HG12 VAL A 101 -0.036 -1.239 9.675 1.00 55.54 H new ATOM 0 HG13 VAL A 101 0.193 0.468 10.122 1.00 55.54 H new ATOM 0 HG21 VAL A 101 0.462 1.471 7.235 1.00 15.43 H new ATOM 0 HG22 VAL A 101 1.563 1.978 8.538 1.00 15.43 H new ATOM 0 HG23 VAL A 101 2.219 1.257 7.049 1.00 15.43 H new ATOM 1493 N VAL A 102 4.067 1.258 9.841 1.00 2.45 N ATOM 1494 CA VAL A 102 4.576 2.302 10.696 1.00 63.42 C ATOM 1495 C VAL A 102 4.401 3.648 10.019 1.00 3.31 C ATOM 1496 O VAL A 102 4.986 3.900 8.950 1.00 3.20 O ATOM 1497 CB VAL A 102 6.082 2.094 11.025 1.00 53.41 C ATOM 1498 CG1 VAL A 102 6.584 3.157 11.996 1.00 52.11 C ATOM 1499 CG2 VAL A 102 6.337 0.701 11.581 1.00 51.32 C ATOM 0 H VAL A 102 4.603 1.124 8.983 1.00 2.45 H new ATOM 0 HA VAL A 102 4.013 2.268 11.629 1.00 63.42 H new ATOM 0 HB VAL A 102 6.638 2.194 10.093 1.00 53.41 H new ATOM 0 HG11 VAL A 102 7.640 2.987 12.208 1.00 52.11 H new ATOM 0 HG12 VAL A 102 6.458 4.144 11.552 1.00 52.11 H new ATOM 0 HG13 VAL A 102 6.014 3.101 12.923 1.00 52.11 H new ATOM 0 HG21 VAL A 102 7.398 0.586 11.801 1.00 51.32 H new ATOM 0 HG22 VAL A 102 5.760 0.563 12.495 1.00 51.32 H new ATOM 0 HG23 VAL A 102 6.036 -0.045 10.845 1.00 51.32 H new ATOM 1509 N ASP A 103 3.590 4.489 10.606 1.00 43.42 N ATOM 1510 CA ASP A 103 3.378 5.820 10.111 1.00 41.33 C ATOM 1511 C ASP A 103 4.264 6.785 10.837 1.00 55.15 C ATOM 1512 O ASP A 103 4.082 7.063 12.030 1.00 75.35 O ATOM 1513 CB ASP A 103 1.918 6.265 10.239 1.00 15.31 C ATOM 1514 CG ASP A 103 1.723 7.743 9.891 1.00 74.34 C ATOM 1515 OD1 ASP A 103 2.198 8.182 8.820 1.00 10.55 O ATOM 1516 OD2 ASP A 103 1.101 8.482 10.685 1.00 51.11 O ATOM 0 H ASP A 103 3.056 4.266 11.446 1.00 43.42 H new ATOM 0 HA ASP A 103 3.627 5.811 9.050 1.00 41.33 H new ATOM 0 HB2 ASP A 103 1.297 5.656 9.583 1.00 15.31 H new ATOM 0 HB3 ASP A 103 1.575 6.087 11.258 1.00 15.31 H new ATOM 1521 N VAL A 104 5.248 7.242 10.151 1.00 33.05 N ATOM 1522 CA VAL A 104 6.132 8.243 10.664 1.00 61.34 C ATOM 1523 C VAL A 104 5.975 9.524 9.861 1.00 10.11 C ATOM 1524 O VAL A 104 6.789 10.455 9.956 1.00 51.41 O ATOM 1525 CB VAL A 104 7.622 7.763 10.773 1.00 14.25 C ATOM 1526 CG1 VAL A 104 7.825 6.984 12.061 1.00 12.34 C ATOM 1527 CG2 VAL A 104 7.998 6.864 9.610 1.00 30.31 C ATOM 0 H VAL A 104 5.471 6.932 9.205 1.00 33.05 H new ATOM 0 HA VAL A 104 5.844 8.448 11.695 1.00 61.34 H new ATOM 0 HB VAL A 104 8.253 8.651 10.760 1.00 14.25 H new ATOM 0 HG11 VAL A 104 8.862 6.655 12.128 1.00 12.34 H new ATOM 0 HG12 VAL A 104 7.591 7.622 12.913 1.00 12.34 H new ATOM 0 HG13 VAL A 104 7.167 6.115 12.068 1.00 12.34 H new ATOM 0 HG21 VAL A 104 9.036 6.548 9.715 1.00 30.31 H new ATOM 0 HG22 VAL A 104 7.351 5.987 9.604 1.00 30.31 H new ATOM 0 HG23 VAL A 104 7.877 7.410 8.674 1.00 30.31 H new ATOM 1537 N GLY A 105 4.873 9.576 9.118 1.00 54.10 N ATOM 1538 CA GLY A 105 4.498 10.730 8.346 1.00 71.32 C ATOM 1539 C GLY A 105 3.130 11.192 8.781 1.00 73.22 C ATOM 1540 O GLY A 105 2.258 11.521 7.964 1.00 4.41 O ATOM 0 H GLY A 105 4.214 8.801 9.042 1.00 54.10 H new ATOM 0 HA2 GLY A 105 5.227 11.529 8.486 1.00 71.32 H new ATOM 0 HA3 GLY A 105 4.492 10.486 7.284 1.00 71.32 H new ATOM 1544 N SER A 106 2.964 11.241 10.085 1.00 1.55 N ATOM 1545 CA SER A 106 1.719 11.560 10.744 1.00 10.23 C ATOM 1546 C SER A 106 1.311 13.028 10.574 1.00 61.13 C ATOM 1547 O SER A 106 0.158 13.409 10.865 1.00 40.21 O ATOM 1548 CB SER A 106 1.835 11.165 12.212 1.00 43.23 C ATOM 1549 OG SER A 106 3.088 11.607 12.756 1.00 1.13 O ATOM 0 H SER A 106 3.723 11.052 10.739 1.00 1.55 H new ATOM 0 HA SER A 106 0.918 10.991 10.272 1.00 10.23 H new ATOM 0 HB2 SER A 106 1.012 11.602 12.778 1.00 43.23 H new ATOM 0 HB3 SER A 106 1.751 10.083 12.311 1.00 43.23 H new ATOM 0 HG SER A 106 3.145 11.347 13.699 1.00 1.13 H new ATOM 1555 N LEU A 107 2.251 13.845 10.115 1.00 33.03 N ATOM 1556 CA LEU A 107 1.985 15.230 9.814 1.00 4.11 C ATOM 1557 C LEU A 107 1.054 15.285 8.613 1.00 50.11 C ATOM 1558 O LEU A 107 0.084 16.049 8.590 1.00 73.32 O ATOM 1559 CB LEU A 107 3.289 15.953 9.518 1.00 61.04 C ATOM 1560 CG LEU A 107 3.193 17.465 9.283 1.00 14.20 C ATOM 1561 CD1 LEU A 107 2.669 18.186 10.520 1.00 4.30 C ATOM 1562 CD2 LEU A 107 4.539 18.028 8.860 1.00 3.45 C ATOM 0 H LEU A 107 3.215 13.559 9.944 1.00 33.03 H new ATOM 0 HA LEU A 107 1.513 15.722 10.665 1.00 4.11 H new ATOM 0 HB2 LEU A 107 3.972 15.779 10.349 1.00 61.04 H new ATOM 0 HB3 LEU A 107 3.739 15.498 8.636 1.00 61.04 H new ATOM 0 HG LEU A 107 2.481 17.633 8.475 1.00 14.20 H new ATOM 0 HD11 LEU A 107 2.613 19.256 10.321 1.00 4.30 H new ATOM 0 HD12 LEU A 107 1.676 17.810 10.767 1.00 4.30 H new ATOM 0 HD13 LEU A 