USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1038 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 130 ASN : amide:sc= -0.193 K(o=-0.19,f=-1.9!) USER MOD Set 1.2: A 133 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 46 THR OG1 : rot -170:sc= -1.73 USER MOD Set 2.2: A 63 MET CE :methyl -167:sc= -2.45 (180deg=-2.5) USER MOD Set 3.1: A 26 SER OG : rot 150:sc= 0.283 USER MOD Set 3.2: A 27 THR OG1 : rot 180:sc= 0.048 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.039 (180deg=0) USER MOD Single : A 3 MET CE :methyl 158:sc= -0.796 (180deg=-2.47) USER MOD Single : A 4 THR OG1 : rot 83:sc= 0.272 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.128 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 130:sc= 0.0387 USER MOD Single : A 36 ASN : amide:sc= -0.138 K(o=-0.14,f=-2.3!) USER MOD Single : A 37 HIS : no HE2:sc= 0.26 K(o=0.26,f=-4!) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -149:sc= 0 (180deg=-0.831) USER MOD Single : A 53 GLN : amide:sc= -1.65 K(o=-1.6,f=-7.4!) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.124 F(o=-1.2,f=-0.12) USER MOD Single : A 72 ASN : amide:sc= -2.23 K(o=-2.2,f=-6.2) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 79 ASN : amide:sc= -0.404 K(o=-0.4,f=-4.2!) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.477 USER MOD Single : A 90 GLN : amide:sc= -0.053 K(o=-0.053,f=-1.1) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 95 THR OG1 : rot 89:sc= 1.24 USER MOD Single : A 102 ASN : amide:sc= -1.37 K(o=-1.4,f=-3.6!) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= -0.411 K(o=-0.41,f=-2.3) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 ASN : amide:sc= -0.0752 K(o=-0.075,f=-1.3) USER MOD Single : A 124 THR OG1 : rot 69:sc= 1.08 USER MOD Single : A 129 SER OG : rot 86:sc= 0.981 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.694 -0.025 -2.335 1.00 33.42 N ATOM 2 CA MET A 1 2.780 0.955 -1.759 1.00 43.15 C ATOM 3 C MET A 1 3.486 2.288 -1.533 1.00 1.30 C ATOM 4 O MET A 1 4.713 2.346 -1.447 1.00 32.24 O ATOM 5 CB MET A 1 2.208 0.437 -0.439 1.00 32.02 C ATOM 6 CG MET A 1 0.757 -0.005 -0.537 1.00 71.43 C ATOM 7 SD MET A 1 0.517 -1.339 -1.727 1.00 54.32 S ATOM 8 CE MET A 1 -1.249 -1.226 -2.010 1.00 24.44 C ATOM 0 H1 MET A 1 3.407 -0.981 -2.043 1.00 33.42 H new ATOM 0 H2 MET A 1 3.667 0.043 -3.372 1.00 33.42 H new ATOM 0 H3 MET A 1 4.661 0.164 -2.001 1.00 33.42 H new ATOM 0 HA MET A 1 1.963 1.111 -2.463 1.00 43.15 H new ATOM 0 HB2 MET A 1 2.812 -0.402 -0.095 1.00 32.02 H new ATOM 0 HB3 MET A 1 2.291 1.220 0.315 1.00 32.02 H new ATOM 0 HG2 MET A 1 0.414 -0.332 0.444 1.00 71.43 H new ATOM 0 HG3 MET A 1 0.140 0.847 -0.823 1.00 71.43 H new ATOM 0 HE1 MET A 1 -1.552 -1.989 -2.727 1.00 24.44 H new ATOM 0 HE2 MET A 1 -1.779 -1.380 -1.070 1.00 24.44 H new ATOM 0 HE3 MET A 1 -1.492 -0.240 -2.406 1.00 24.44 H new ATOM 18 N VAL A 2 2.703 3.359 -1.438 1.00 25.41 N ATOM 19 CA VAL A 2 3.254 4.691 -1.221 1.00 12.24 C ATOM 20 C VAL A 2 2.639 5.345 0.012 1.00 45.21 C ATOM 21 O VAL A 2 1.831 4.736 0.712 1.00 5.23 O ATOM 22 CB VAL A 2 3.020 5.601 -2.441 1.00 71.24 C ATOM 23 CG1 VAL A 2 3.685 5.016 -3.678 1.00 51.33 C ATOM 24 CG2 VAL A 2 1.531 5.807 -2.674 1.00 11.52 C ATOM 0 H VAL A 2 1.686 3.329 -1.508 1.00 25.41 H new ATOM 0 HA VAL A 2 4.326 4.569 -1.068 1.00 12.24 H new ATOM 0 HB VAL A 2 3.471 6.573 -2.240 1.00 71.24 H new ATOM 0 HG11 VAL A 2 3.509 5.672 -4.530 1.00 51.33 H new ATOM 0 HG12 VAL A 2 4.757 4.924 -3.506 1.00 51.33 H new ATOM 0 HG13 VAL A 2 3.265 4.032 -3.885 1.00 51.33 H new ATOM 0 HG21 VAL A 2 1.384 6.453 -3.540 1.00 11.52 H new ATOM 0 HG22 VAL A 2 1.054 4.844 -2.855 1.00 11.52 H new ATOM 0 HG23 VAL A 2 1.086 6.273 -1.795 1.00 11.52 H new ATOM 34 N MET A 3 3.028 6.590 0.270 1.00 21.54 N ATOM 35 CA MET A 3 2.514 7.327 1.418 1.00 12.52 C ATOM 36 C MET A 3 1.359 8.235 1.008 1.00 54.22 C ATOM 37 O MET A 3 1.219 8.589 -0.164 1.00 32.14 O ATOM 38 CB MET A 3 3.628 8.158 2.058 1.00 33.15 C ATOM 39 CG MET A 3 3.385 8.472 3.526 1.00 54.43 C ATOM 40 SD MET A 3 4.580 9.646 4.192 1.00 42.33 S ATOM 41 CE MET A 3 4.276 11.069 3.147 1.00 13.12 C ATOM 0 H MET A 3 3.696 7.108 -0.300 1.00 21.54 H new ATOM 0 HA MET A 3 2.145 6.605 2.146 1.00 12.52 H new ATOM 0 HB2 MET A 3 4.572 7.621 1.961 1.00 33.15 H new ATOM 0 HB3 MET A 3 3.735 9.093 1.508 1.00 33.15 H new ATOM 0 HG2 MET A 3 2.380 8.876 3.646 1.00 54.43 H new ATOM 0 HG3 MET A 3 3.428 7.548 4.103 1.00 54.43 H new ATOM 0 HE1 MET A 3 4.625 11.971 3.650 1.00 13.12 H new ATOM 0 HE2 MET A 3 4.811 10.949 2.205 1.00 13.12 H new ATOM 0 HE3 MET A 3 