107 3.343 18.008 11.358 1.00 4.30 H new ATOM 0 HD21 LEU A 107 4.449 19.102 8.698 1.00 3.45 H new ATOM 0 HD22 LEU A 107 5.274 17.839 9.642 1.00 3.45 H new ATOM 0 HD23 LEU A 107 4.860 17.547 7.936 1.00 3.45 H new ATOM 1574 N ASN A 108 1.356 14.462 7.629 1.00 33.35 N ATOM 1575 CA ASN A 108 0.499 14.276 6.476 1.00 4.22 C ATOM 1576 C ASN A 108 -0.670 13.440 6.923 1.00 72.34 C ATOM 1577 O ASN A 108 -1.822 13.800 6.716 1.00 44.34 O ATOM 1578 CB ASN A 108 1.265 13.575 5.359 1.00 52.55 C ATOM 1579 CG ASN A 108 0.426 13.249 4.135 1.00 12.02 C ATOM 1580 OD1 ASN A 108 -0.150 12.181 4.038 1.00 41.35 O ATOM 1581 ND2 ASN A 108 0.372 14.154 3.194 1.00 52.44 N ATOM 0 H ASN A 108 2.207 13.901 7.607 1.00 33.35 H new ATOM 0 HA ASN A 108 0.156 15.234 6.086 1.00 4.22 H new ATOM 0 HB2 ASN A 108 2.100 14.206 5.055 1.00 52.55 H new ATOM 0 HB3 ASN A 108 1.690 12.651 5.750 1.00 52.55 H new ATOM 0 HD21 ASN A 108 -0.165 13.976 2.345 1.00 52.44 H new ATOM 0 HD22 ASN A 108 0.867 15.039 3.308 1.00 52.44 H new ATOM 1588 N GLY A 109 -0.364 12.365 7.621 1.00 63.30 N ATOM 1589 CA GLY A 109 -1.390 11.538 8.199 1.00 15.22 C ATOM 1590 C GLY A 109 -1.713 10.281 7.426 1.00 12.50 C ATOM 1591 O GLY A 109 -2.512 10.311 6.473 1.00 24.12 O ATOM 0 H GLY A 109 0.589 12.048 7.799 1.00 63.30 H new ATOM 0 HA2 GLY A 109 -1.084 11.257 9.207 1.00 15.22 H new ATOM 0 HA3 GLY A 109 -2.300 12.130 8.296 1.00 15.22 H new ATOM 1595 N THR A 110 -1.111 9.192 7.822 1.00 51.04 N ATOM 1596 CA THR A 110 -1.432 7.902 7.277 1.00 34.54 C ATOM 1597 C THR A 110 -2.534 7.269 8.146 1.00 31.31 C ATOM 1598 O THR A 110 -2.367 7.096 9.366 1.00 62.12 O ATOM 1599 CB THR A 110 -0.185 6.990 7.273 1.00 43.41 C ATOM 1600 OG1 THR A 110 0.883 7.643 6.566 1.00 10.23 O ATOM 1601 CG2 THR A 110 -0.483 5.636 6.635 1.00 63.22 C ATOM 0 H THR A 110 -0.381 9.175 8.535 1.00 51.04 H new ATOM 0 HA THR A 110 -1.776 8.015 6.249 1.00 34.54 H new ATOM 0 HB THR A 110 0.111 6.811 8.307 1.00 43.41 H new ATOM 0 HG1 THR A 110 1.560 7.948 7.205 1.00 10.23 H new ATOM 0 HG21 THR A 110 0.417 5.021 6.650 1.00 63.22 H new ATOM 0 HG22 THR A 110 -1.273 5.136 7.195 1.00 63.22 H new ATOM 0 HG23 THR A 110 -0.806 5.783 5.604 1.00 63.22 H new ATOM 1609 N TYR A 111 -3.657 6.976 7.552 1.00 63.15 N ATOM 1610 CA TYR A 111 -4.723 6.361 8.282 1.00 61.41 C ATOM 1611 C TYR A 111 -4.750 4.887 7.945 1.00 53.30 C ATOM 1612 O TYR A 111 -4.700 4.517 6.777 1.00 51.23 O ATOM 1613 CB TYR A 111 -6.084 6.918 7.883 1.00 35.11 C ATOM 1614 CG TYR A 111 -6.284 8.412 7.914 1.00 43.13 C ATOM 1615 CD1 TYR A 111 -6.514 9.088 9.102 1.00 34.42 C ATOM 1616 CD2 TYR A 111 -6.318 9.134 6.733 1.00 51.33 C ATOM 1617 CE1 TYR A 111 -6.774 10.445 9.103 1.00 72.22 C ATOM 1618 CE2 TYR A 111 -6.562 10.482 6.727 1.00 21.53 C ATOM 1619 CZ TYR A 111 -6.792 11.135 7.908 1.00 74.24 C ATOM 1620 OH TYR A 111 -7.080 12.482 7.894 1.00 11.22 O ATOM 0 H TYR A 111 -3.855 7.154 6.567 1.00 63.15 H new ATOM 0 HA TYR A 111 -4.546 6.552 9.341 1.00 61.41 H new ATOM 0 HB2 TYR A 111 -6.299 6.575 6.871 1.00 35.11 H new ATOM 0 HB3 TYR A 111 -6.831 6.469 8.537 1.00 35.11 H new ATOM 0 HD1 TYR A 111 -6.490 8.548 10.037 1.00 34.42 H new ATOM 0 HD2 TYR A 111 -6.149 8.623 5.796 1.00 51.33 H new ATOM 0 HE1 TYR A 111 -6.962 10.962 10.032 1.00 72.22 H new ATOM 0 HE2 TYR A 111 -6.573 11.027 5.795 1.00 21.53 H new ATOM 0 HH TYR A 111 -7.050 12.813 6.972 1.00 11.22 H new ATOM 1630 N VAL A 112 -4.878 4.067 8.937 1.00 3.21 N ATOM 1631 CA VAL A 112 -5.000 2.639 8.744 1.00 22.31 C ATOM 1632 C VAL A 112 -6.355 2.276 9.289 1.00 14.23 C ATOM 1633 O VAL A 112 -6.651 2.617 10.433 1.00 75.20 O ATOM 1634 CB VAL A 112 -3.901 1.846 9.494 1.00 3.13 C ATOM 1635 CG1 VAL A 112 -3.980 0.363 9.149 1.00 50.25 C ATOM 1636 CG2 VAL A 112 -2.517 2.398 9.169 1.00 2.44 C ATOM 0 H VAL A 112 -4.902 4.360 9.914 1.00 3.21 H new ATOM 0 HA VAL A 112 -4.885 2.387 7.690 1.00 22.31 H new ATOM 0 HB VAL A 112 -4.070 1.960 10.565 1.00 3.13 H new ATOM 0 HG11 VAL A 112 -3.200 -0.177 9.685 1.00 50.25 H new ATOM 0 HG12 VAL A 112 -4.956 -0.026 9.438 1.00 50.25 H new ATOM 0 HG13 VAL A 112 -3.840 0.231 8.076 1.00 50.25 H new ATOM 0 HG21 VAL A 112 -1.761 1.826 9.707 1.00 2.44 H new ATOM 0 HG22 VAL A 112 -2.337 2.320 8.097 1.00 2.44 H new ATOM 0 HG23 VAL A 112 -2.462 3.444 9.470 1.00 2.44 H new ATOM 1646 N ASN A 113 -7.213 1.679 8.437 1.00 51.03 N ATOM 1647 CA ASN A 113 -8.644 1.397 8.765 1.00 52.11 C ATOM 1648 C ASN A 113 -9.356 2.744 8.877 1.00 74.00 C ATOM 1649 O ASN A 113 -10.457 2.867 9.430 1.00 75.20 O ATOM 1650 CB ASN A 113 -8.830 0.596 10.096 1.00 73.25 C ATOM 1651 CG ASN A 113 -8.049 -0.712 10.175 1.00 40.31 C ATOM 1652 