3.207 11.154 2.950 1.00 13.12 H new ATOM 51 N THR A 4 0.532 8.610 1.979 1.00 32.32 N ATOM 52 CA THR A 4 -0.612 9.475 1.719 1.00 63.35 C ATOM 53 C THR A 4 -0.637 10.657 2.680 1.00 40.40 C ATOM 54 O THR A 4 -1.052 10.526 3.831 1.00 35.33 O ATOM 55 CB THR A 4 -1.939 8.702 1.838 1.00 51.43 C ATOM 56 OG1 THR A 4 -1.737 7.326 1.498 1.00 32.03 O ATOM 57 CG2 THR A 4 -2.999 9.304 0.927 1.00 0.34 C ATOM 0 H THR A 4 0.634 8.328 2.954 1.00 32.32 H new ATOM 0 HA THR A 4 -0.505 9.843 0.699 1.00 63.35 H new ATOM 0 HB THR A 4 -2.285 8.774 2.869 1.00 51.43 H new ATOM 0 HG1 THR A 4 -1.386 6.845 2.276 1.00 32.03 H new ATOM 0 HG21 THR A 4 -3.927 8.742 1.028 1.00 0.34 H new ATOM 0 HG22 THR A 4 -3.172 10.343 1.207 1.00 0.34 H new ATOM 0 HG23 THR A 4 -2.658 9.259 -0.107 1.00 0.34 H new ATOM 65 N VAL A 5 -0.190 11.814 2.200 1.00 34.12 N ATOM 66 CA VAL A 5 -0.164 13.021 3.017 1.00 4.22 C ATOM 67 C VAL A 5 -1.367 13.910 2.724 1.00 34.34 C ATOM 68 O VAL A 5 -1.775 14.060 1.573 1.00 51.35 O ATOM 69 CB VAL A 5 1.126 13.829 2.782 1.00 3.42 C ATOM 70 CG1 VAL A 5 1.237 14.247 1.324 1.00 53.12 C ATOM 71 CG2 VAL A 5 1.168 15.044 3.698 1.00 61.53 C ATOM 0 H VAL A 5 0.159 11.940 1.250 1.00 34.12 H new ATOM 0 HA VAL A 5 -0.199 12.699 4.058 1.00 4.22 H new ATOM 0 HB VAL A 5 1.980 13.194 3.019 1.00 3.42 H new ATOM 0 HG11 VAL A 5 2.155 14.817 1.178 1.00 53.12 H new ATOM 0 HG12 VAL A 5 1.256 13.359 0.692 1.00 53.12 H new ATOM 0 HG13 VAL A 5 0.380 14.865 1.056 1.00 53.12 H new ATOM 0 HG21 VAL A 5 2.086 15.603 3.519 1.00 61.53 H new ATOM 0 HG22 VAL A 5 0.308 15.683 3.495 1.00 61.53 H new ATOM 0 HG23 VAL A 5 1.140 14.717 4.737 1.00 61.53 H new ATOM 81 N ARG A 6 -1.932 14.497 3.775 1.00 71.54 N ATOM 82 CA ARG A 6 -3.090 15.370 3.630 1.00 13.24 C ATOM 83 C ARG A 6 -2.942 16.617 4.497 1.00 1.22 C ATOM 84 O ARG A 6 -2.495 16.541 5.642 1.00 53.01 O ATOM 85 CB ARG A 6 -4.370 14.622 4.009 1.00 51.41 C ATOM 86 CG ARG A 6 -4.560 14.460 5.508 1.00 1.01 C ATOM 87 CD ARG A 6 -5.126 13.091 5.853 1.00 51.40 C ATOM 88 NE ARG A 6 -6.499 12.933 5.382 1.00 72.53 N ATOM 89 CZ ARG A 6 -7.128 11.764 5.331 1.00 71.43 C ATOM 90 NH1 ARG A 6 -6.510 10.657 5.720 1.00 12.14 N ATOM 91 NH2 ARG A 6 -8.378 11.700 4.890 1.00 61.14 N ATOM 0 H ARG A 6 -1.606 14.384 4.735 1.00 71.54 H new ATOM 0 HA ARG A 6 -3.153 