OD1 ASN A 113 -6.917 -0.742 10.667 1.00 4.25 O ATOM 1653 ND2 ASN A 113 -8.632 -1.791 9.725 1.00 51.24 N ATOM 0 H ASN A 113 -6.944 1.375 7.501 1.00 51.03 H new ATOM 0 HA ASN A 113 -9.061 0.772 7.976 1.00 52.11 H new ATOM 0 HB2 ASN A 113 -8.531 1.231 10.930 1.00 73.25 H new ATOM 0 HB3 ASN A 113 -9.890 0.377 10.226 1.00 73.25 H new ATOM 0 HD21 ASN A 113 -8.151 -2.689 9.775 1.00 51.24 H new ATOM 0 HD22 ASN A 113 -9.568 -1.735 9.324 1.00 51.24 H new ATOM 1660 N ARG A 114 -8.690 3.752 8.302 1.00 25.12 N ATOM 1661 CA ARG A 114 -9.053 5.152 8.369 1.00 31.00 C ATOM 1662 C ARG A 114 -8.889 5.777 9.756 1.00 31.34 C ATOM 1663 O ARG A 114 -9.296 6.913 9.996 1.00 51.15 O ATOM 1664 CB ARG A 114 -10.354 5.514 7.647 1.00 40.10 C ATOM 1665 CG ARG A 114 -10.095 5.793 6.173 1.00 74.11 C ATOM 1666 CD ARG A 114 -11.337 6.193 5.412 1.00 22.00 C ATOM 1667 NE ARG A 114 -10.981 6.717 4.075 1.00 21.10 N ATOM 1668 CZ ARG A 114 -11.271 6.134 2.900 1.00 72.11 C ATOM 1669 NH1 ARG A 114 -11.840 4.956 2.877 1.00 54.53 N ATOM 1670 NH2 ARG A 114 -10.971 6.734 1.750 1.00 44.31 N ATOM 0 H ARG A 114 -7.844 3.595 7.754 1.00 25.12 H new ATOM 0 HA ARG A 114 -8.292 5.650 7.768 1.00 31.00 H new ATOM 0 HB2 ARG A 114 -11.070 4.698 7.747 1.00 40.10 H new ATOM 0 HB3 ARG A 114 -10.803 6.391 8.114 1.00 40.10 H new ATOM 0 HG2 ARG A 114 -9.353 6.587 6.086 1.00 74.11 H new ATOM 0 HG3 ARG A 114 -9.666 4.903 5.712 1.00 74.11 H new ATOM 0 HD2 ARG A 114 -11.999 5.333 5.307 1.00 22.00 H new ATOM 0 HD3 ARG A 114 -11.885 6.951 5.972 1.00 22.00 H new ATOM 0 HE ARG A 114 -10.470 7.599 4.043 1.00 21.10 H new ATOM 0 HH11 ARG A 114 -12.063 4.480 3.751 1.00 54.53 H new ATOM 0 HH12 ARG A 114 -12.060 4.513 1.985 1.00 54.53 H new ATOM 0 HH21 ARG A 114 -10.516 7.647 1.755 1.00 44.31 H new ATOM 0 HH22 ARG A 114 -11.196 6.281 0.864 1.00 44.31 H new ATOM 1684 N GLU A 115 -8.208 5.062 10.631 1.00 3.44 N ATOM 1685 CA GLU A 115 -7.877 5.570 11.939 1.00 73.34 C ATOM 1686 C GLU A 115 -6.443 6.102 11.887 1.00 71.32 C ATOM 1687 O GLU A 115 -5.571 5.457 11.284 1.00 31.24 O ATOM 1688 CB GLU A 115 -7.893 4.456 12.986 1.00 65.04 C ATOM 1689 CG GLU A 115 -9.154 3.628 13.073 1.00 41.44 C ATOM 1690 CD GLU A 115 -9.028 2.585 14.153 1.00 44.10 C ATOM 1691 OE1 GLU A 115 -8.010 1.856 14.174 1.00 13.23 O ATOM 1692 OE2 GLU A 115 -9.901 2.511 15.047 1.00 51.23 O ATOM 0 H GLU A 115 -7.872 4.116 10.451 1.00 3.44 H new ATOM 0 HA GLU A 115 -8.605 6.336 12.207 1.00 73.34 H new ATOM 0 HB2 GLU A 115 -7.058 3.785 12.783 1.00 65.04 H new ATOM 0 HB3 GLU A 115 -7.711 4.904 13.963 1.00 65.04 H new ATOM 0 HG2 GLU A 115 -10.007 4.274 13.281 1.00 41.44 H new ATOM 0 HG3 GLU A 115 -9.346 3.146 12.114 1.00 41.44 H new ATOM 1699 N PRO A 116 -6.169 7.273 12.460 1.00 20.25 N ATOM 1700 CA PRO A 116 -4.803 7.768 12.585 1.00 21.43 C ATOM 1701 C PRO A 116 -4.044 6.895 13.581 1.00 64.24 C ATOM 1702 O PRO A 116 -4.424 6.805 14.758 1.00 71.04 O ATOM 1703 CB PRO A 116 -4.967 9.193 13.146 1.00 54.05 C ATOM 1704 CG PRO A 116 -6.409 9.520 12.975 1.00 4.51 C ATOM 1705 CD PRO A 116 -7.143 8.214 13.008 1.00 4.14 C ATOM 0 HA PRO A 116 -4.252 7.754 11.645 1.00 21.43 H new ATOM 0 HB2 PRO A 116 -4.675 9.238 14.195 1.00 54.05 H new ATOM 0 HB3 PRO A 116 -4.337 9.902 12.609 1.00 54.05 H new ATOM 0 HG2 PRO A 116 -6.755 10.181 13.770 1.00 4.51 H new ATOM 0 HG3 PRO A 116 -6.581 10.039 12.032 1.00 4.51 H new ATOM 0 HD2 PRO A 116 -7.439 7.943 14.022 1.00 4.14 H new ATOM 0 HD3 PRO A 116 -8.053 8.248 12.408 1.00 4.14 H new ATOM 1713 N ARG A 117 -3.036 6.213 13.104 1.00 23.21 N ATOM 1714 CA ARG A 117 -2.246 5.316 13.917 1.00 13.40 C ATOM 1715 C ARG A 117 -0.794 5.569 13.611 1.00 73.15 C ATOM 1716 O ARG A 117 -0.438 5.638 12.447 1.00 31.44 O ATOM 1717 CB ARG A 117 -2.569 3.846 13.574 1.00 75.24 C ATOM 1718 CG ARG A 117 -4.009 3.397 13.828 1.00 53.24 C ATOM 1719 CD ARG A 117 -4.357 3.426 15.305 1.00 0.45 C ATOM 1720 NE ARG A 117 -5.710 2.899 15.569 1.00 64.42 N ATOM 1721 CZ ARG A 117 -6.228 2.653 16.785 1.00 22.30 C ATOM 1722 NH1 ARG A 117 -5.546 2.926 17.890 1.00 12.32 N ATOM 1723 NH2 ARG A 117 -7.435 2.150 16.869 1.00 54.10 N ATOM 0 H ARG A 117 -2.735 6.263 12.131 1.00 23.21 H new ATOM 0 HA ARG A 117 -2.469 5.490 14.970 1.00 13.40 H new ATOM 0 HB2 ARG A 117 -2.339 3.681 12.522 1.00 75.24 H new ATOM 0 HB3 ARG A 117 -1.903 3.205 14.151 1.00 75.24 H new ATOM 0 HG2 ARG A 117 -4.694 4.045 13.281 1.00 53.24 H new ATOM 0 HG3 ARG A 117 -4.148 2.387 13.442 1.00 53.24 H new ATOM 0 HD2 ARG A 117 -3.625 2.839 15.861 1.00 0.45 H new ATOM 0 HD3 ARG A 117 -4.290 4.450 15.672 1.00 0.45 H new ATOM 0 HE ARG A 117 -6.302 2.705 14.761 1.00 64.42 H new ATOM 0 HH11 ARG A 117 -4.612 3.330 17.826 1.00 12.32 H new ATOM 0 HH12 ARG A 117 -5.956 2.732 18.804 1.00 12.32 H new ATOM 0 HH21 ARG A 117 -7.965 1.952 16.020 1.00 54.10 H new ATOM 0 HH22 ARG A 117 -7.844 1.957 17.783 1.00 54.10 H new ATOM 1737 N ASN A 118 0.039 5.736 14.632 1.00 51.45 N ATOM 1738 CA ASN A 118 1.480 5.913 14.383 1.00 72.52 C ATOM 1739 C ASN A 118 2.099 4.566 14.080 1.00 52.53 C ATOM 1740 O ASN A 118 3.069 4.453 13.344 1.00 73.11 O ATOM 1741 CB ASN A 118 2.223 6.633 15.533 1.00 61.14 C ATOM 1742 CG ASN A 118 2.233 5.896 16.861 1.00 22.32 C ATOM 1743 OD1 ASN A 118 3.117 5.093 17.139 1.00 22.13 O ATOM 1744 ND2 ASN A 118 1.280 6.179 17.699 1.00 52.52 N ATOM 0 H ASN A 118 -0.238 5.754 15.613 1.00 51.45 H new ATOM 0 HA ASN A 118 1.587 6.572 13.522 1.00 72.52 H new ATOM 0 HB2 ASN A 118 3.254 6.807 15.225 1.00 61.14 H new ATOM 0 HB3 ASN A 118 1.766 7.611 15.683 1.00 61.14 H new ATOM 0 HD21 ASN A 118 1.255 5.729 18.614 1.00 52.52 H new ATOM 0 HD22 ASN A 118 0.557 6.851 17.441 1.00 52.52 H new ATOM 1751 N ALA A 119 1.519 3.550 14.644 1.00 54.41 N ATOM 1752 CA ALA A 119 1.866 2.203 14.317 1.00 71.44 C ATOM 1753 C ALA A 119 0.603 1.394 14.377 1.00 64.13 C ATOM 1754 O ALA A 119 -0.227 1.606 15.257 1.00 42.35 O ATOM 1755 CB ALA A 119 2.898 1.659 15.302 1.00 63.55 C ATOM 0 H ALA A 119 0.787 3.635 15.349 1.00 54.41 H new ATOM 0 HA ALA A 119 2.310 2.151 13.323 1.00 71.44 H new ATOM 0 HB1 ALA A 119 3.149 0.632 15.036 1.00 63.55 H new ATOM 0 HB2 ALA A 119 3.797 2.274 15.264 1.00 63.55 H new ATOM 0 HB3 ALA A 119 2.486 1.682 16.311 1.00 63.55 H new ATOM 1761 N GLN A 120 0.423 0.536 13.435 1.00 31.45 N ATOM 1762 CA GLN A 120 -0.720 -0.325 13.404 1.00 62.33 C ATOM 1763 C GLN A 120 -0.316 -1.684 12.905 1.00 41.40 C ATOM 1764 O GLN A 120 0.646 -1.813 12.125 1.00 72.45 O ATOM 1765 CB GLN A 120 -1.868 0.278 12.562 1.00 31.31 C ATOM 1766 CG GLN A 120 -3.141 -0.585 12.466 1.00 33.44 C ATOM 1767 CD GLN A 120 -3.745 -0.952 13.819 1.00 3.43 C ATOM 1768 OE1 GLN A 120 -3.420 -1.978 14.407 1.00 33.51 O ATOM 1769 NE2 GLN A 120 -4.614 -0.147 14.295 1.00 5.12 N ATOM 0 H GLN A 120 1.067 0.406 12.655 1.00 31.45 H new ATOM 0 HA GLN A 120 -1.105 -0.429 14.418 1.00 62.33 H new ATOM 0 HB2 GLN A 120 -2.137 1.246 12.985 1.00 31.31 H new ATOM 0 HB3 GLN A 120 -1.498 0.463 11.554 1.00 31.31 H new ATOM 0 HG2 GLN A 120 -3.887 -0.049 11.880 1.00 33.44 H new ATOM 0 HG3 GLN A 120 -2.907 -1.501 11.924 1.00 33.44 H new ATOM 0 HE21 GLN A 120 -4.862 0.698 13.781 1.00 5.12 H new ATOM 0 HE22 GLN A 120 -5.060 -0.349 15.190 1.00 5.12 H new ATOM 1778 N VAL A 121 -1.005 -2.675 13.350 1.00 41.44 N ATOM 1779 CA VAL A 121 -0.809 -3.989 12.846 1.00 32.01 C ATOM 1780 C VAL A 121 -1.587 -4.033 11.542 1.00 14.01 C ATOM 1781 O VAL A 121 -2.820 -3.905 11.535 1.00 73.10 O ATOM 1782 CB VAL A 121 -1.319 -5.065 13.832 1.00 53.50 C ATOM 1783 CG1 VAL A 121 -1.039 -6.466 13.303 1.00 10.53 C ATOM 1784 CG2 VAL A 121 -0.673 -4.873 15.200 1.00 61.23 C ATOM 0 H VAL A 121 -1.720 -2.598 14.073 1.00 41.44 H new ATOM 0 HA VAL A 121 0.250 -4.205 12.701 1.00 32.01 H new ATOM 0 HB VAL A 121 -2.398 -4.952 13.933 1.00 53.50 H new ATOM 0 HG11 VAL A 121 -1.408 -7.204 14.015 1.00 10.53 H new ATOM 0 HG12 VAL A 121 -1.544 -6.601 12.346 1.00 10.53 H new ATOM 0 HG13 VAL A 121 0.035 -6.596 13.168 1.00 10.53 H new ATOM 0 HG21 VAL A 121 -1.040 -5.637 15.886 1.00 61.23 H new ATOM 0 HG22 VAL A 121 0.410 -4.959 15.106 1.00 61.23 H new ATOM 0 HG23 VAL A 121 -0.926 -3.886 15.587 1.00 61.23 H new ATOM 1794 N MET A 122 -0.856 -4.143 10.460 1.00 53.10 N ATOM 1795 CA MET A 122 -1.384 -4.031 9.112 1.00 32.34 C ATOM 1796 C MET A 122 -2.361 -5.174 8.856 1.00 23.00 C ATOM 1797 O MET A 122 -2.007 -6.353 8.982 1.00 73.40 O ATOM 1798 CB MET A 122 -0.207 -4.037 8.133 1.00 24.44 C ATOM 1799 CG MET A 122 -0.512 -3.589 6.721 1.00 55.44 C ATOM 1800 SD MET A 122 0.986 -3.558 5.709 1.00 72.24 S ATOM 1801 CE MET A 122 0.369 -2.835 4.197 1.00 33.24 C ATOM 0 H MET A 122 0.149 -4.317 10.487 1.00 53.10 H new ATOM 0 HA MET A 122 -1.935 -3.100 8.976 1.00 32.34 H new ATOM 0 HB2 MET A 122 0.576 -3.394 8.535 1.00 24.44 H new ATOM 0 HB3 MET A 122 0.199 -5.048 8.092 1.00 24.44 H new ATOM 0 HG2 MET A 122 -1.243 -4.262 6.273 1.00 55.44 H new ATOM 0 HG3 MET A 122 -0.962 -2.596 6.740 1.00 55.44 H new ATOM 0 HE1 MET A 122 1.108 -2.962 3.405 1.00 33.24 H new ATOM 0 HE2 MET A 122 -0.559 -3.329 3.910 1.00 33.24 H new ATOM 0 HE3 MET A 122 0.182 -1.772 4.352 1.00 33.24 H new ATOM 1811 N GLN A 123 -3.577 -4.819 8.512 1.00 63.32 N ATOM 1812 CA GLN A 123 -4.662 -5.772 8.418 1.00 40.34 C ATOM 1813 C GLN A 123 -4.990 -6.090 6.964 