15.679 2.586 1.00 13.24 H new ATOM 0 HB2 ARG A 6 -5.227 15.155 3.598 1.00 51.41 H new ATOM 0 HB3 ARG A 6 -4.355 13.636 3.545 1.00 51.41 H new ATOM 0 HG2 ARG A 6 -3.604 14.598 6.014 1.00 1.01 H new ATOM 0 HG3 ARG A 6 -5.231 15.236 5.877 1.00 1.01 H new ATOM 0 HD2 ARG A 6 -4.499 12.317 5.410 1.00 51.40 H new ATOM 0 HD3 ARG A 6 -5.094 12.947 6.933 1.00 51.40 H new ATOM 0 HE ARG A 6 -7.003 13.765 5.075 1.00 72.53 H new ATOM 0 HH11 ARG A 6 -5.549 10.702 6.059 1.00 12.14 H new ATOM 0 HH12 ARG A 6 -6.995 9.761 5.680 1.00 12.14 H new ATOM 0 HH21 ARG A 6 -8.857 12.549 4.590 1.00 61.14 H new ATOM 0 HH22 ARG A 6 -8.860 10.802 4.851 1.00 61.14 H new ATOM 105 N VAL A 7 -3.319 17.765 3.943 1.00 11.11 N ATOM 106 CA VAL A 7 -3.229 19.029 4.665 1.00 23.40 C ATOM 107 C VAL A 7 -4.577 19.420 5.259 1.00 72.11 C ATOM 108 O VAL A 7 -5.619 19.247 4.626 1.00 51.44 O ATOM 109 CB VAL A 7 -2.734 20.164 3.749 1.00 15.23 C ATOM 110 CG1 VAL A 7 -2.615 21.465 4.529 1.00 63.04 C ATOM 111 CG2 VAL A 7 -1.405 19.792 3.110 1.00 74.03 C ATOM 0 H VAL A 7 -3.690 17.846 2.996 1.00 11.11 H new ATOM 0 HA VAL A 7 -2.510 18.883 5.471 1.00 23.40 H new ATOM 0 HB VAL A 7 -3.464 20.310 2.953 1.00 15.23 H new ATOM 0 HG11 VAL A 7 -2.264 22.256 3.866 1.00 63.04 H new ATOM 0 HG12 VAL A 7 -3.590 21.737 4.934 1.00 63.04 H new ATOM 0 HG13 VAL A 7 -1.906 21.336 5.347 1.00 63.04 H new ATOM 0 HG21 VAL A 7 -1.070 20.605 2.466 1.00 74.03 H new ATOM 0 HG22 VAL A 7 -0.663 19.617 3.889 1.00 74.03 H new ATOM 0 HG23 VAL A 7 -1.528 18.886 2.516 1.00 74.03 H new ATOM 121 N ILE A 8 -4.550 19.948 6.478 1.00 62.21 N ATOM 122 CA ILE A 8 -5.770 20.365 7.157 1.00 53.34 C ATOM 123 C ILE A 8 -5.556 21.666 7.923 1.00 43.11 C ATOM 124 O ILE A 8 -4.465 21.928 8.429 1.00 63.25 O ATOM 125 CB ILE A 8 -6.270 19.284 8.133 1.00 64.11 C ATOM 126 CG1 ILE A 8 -6.294 17.917 7.445 1.00 2.25 C ATOM 127 CG2 ILE A 8 -7.651 19.643 8.659 1.00 33.42 C ATOM 128 CD1 ILE A 8 -5.001 17.145 7.591 1.00 74.31 C ATOM 0 H ILE A 8 -3.696 20.097 7.016 1.00 62.21 H new ATOM 0 HA ILE A 8 -6.523 20.521 6.384 1.00 53.34 H new ATOM 0 HB ILE A 8 -5.584 19.232 8.978 1.00 64.11 H new ATOM 0 HG12 ILE A 8 -7.110 17.325 7.859 1.00 2.25 H new ATOM 0 HG13 ILE A 8 -6.507 18.056 6.385 1.00 2.25 H new ATOM 0 HG21 ILE A 8 -7.991 18.869 9.348 1.00 