1.00 12.05 C ATOM 1814 O GLN A 123 -5.243 -5.189 6.164 1.00 72.40 O ATOM 1815 CB GLN A 123 -5.893 -5.174 9.114 1.00 13.52 C ATOM 1816 CG GLN A 123 -7.083 -6.110 9.234 1.00 60.14 C ATOM 1817 CD GLN A 123 -6.794 -7.320 10.107 1.00 31.55 C ATOM 1818 OE1 GLN A 123 -5.985 -7.262 11.030 1.00 2.44 O ATOM 1819 NE2 GLN A 123 -7.452 -8.407 9.830 1.00 1.12 N ATOM 0 H GLN A 123 -3.844 -3.860 8.289 1.00 63.32 H new ATOM 0 HA GLN A 123 -4.366 -6.703 8.901 1.00 40.34 H new ATOM 0 HB2 GLN A 123 -5.604 -4.849 10.113 1.00 13.52 H new ATOM 0 HB3 GLN A 123 -6.204 -4.284 8.567 1.00 13.52 H new ATOM 0 HG2 GLN A 123 -7.930 -5.563 9.648 1.00 60.14 H new ATOM 0 HG3 GLN A 123 -7.377 -6.447 8.240 1.00 60.14 H new ATOM 0 HE21 GLN A 123 -8.116 -8.418 9.056 1.00 1.12 H new ATOM 0 HE22 GLN A 123 -7.304 -9.249 10.387 1.00 1.12 H new ATOM 1828 N THR A 124 -4.982 -7.363 6.640 1.00 54.54 N ATOM 1829 CA THR A 124 -5.292 -7.842 5.324 1.00 74.53 C ATOM 1830 C THR A 124 -6.806 -7.865 5.121 1.00 65.31 C ATOM 1831 O THR A 124 -7.527 -8.555 5.845 1.00 42.32 O ATOM 1832 CB THR A 124 -4.715 -9.266 5.160 1.00 71.44 C ATOM 1833 OG1 THR A 124 -5.010 -10.029 6.346 1.00 24.34 O ATOM 1834 CG2 THR A 124 -3.212 -9.234 4.945 1.00 63.24 C ATOM 0 H THR A 124 -4.754 -8.105 7.302 1.00 54.54 H new ATOM 0 HA THR A 124 -4.851 -7.180 4.579 1.00 74.53 H new ATOM 0 HB THR A 124 -5.173 -9.725 4.284 1.00 71.44 H new ATOM 0 HG1 THR A 124 -5.928 -9.843 6.634 1.00 24.34 H new ATOM 0 HG21 THR A 124 -2.839 -10.252 4.833 1.00 63.24 H new ATOM 0 HG22 THR A 124 -2.985 -8.664 4.044 1.00 63.24 H new ATOM 0 HG23 THR A 124 -2.732 -8.763 5.803 1.00 63.24 H new ATOM 1842 N GLY A 125 -7.284 -7.077 4.199 1.00 32.05 N ATOM 1843 CA GLY A 125 -8.690 -7.060 3.911 1.00 23.52 C ATOM 1844 C GLY A 125 -9.339 -5.736 4.233 1.00 40.21 C ATOM 1845 O GLY A 125 -10.562 -5.607 4.142 1.00 60.34 O ATOM 0 H GLY A 125 -6.722 -6.439 3.635 1.00 32.05 H new ATOM 0 HA2 GLY A 125 -8.842 -7.287 2.856 1.00 23.52 H new ATOM 0 HA3 GLY A 125 -9.182 -7.848 4.481 1.00 23.52 H new ATOM 1849 N ASP A 126 -8.545 -4.745 4.585 1.00 10.14 N ATOM 1850 CA ASP A 126 -9.092 -3.431 4.922 1.00 1.43 C ATOM 1851 C ASP A 126 -8.346 -2.365 4.103 1.00 33.52 C ATOM 1852 O ASP A 126 -7.620 -2.714 3.168 1.00 12.23 O ATOM 1853 CB ASP A 126 -8.996 -3.167 6.441 1.00 24.43 C ATOM 1854 CG ASP A 126 -9.945 -2.067 6.914 1.00 41.11 C ATOM 1855 OD1 ASP A 126 -9.592 -0.889 6.853 1.00 32.11 O ATOM 1856 OD2 ASP A 126 -11.064 -2.378 7.368 1.00 3.34 O ATOM 0 H ASP A 126 -7.529 -4.815 4.647 1.00 10.14 H new ATOM 0 HA ASP A 126 -10.151 -3.392 4.669 1.00 1.43 H new ATOM 0 HB2 ASP A 126 -9.218 -4.088 6.980 1.00 24.43 H new ATOM 0 HB3 ASP A 126 -7.972 -2.890 6.693 1.00 24.43 H new ATOM 1861 N GLU A 127 -8.470 -1.109 4.445 1.00 31.52 N ATOM 1862 CA GLU A 127 -7.929 -0.061 3.617 1.00 21.52 C ATOM 1863 C GLU A 127 -7.051 0.930 4.395 1.00 4.30 C ATOM 1864 O GLU A 127 -7.240 1.165 5.602 1.00 30.21 O ATOM 1865 CB GLU A 127 -9.050 0.630 2.828 1.00 33.33 C ATOM 1866 CG GLU A 127 -10.120 1.283 3.682 1.00 4.31 C ATOM 1867 CD GLU A 127 -11.311 1.754 2.881 1.00 44.54 C ATOM 1868 OE1 GLU A 127 -11.129 2.421 1.838 1.00 12.13 O ATOM 1869 OE2 GLU A 127 -12.470 1.493 3.309 1.00 72.52 O ATOM 0 H GLU A 127 -8.940 -0.786 5.291 1.00 31.52 H new ATOM 0 HA GLU A 127 -7.254 -0.527 2.899 1.00 21.52 H new ATOM 0 HB2 GLU A 127 -8.607 1.389 2.183 1.00 33.33 H new ATOM 0 HB3 GLU A 127 -9.523 -0.105 2.177 1.00 33.33 H new ATOM 0 HG2 GLU A 127 -10.456 0.574 4.438 1.00 4.31 H new ATOM 0 HG3 GLU A 127 -9.687 2.132 4.211 1.00 4.31 H new ATOM 1876 N ILE A 128 -6.084 1.483 3.701 1.00 63.20 N ATOM 1877 CA ILE A 128 -5.126 2.412 4.258 1.00 41.34 C ATOM 1878 C ILE A 128 -5.181 3.692 3.434 1.00 11.24 C ATOM 1879 O ILE A 128 -5.123 3.652 2.213 1.00 1.41 O ATOM 1880 CB ILE A 128 -3.679 1.823 4.214 1.00 55.53 C ATOM 1881 CG1 ILE A 128 -3.611 0.495 4.992 1.00 53.24 C ATOM 1882 CG2 ILE A 128 -2.651 2.826 4.758 1.00 62.33 C ATOM 1883 CD1 ILE A 128 -2.252 -0.181 4.975 1.00 33.11 C ATOM 0 H ILE A 128 -5.937 1.295 2.709 1.00 63.20 H new ATOM 0 HA ILE A 128 -5.374 2.608 5.301 1.00 41.34 H new ATOM 0 HB ILE A 128 -3.430 1.626 3.171 1.00 55.53 H new ATOM 0 HG12 ILE A 128 -3.896 0.681 6.027 1.00 53.24 H new ATOM 0 HG13 ILE A 128 -4.349 -0.192 4.577 1.00 53.24 H new ATOM 0 HG21 ILE A 128 -1.655 2.386 4.714 1.00 62.33 H new ATOM 0 HG22 ILE A 128 -2.674 3.734 4.155 1.00 62.33 H new ATOM 0 HG23 ILE A 128 -2.894 3.071 5.792 1.00 62.33 H new ATOM 0 HD11 ILE A 128 -2.299 -1.107 5.547 1.00 33.11 H new ATOM 0 HD12 ILE A 128 -1.969 -0.404 3.946 1.00 33.11 H new ATOM 0 HD13 ILE A 128 -1.510 0.482 5.419 1.00 33.11 H new ATOM 1895 N GLN A 129 -5.302 4.800 4.080 1.00 35.43 N ATOM 1896 CA GLN A 129 -5.423 6.044 3.382 1.00 11.32 C ATOM 1897 C GLN A 129 -4.252 6.938 3.730 1.00 52.00 C ATOM 1898 O GLN A 129 -4.104 7.365 4.867 1.00 32.11 O ATOM 1899 CB GLN A 129 -6.756 6.716 3.725 1.00 12.04 C ATOM 1900 CG GLN A 129 -7.042 7.991 2.942 1.00 64.33 C ATOM 1901 CD GLN A 129 -8.350 8.629 3.343 1.00 13.21 C ATOM 1902 OE1 GLN A 129 -8.779 8.532 4.477 1.00 13.43 O ATOM 1903 NE2 GLN A 129 -9.021 9.248 2.414 1.00 61.34 N ATOM 0 H GLN A 129 -5.320 4.876 5.097 1.00 35.43 H new ATOM 0 HA GLN A 129 -5.409 5.861 2.308 1.00 11.32 H new ATOM 0 HB2 GLN A 129 -7.563 6.006 3.545 1.00 12.04 H new ATOM 0 HB3 GLN A 129 -6.767 6.949 4.790 1.00 12.04 H new ATOM 0 HG2 GLN A 129 -6.230 8.701 3.100 1.00 64.33 H new ATOM 0 HG3 GLN A 129 -7.063 7.763 1.876 1.00 64.33 H new ATOM 0 HE21 GLN A 129 -8.641 9.317 1.470 1.00 61.34 H new ATOM 0 HE22 GLN A 129 -9.927 9.664 2.630 1.00 61.34 H new ATOM 1912 N ILE A 130 -3.418 7.189 2.768 1.00 3.33 N ATOM 1913 CA ILE A 130 -2.276 8.050 2.965 1.00 52.50 C ATOM 1914 C ILE A 130 -2.633 9.459 2.550 1.00 51.35 C ATOM 1915 O ILE A 130 -2.790 9.758 1.353 1.00 61.22 O ATOM 1916 CB ILE A 130 -0.929 7.571 2.276 1.00 75.15 C ATOM 1917 CG1 ILE A 130 -1.011 7.343 0.728 1.00 43.20 C ATOM 1918 CG2 ILE A 130 -0.355 6.349 2.973 1.00 14.32 C ATOM 1919 CD1 ILE A 130 -1.767 6.103 0.247 1.00 54.11 C ATOM 0 H ILE A 130 -3.503 6.808 1.826 1.00 3.33 H new ATOM 0 HA ILE A 130 -2.051 8.007 4.031 1.00 52.50 H new ATOM 0 HB ILE A 130 -0.249 8.413 2.400 1.00 75.15 H new ATOM 0 HG12 ILE A 130 -1.479 8.220 0.281 1.00 43.20 H new ATOM 0 HG13 ILE A 130 0.006 7.292 0.339 1.00 43.20 H new ATOM 0 HG21 ILE A 130 0.567 6.047 2.477 1.00 14.32 H new ATOM 0 HG22 ILE A 130 -0.144 6.590 4.015 1.00 14.32 H new ATOM 0 HG23 ILE A 130 -1.076 5.533 2.928 1.00 14.32 H new ATOM 0 HD11 ILE A 130 -1.748 6.065 -0.842 1.00 54.11 H new ATOM 0 HD12 ILE A 130 -1.292 5.208 0.649 1.00 54.11 H new ATOM 0 HD13 ILE A 130 -2.800 6.151 0.591 1.00 54.11 H new ATOM 1931 N GLY A 131 -2.823 10.307 3.531 1.00 44.13 N ATOM 1932 CA GLY A 131 -3.236 11.654 3.269 1.00 70.35 C ATOM 1933 C GLY A 131 -4.667 11.680 2.802 1.00 22.12 C ATOM 1934 O GLY A 131 -5.604 11.472 3.587 1.00 44.34 O ATOM 0 H GLY A 131 -2.697 10.083 4.518 1.00 44.13 H new ATOM 0 HA2 GLY A 131 -3.130 12.256 4.171 1.00 70.35 H new ATOM 0 HA3 GLY A 131 -2.591 12.099 2.511 1.00 70.35 H new ATOM 1938 N LYS A 132 -4.842 11.876 1.522 1.00 65.24 N ATOM 1939 CA LYS A 132 -6.155 11.874 0.937 1.00 14.50 C ATOM 1940 C LYS A 132 -6.224 10.839 -0.183 1.00 33.23 C ATOM 1941 O LYS A 132 -7.157 10.831 -0.979 1.00 70.41 O ATOM 1942 CB LYS A 132 -6.531 13.266 0.400 1.00 64.01 C ATOM 1943 CG LYS A 132 -6.456 14.400 1.430 1.00 14.04 C ATOM 1944 CD LYS A 132 -7.093 15.688 0.904 1.00 35.40 C ATOM 1945 CE LYS A 132 -8.606 15.535 0.797 1.00 72.11 C ATOM 1946 NZ LYS A 132 -9.274 16.704 0.203 1.00 23.21 N ATOM 0 H LYS A 132 -4.084 12.040 0.860 1.00 65.24 H new ATOM 0 HA LYS A 132 -6.873 11.612 1.714 1.00 14.50 H new ATOM 0 HB2 LYS A 132 -5.871 13.508 -0.433 1.00 64.01 H new ATOM 0 HB3 LYS A 132 -7.545 13.224 0.002 1.00 64.01 H new ATOM 0 HG2 LYS A 132 -6.960 14.093 2.346 1.00 14.04 H new ATOM 0 HG3 LYS A 132 -5.414 14.589 1.688 1.00 14.04 H new ATOM 0 HD2 LYS A 132 -6.852 16.517 1.570 1.00 35.40 H new ATOM 0 HD3 LYS A 132 -6.677 15.933 -0.073 1.00 35.40 H new ATOM 0 HE2 LYS A 132 -8.832 14.653 0.197 1.00 72.11 H new ATOM 0 HE3 LYS A 132 -9.017 15.358 1.791 1.00 72.11 H new ATOM 0 HZ1 LYS A 132 -10.299 16.533 0.160 1.00 23.21 H new ATOM 0 HZ2 LYS A 132 -9.087 17.544 0.786 1.00 23.21 H new ATOM 0 HZ3 LYS A 132 -8.909 16.861 -0.758 1.00 23.21 H new ATOM 1960 N PHE A 133 -5.248 9.953 -0.232 1.00 25.11 N ATOM 1961 CA PHE A 133 -5.202 8.932 -1.269 1.00 51.14 C ATOM 1962 C PHE A 133 -5.696 7.609 -0.714 1.00 14.11 C ATOM 1963 O PHE A 133 -5.255 7.183 0.354 1.00 52.41 O ATOM 1964 CB PHE A 133 -3.784 8.771 -1.815 1.00 33.21 C ATOM 1965 CG PHE A 133 -3.181 10.042 -2.342 1.00 31.12 C ATOM 1966 CD1 PHE A 133 -3.758 10.707 -3.411 1.00 5.21 C ATOM 1967 CD2 PHE A 133 -2.029 10.560 -1.779 1.00 15.42 C ATOM 1968 CE1 PHE A 133 -3.199 11.866 -3.903 1.00 2.41 C ATOM 1969 CE2 PHE A 133 -1.466 11.718 -2.266 1.00 22.42 C ATOM 1970 CZ PHE A 133 -2.050 12.370 -3.330 1.00 32.11 C ATOM 0 H PHE A 133 -4.475 9.917 0.432 1.00 25.11 H new ATOM 0 HA PHE A 133 -5.850 9.245 -2.087 1.00 51.14 H new ATOM 0 HB2 PHE A 133 -3.144 8.379 -1.024 1.00 33.21 H new ATOM 0 HB3 PHE A 133 -3.796 8.029 -2.613 1.00 33.21 H new ATOM 0 HD1 PHE A 133 -4.656 10.313 -3.864 1.00 5.21 