33.42 H new ATOM 0 HG22 ILE A 8 -7.604 20.599 9.181 1.00 33.42 H new ATOM 0 HG23 ILE A 8 -8.349 19.719 7.826 1.00 33.42 H new ATOM 0 HD11 ILE A 8 -5.090 16.187 7.079 1.00 74.31 H new ATOM 0 HD12 ILE A 8 -4.184 17.717 7.151 1.00 74.31 H new ATOM 0 HD13 ILE A 8 -4.796 16.974 8.648 1.00 74.31 H new ATOM 140 N ALA A 9 -6.605 22.477 8.006 1.00 10.41 N ATOM 141 CA ALA A 9 -6.533 23.749 8.714 1.00 1.42 C ATOM 142 C ALA A 9 -7.582 23.823 9.818 1.00 0.34 C ATOM 143 O ALA A 9 -8.562 23.078 9.828 1.00 61.02 O ATOM 144 CB ALA A 9 -6.706 24.906 7.741 1.00 71.12 C ATOM 0 H ALA A 9 -7.515 22.276 7.592 1.00 10.41 H new ATOM 0 HA ALA A 9 -5.549 23.823 9.178 1.00 1.42 H new ATOM 0 HB1 ALA A 9 -6.650 25.849 8.284 1.00 71.12 H new ATOM 0 HB2 ALA A 9 -5.916 24.872 6.991 1.00 71.12 H new ATOM 0 HB3 ALA A 9 -7.676 24.827 7.250 1.00 71.12 H new ATOM 150 N PRO A 10 -7.374 24.742 10.773 1.00 40.51 N ATOM 151 CA PRO A 10 -8.291 24.935 11.900 1.00 55.12 C ATOM 152 C PRO A 10 -9.621 25.543 11.467 1.00 34.12 C ATOM 153 O PRO A 10 -10.557 25.641 12.261 1.00 11.42 O ATOM 154 CB PRO A 10 -7.534 25.902 12.813 1.00 25.10 C ATOM 155 CG PRO A 10 -6.613 26.640 11.903 1.00 32.31 C ATOM 156 CD PRO A 10 -6.227 25.665 10.825 1.00 33.11 C ATOM 0 HA PRO A 10 -8.552 23.991 12.379 1.00 55.12 H new ATOM 0 HB2 PRO A 10 -8.217 26.582 13.322 1.00 25.10 H new ATOM 0 HB3 PRO A 10 -6.982 25.367 13.586 1.00 25.10 H new ATOM 0 HG2 PRO A 10 -7.103 27.517 11.479 1.00 32.31 H new ATOM 0 HG3 PRO A 10 -5.734 26.995 12.441 1.00 32.31 H new ATOM 0 HD2 PRO A 10 -6.069 26.164 9.869 1.00 33.11 H new ATOM 0 HD3 PRO A 10 -5.302 25.143 11.068 1.00 33.11 H new ATOM 164 N ASP A 11 -9.698 25.948 10.205 1.00 53.34 N ATOM 165 CA ASP A 11 -10.915 26.545 9.666 1.00 41.30 C ATOM 166 C ASP A 11 -11.636 25.569 8.742 1.00 52.00 C ATOM 167 O ASP A 11 -12.832 25.710 8.484 1.00 62.52 O ATOM 168 CB ASP A 11 -10.585 27.833 8.910 1.00 50.30 C ATOM 169 CG ASP A 11 -11.557 28.954 9.223 1.00 32.42 C ATOM 170 OD1 ASP A 11 -11.416 29.580 10.295 1.00 74.51 O ATOM 171 OD2 ASP A 11 -12.458 29.205 8.396 1.00 13.24 O ATOM 0 H ASP A 11 -8.932 25.874 9.535 1.00 53.34 H new ATOM 0 HA ASP A 11 -11.575 26.782 10.501 1.00 41.30 H new ATOM 0 HB2 ASP A 11 -9.574 28.151 9.164 1.00 50.30 H new ATOM 0 HB3 ASP A 11 -10.597 27.635 7.838 1.00 50.30 H new ATOM 176 N LYS A 12 -10.901 24.580 8.245 1.00 35.45 N ATOM 177 CA LYS A 12 -11.470 23.579 7.350 1.00 24.10 C ATOM 178 C LYS A 12 -10.398 22.603 6.874 1.00 1.42 C ATOM 179 O LYS A 12 -9.278 22.596 7.387 1.00 71.12 O ATOM 180 CB LYS A 12 -12.128 24.257 6.146 1.00 21.22 C ATOM 181 CG LYS A 12 -13.564 23.821 5.913 1.00 12.31 C ATOM 182 CD LYS A 12 -14.418 24.968 5.398 1.00 61.22 C ATOM 183 CE LYS A 12 -15.508 25.341 6.391 1.00 44.40 C ATOM 184 NZ LYS A 12 -16.829 24.774 6.004 1.00 10.20 N ATOM 0 H LYS A 12 -9.910 24.450 8.447 1.00 35.45 H new ATOM 0 HA LYS A 12 -12.226 23.021 7.903 1.00 24.10 H new ATOM 0 HB2 LYS A 12 -12.104 25.337 6.290 1.00 21.22 H new ATOM 0 HB3 LYS A 12 -11.542 24.041 5.253 1.00 21.22 H new ATOM 0 HG2 LYS A 12 -13.584 23.000 5.196 1.00 12.31 H new ATOM 0 HG3 LYS A 12 -13.986 23.441 6.844 1.00 12.31 H new ATOM 0 HD2 LYS A 12 -13.787 25.836 5.206 1.00 61.22 H new ATOM 0 HD3 LYS A 12 -14.871 24.687 4.447 1.00 61.22 H new ATOM 0 HE2 LYS A 12 -15.235 24.980 7.383 1.00 44.40 H new ATOM 0 HE3 LYS A 12 -15.584 26.426 6.456 1.00 44.40 H new ATOM 0 HZ1 LYS A 12 -17.545 25.051 6.706 1.00 10.20 H new ATOM 0 HZ2 LYS A 12 -17.102 25.138 5.069 1.00 10.20 H new ATOM 0 HZ3 LYS A 12 -16.764 23.737 5.967 1.00 10.20 H new ATOM 198 N THR A 13 -10.747 21.781 5.889 1.00 12.44 N ATOM 199 CA THR A 13 -9.815 20.802 5.344 1.00 15.33 C ATOM 200 C THR A 13 -9.287 21.244 3.984 1.00 34.31 C ATOM 201 O THR A 13 -9.979 21.930 3.232 1.00 44.35 O ATOM 202 CB THR A 13 -10.475 19.418 5.201 1.00 32.34 C ATOM 203 OG1 THR A 13 -9.534 18.480 4.667 1.00 34.43 O ATOM 204 CG2 THR A 13 -11.696 19.491 4.297 1.00 62.35 C ATOM 0 H THR A 13 -11.669 21.774 5.452 1.00 12.44 H new ATOM 0 HA THR A 13 -8.985 20.730 6.047 1.00 15.33 H new ATOM 0 HB THR A 13 -10.795 19.088 6.189 1.00 32.34 H new ATOM 0 HG1 THR A 13 -9.961 17.602 4.581 1.00 34.43 H new ATOM 0 HG21 THR A 13 -12.145 18.501 4.211 1.00 62.35 H new ATOM 0 HG22 THR A 13 -12.423 20.184 4.722 1.00 62.35 H new ATOM 0 HG23 THR A 13 -11.397 19.840 3.309 1.00 62.35 H new ATOM 212 N VAL A 14 -8.058 20.845 3.674 1.00 61.22 N ATOM 213 CA VAL A 14 -7.438 21.198 2.403 1.00 44.05 C ATOM 214 C VAL A 14 -7.610 20.082 1.378 1.00 0.21 C ATOM 215 O VAL A 14 -8.361 20.223 0.413 1.00 31.40 O ATOM 216 CB VAL A 