H new ATOM 0 HD2 PHE A 133 -1.566 10.050 -0.947 1.00 15.42 H new ATOM 0 HE1 PHE A 133 -3.659 12.378 -4.735 1.00 2.41 H new ATOM 0 HE2 PHE A 133 -0.568 12.115 -1.815 1.00 22.42 H new ATOM 0 HZ PHE A 133 -1.608 13.277 -3.716 1.00 32.11 H new ATOM 1980 N ARG A 134 -6.586 6.957 -1.440 1.00 51.54 N ATOM 1981 CA ARG A 134 -7.183 5.714 -0.978 1.00 73.43 C ATOM 1982 C ARG A 134 -6.479 4.484 -1.555 1.00 24.23 C ATOM 1983 O ARG A 134 -6.377 4.302 -2.792 1.00 71.22 O ATOM 1984 CB ARG A 134 -8.704 5.679 -1.269 1.00 62.41 C ATOM 1985 CG ARG A 134 -9.093 6.082 -2.685 1.00 25.50 C ATOM 1986 CD ARG A 134 -10.581 5.876 -2.949 1.00 2.21 C ATOM 1987 NE ARG A 134 -10.986 6.449 -4.250 1.00 40.41 N ATOM 1988 CZ ARG A 134 -11.959 5.976 -5.061 1.00 31.50 C ATOM 1989 NH1 ARG A 134 -12.618 4.861 -4.755 1.00 5.14 N ATOM 1990 NH2 ARG A 134 -12.276 6.640 -6.169 1.00 62.12 N ATOM 0 H ARG A 134 -6.913 7.268 -2.355 1.00 51.54 H new ATOM 0 HA ARG A 134 -7.047 5.679 0.103 1.00 73.43 H new ATOM 0 HB2 ARG A 134 -9.073 4.671 -1.079 1.00 62.41 H new ATOM 0 HB3 ARG A 134 -9.209 6.341 -0.566 1.00 62.41 H new ATOM 0 HG2 ARG A 134 -8.838 7.129 -2.847 1.00 25.50 H new ATOM 0 HG3 ARG A 134 -8.514 5.498 -3.400 1.00 25.50 H new ATOM 0 HD2 ARG A 134 -10.810 4.810 -2.933 1.00 2.21 H new ATOM 0 HD3 ARG A 134 -11.161 6.339 -2.150 1.00 2.21 H new ATOM 0 HE ARG A 134 -10.484 7.279 -4.566 1.00 40.41 H new ATOM 0 HH11 ARG A 134 -12.391 4.353 -3.900 1.00 5.14 H new ATOM 0 HH12 ARG A 134 -13.350 4.515 -5.375 1.00 5.14 H new ATOM 0 HH21 ARG A 134 -11.786 7.503 -6.404 1.00 62.12 H new ATOM 0 HH22 ARG A 134 -13.009 6.286 -6.783 1.00 62.12 H new ATOM 2004 N LEU A 135 -5.988 3.670 -0.657 1.00 51.02 N ATOM 2005 CA LEU A 135 -5.315 2.438 -0.951 1.00 53.02 C ATOM 2006 C LEU A 135 -6.028 1.321 -0.179 1.00 0.11 C ATOM 2007 O LEU A 135 -6.508 1.542 0.929 1.00 65.43 O ATOM 2008 CB LEU A 135 -3.814 2.610 -0.546 1.00 43.25 C ATOM 2009 CG LEU A 135 -2.826 1.429 -0.694 1.00 34.32 C ATOM 2010 CD1 LEU A 135 -1.406 1.969 -0.668 1.00 41.42 C ATOM 2011 CD2 LEU A 135 -2.974 0.445 0.462 1.00 23.32 C ATOM 0 H LEU A 135 -6.051 3.859 0.343 1.00 51.02 H new ATOM 0 HA LEU A 135 -5.343 2.175 -2.008 1.00 53.02 H new ATOM 0 HB2 LEU A 135 -3.415 3.440 -1.130 1.00 43.25 H new ATOM 0 HB3 LEU A 135 -3.795 2.918 0.499 1.00 43.25 H new ATOM 0 HG LEU A 135 -3.040 0.918 -1.633 1.00 34.32 H new ATOM 0 HD11 LEU A 135 -0.701 1.144 -0.772 1.00 41.42 H new ATOM 0 HD12 LEU A 135 -1.268 2.670 -1.491 1.00 41.42 H new ATOM 0 HD13 LEU A 135 -1.229 2.481 0.278 1.00 41.42 H new ATOM 0 HD21 LEU A 135 -2.268 -0.376 0.334 1.00 23.32 H new ATOM 0 HD22 LEU A 135 -2.770 0.956 1.403 1.00 23.32 H new ATOM 0 HD23 LEU A 135 -3.990 0.051 0.476 1.00 23.32 H new ATOM 2023 N VAL A 136 -6.142 0.168 -0.758 1.00 51.33 N ATOM 2024 CA VAL A 136 -6.755 -0.953 -0.083 1.00 54.35 C ATOM 2025 C VAL A 136 -5.725 -2.077 0.033 1.00 74.43 C ATOM 2026 O VAL A 136 -4.932 -2.282 -0.884 1.00 34.10 O ATOM 2027 CB VAL A 136 -8.068 -1.424 -0.805 1.00 71.50 C ATOM 2028 CG1 VAL A 136 -7.810 -1.882 -2.230 1.00 20.32 C ATOM 2029 CG2 VAL A 136 -8.797 -2.499 -0.008 1.00 40.14 C ATOM 0 H VAL A 136 -5.818 -0.032 -1.704 1.00 51.33 H new ATOM 0 HA VAL A 136 -7.063 -0.648 0.917 1.00 54.35 H new ATOM 0 HB VAL A 136 -8.719 -0.551 -0.860 1.00 71.50 H new ATOM 0 HG11 VAL A 136 -8.748 -2.198 -2.686 1.00 20.32 H new ATOM 0 HG12 VAL A 136 -7.385 -1.059 -2.805 1.00 20.32 H new ATOM 0 HG13 VAL A 136 -7.111 -2.718 -2.222 1.00 20.32 H new ATOM 0 HG21 VAL A 136 -9.700 -2.798 -0.541 1.00 40.14 H new ATOM 0 HG22 VAL A 136 -8.146 -3.364 0.116 1.00 40.14 H new ATOM 0 HG23 VAL A 136 -9.068 -2.105 0.972 1.00 40.14 H new ATOM 2039 N PHE A 137 -5.697 -2.759 1.148 1.00 42.34 N ATOM 2040 CA PHE A 137 -4.707 -3.790 1.380 1.00 44.00 C ATOM 2041 C PHE A 137 -5.377 -5.122 1.617 1.00 73.42 C ATOM 2042 O PHE A 137 -6.115 -5.294 2.579 1.00 22.30 O ATOM 2043 CB PHE A 137 -3.804 -3.401 2.559 1.00 21.00 C ATOM 2044 CG PHE A 137 -2.783 -4.438 2.944 1.00 31.34 C ATOM 2045 CD1 PHE A 137 -1.773 -4.799 2.073 1.00 21.42 C ATOM 2046 CD2 PHE A 137 -2.826 -5.033 4.189 1.00 41.21 C ATOM 2047 CE1 PHE A 137 -0.829 -5.731 2.437 1.00 41.44 C ATOM 2048 CE2 PHE A 137 -1.890 -5.969 4.558 1.00 1.03 C ATOM 2049 CZ PHE A 137 -0.890 -6.317 3.685 1.00 23.01 C ATOM 0 H PHE A 137 -6.352 -2.621 1.918 1.00 42.34 H new ATOM 0 HA PHE A 137 -4.081 -3.886 0.493 1.00 44.00 H new ATOM 0 HB2 PHE A 137 -3.285 -2.476 2.310 1.00 21.00 H new ATOM 0 HB3 PHE A 137 -4.432 -3.191 3.425 1.00 21.00 H new ATOM 0 HD1 PHE A 137 -1.724 -4.344 1.095 1.00 21.42 H new ATOM 0 HD2 PHE A 137 -3.607 -4.759 4.883 1.00 41.21 H new ATOM 0 HE1 PHE A 137 -0.043 -6.003 1.748 1.00 41.44 H new ATOM 0 HE2 PHE A 137 -1.941 -6.430 5.533 1.00 1.03 H new ATOM 0 HZ PHE A 137 -0.151 -7.049 3.975 1.00 23.01 H new ATOM 2059 N LEU A 138 -5.107 -6.060 0.756 1.00 21.04 N ATOM 2060 CA LEU A 138 -5.730 -7.362 0.815 1.00 63.31 C ATOM 2061 C LEU A 138 -4.671 -8.415 1.020 1.00 75.33 C ATOM 2062 O LEU A 138 -3.468 -8.118 1.010 1.00 3.14 O ATOM 2063 CB LEU A 138 -6.496 -7.703 -0.498 1.00 33.30 C ATOM 2064 CG LEU A 138 -7.635 -6.773 -0.959 1.00 73.12 C ATOM 2065 CD1 LEU A 138 -8.614 -6.490 0.161 1.00 11.40 C ATOM 2066 CD2 LEU A 138 -7.110 -5.491 -1.599 1.00 1.04 C ATOM 0 H LEU A 138 -4.446 -5.948 -0.013 1.00 21.04 H new ATOM 0 HA LEU A 138 -6.440 -7.344 1.642 1.00 63.31 H new ATOM 0 HB2 LEU A 138 -5.763 -7.751 -1.304 1.00 33.30 H new ATOM 0 HB3 LEU A 138 -6.913 -8.704 -0.386 1.00 33.30 H new ATOM 0 HG LEU A 138 -8.183 -7.305 -1.737 1.00 73.12 H new ATOM 0 HD11 LEU A 138 -9.402 -5.831 -0.203 1.00 11.40 H new ATOM 0 HD12 LEU A 138 -9.054 -7.426 0.505 1.00 11.40 H new ATOM 0 HD13 LEU A 138 -8.092 -6.009 0.988 1.00 11.40 H new ATOM 0 HD21 LEU A 138 -7.950 -4.868 -1.908 1.00 1.04 H new ATOM 0 HD22 LEU A 138 -6.501 -4.947 -0.877 1.00 1.04 H new ATOM 0 HD23 LEU A 138 -6.504 -5.741 -2.470 1.00 1.04 H new ATOM 2078 N ALA A 139 -5.107 -9.628 1.215 1.00 11.25 N ATOM 2079 CA ALA A 139 -4.214 -10.747 1.272 1.00 63.20 C ATOM 2080 C ALA A 139 -3.691 -10.991 -0.135 1.00 22.21 C ATOM 2081 O ALA A 139 -4.379 -10.695 -1.126 1.00 73.24 O ATOM 2082 CB ALA A 139 -4.929 -11.978 1.804 1.00 62.34 C ATOM 0 H ALA A 139 -6.091 -9.867 1.339 1.00 11.25 H new ATOM 0 HA ALA A 139 -3.387 -10.538 1.950 1.00 63.20 H new ATOM 0 HB1 ALA A 139 -4.233 -12.816 1.839 1.00 62.34 H new ATOM 0 HB2 ALA A 139 -5.304 -11.776 2.807 1.00 62.34 H new ATOM 0 HB3 ALA A 139 -5.763 -12.226 1.148 1.00 62.34 H new ATOM 2088 N GLY A 140 -2.509 -11.491 -0.232 1.00 22.21 N ATOM 2089 CA GLY A 140 -1.911 -11.691 -1.512 1.00 61.24 C ATOM 2090 C GLY A 140 -2.097 -13.089 -1.988 1.00 23.04 C ATOM 2091 O GLY A 140 -2.988 -13.802 -1.497 1.00 64.23 O ATOM 0 H GLY A 140 -1.932 -11.771 0.561 1.00 22.21 H new ATOM 0 HA2 GLY A 140 -2.349 -10.999 -2.232 1.00 61.24 H new ATOM 0 HA3 GLY A 140 -0.847 -11.463 -1.457 1.00 61.24 H new ATOM 2095 N PRO A 141 -1.290 -13.534 -2.938 1.00 74.43 N ATOM 2096 CA PRO A 141 -1.391 -14.869 -3.452 1.00 74.14 C ATOM 2097 C PRO A 141 -0.954 -15.876 -2.421 1.00 45.02 C ATOM 2098 O PRO A 141 0.181 -15.831 -1.915 1.00 5.45 O ATOM 2099 CB PRO A 141 -0.442 -14.909 -4.645 1.00 5.52 C ATOM 2100 CG PRO A 141 -0.050 -13.487 -4.892 1.00 62.25 C ATOM 2101 CD PRO A 141 -0.207 -12.781 -3.580 1.00 21.12 C ATOM 0 HA PRO A 141 -2.417 -15.115 -3.724 1.00 74.14 H new ATOM 0 HB2 PRO A 141 0.431 -15.525 -4.431 1.00 5.52 H new ATOM 0 HB3 PRO A 141 -0.929 -15.339 -5.520 1.00 5.52 H new ATOM 0 HG2 PRO A 141 0.978 -13.422 -5.249 1.00 62.25 H new ATOM 0 HG3 PRO A 141 -0.682 -13.035 -5.656 1.00 62.25 H new ATOM 0 HD2 PRO A 141 0.710 -12.810 -2.992 1.00 21.12 H new ATOM 0 HD3 PRO A 141 -0.467 -11.731 -3.713 1.00 21.12 H new ATOM 2109 N ALA A 142 -1.842 -16.757 -2.111 1.00 40.03 N ATOM 2110 CA ALA A 142 -1.573 -17.805 -1.194 1.00 14.44 C ATOM 2111 C ALA A 142 -0.946 -18.897 -2.004 1.00 72.35 C ATOM 2112 O ALA A 142 -1.625 -19.588 -2.771 1.00 13.21 O ATOM 2113 CB ALA A 142 -2.867 -18.269 -0.544 1.00 22.11 C ATOM 0 H ALA A 142 -2.787 -16.768 -2.494 1.00 40.03 H new ATOM 0 HA ALA A 142 -0.912 -17.491 -0.386 1.00 14.44 H new ATOM 0 HB1 ALA A 142 -2.653 -19.074 0.159 1.00 22.11 H new ATOM 0 HB2 ALA A 142 -3.326 -17.436 -0.012 1.00 22.11 H new ATOM 0 HB3 ALA A 142 -3.551 -18.630 -1.312 1.00 22.11 H new ATOM 2119 N GLU A 143 0.335 -19.019 -1.884 1.00 33.33 N ATOM 2120 CA GLU A 143 1.083 -19.886 -2.723 1.00 70.34 C ATOM 2121 C GLU A 143 2.253 -20.419 -1.926 1.00 63.22 C ATOM 2122 O GLU A 143 3.288 -19.761 -1.843 1.00 38.30 O ATOM 2123 CB GLU A 143 1.520 -19.072 -3.941 1.00 2.32 C ATOM 2124 CG GLU A 143 2.181 -19.832 -5.068 1.00 24.14 C ATOM 2125 CD GLU A 143 2.462 -18.913 -6.229 1.00 52.41 C ATOM 2126 OE1 GLU A 143 3.487 -18.209 -6.210 1.00 34.43 O ATOM 2127 OE2 GLU A 143 1.635 -18.839 -7.169 1.00 72.21 O ATOM 2128 OXT GLU A 143 2.099 -21.485 -1.296 1.00 38.30 O ATOM 0 H GLU A 143 0.893 -18.515 -1.195 1.00 33.33 H new ATOM 0 HA GLU A 143 0.506 -20.743 -3.071 1.00 70.34 H new ATOM 0 HB2 GLU A 143 0.643 -18.564 -4.342 1.00 2.32 H new ATOM 0 HB3 GLU A 143 2.209 -18.298 -3.603 1.00 2.32 H new ATOM 0 HG2 GLU A 143 3.111 -20.279 -4.717 1.00 24.14 H new ATOM 0 HG3 GLU A 143 1.536 -20.649 -5.391 1.00 24.14 H new TER 2135 GLU A 143