14 -5.936 21.495 2.574 1.00 10.10 C ATOM 217 CG1 VAL A 14 -5.358 22.081 1.295 1.00 61.11 C ATOM 218 CG2 VAL A 14 -5.710 22.433 3.750 1.00 41.52 C ATOM 0 H VAL A 14 -7.472 20.277 4.286 1.00 61.22 H new ATOM 0 HA VAL A 14 -7.940 22.097 2.045 1.00 44.05 H new ATOM 0 HB VAL A 14 -5.419 20.558 2.781 1.00 10.10 H new ATOM 0 HG11 VAL A 14 -4.296 22.284 1.435 1.00 61.11 H new ATOM 0 HG12 VAL A 14 -5.487 21.370 0.479 1.00 61.11 H new ATOM 0 HG13 VAL A 14 -5.876 23.009 1.053 1.00 61.11 H new ATOM 0 HG21 VAL A 14 -4.644 22.632 3.857 1.00 41.52 H new ATOM 0 HG22 VAL A 14 -6.239 23.370 3.575 1.00 41.52 H new ATOM 0 HG23 VAL A 14 -6.086 21.970 4.662 1.00 41.52 H new ATOM 228 N TRP A 15 -6.910 18.975 1.595 1.00 32.41 N ATOM 229 CA TRP A 15 -6.986 17.833 0.690 1.00 12.22 C ATOM 230 C TRP A 15 -6.057 16.714 1.146 1.00 22.04 C ATOM 231 O TRP A 15 -5.297 16.876 2.101 1.00 2.33 O ATOM 232 CB TRP A 15 -6.629 18.261 -0.734 1.00 60.32 C ATOM 233 CG TRP A 15 -7.611 17.785 -1.761 1.00 72.43 C ATOM 234 CD1 TRP A 15 -8.896 18.216 -1.928 1.00 73.41 C ATOM 235 CD2 TRP A 15 -7.388 16.785 -2.762 1.00 11.11 C ATOM 236 NE1 TRP A 15 -9.486 17.544 -2.972 1.00 44.11 N ATOM 237 CE2 TRP A 15 -8.581 16.662 -3.501 1.00 20.22 C ATOM 238 CE3 TRP A 15 -6.296 15.984 -3.107 1.00 33.01 C ATOM 239 CZ2 TRP A 15 -8.710 15.769 -4.561 1.00 53.04 C ATOM 240 CZ3 TRP A 15 -6.426 15.098 -4.160 1.00 14.25 C ATOM 241 CH2 TRP A 15 -7.626 14.997 -4.877 1.00 64.13 C ATOM 0 H TRP A 15 -6.283 18.843 2.389 1.00 32.41 H new ATOM 0 HA TRP A 15 -8.009 17.458 0.703 1.00 12.22 H new ATOM 0 HB2 TRP A 15 -6.570 19.349 -0.775 1.00 60.32 H new ATOM 0 HB3 TRP A 15 -5.639 17.879 -0.983 1.00 60.32 H new ATOM 0 HD1 TRP A 15 -9.378 18.974 -1.328 1.00 73.41 H new ATOM 0 HE1 TRP A 15 -10.442 17.680 -3.300 1.00 44.11 H new ATOM 0 HE3 TRP A 15 -5.367 16.056 -2.561 1.00 33.01 H new ATOM 0 HZ2 TRP A 15 -9.634 15.689 -5.115 1.00 53.04 H new ATOM 0 HZ3 TRP A 15 -5.589 14.473 -4.435 1.00 14.25 H new ATOM 0 HH2 TRP A 15 -7.696 14.296 -5.695 1.00 64.13 H new ATOM 252 N ASP A 16 -6.122 15.579 0.459 1.00 52.33 N ATOM 253 CA ASP A 16 -5.285 14.433 0.793 1.00 2.22 C ATOM 254 C ASP A 16 -4.728 13.780 -0.468 1.00 51.43 C ATOM 255 O ASP A 16 -5.396 12.965 -1.104 1.00 12.52 O ATOM 256 CB ASP A 16 -6.083 13.410 1.602 1.00 33.21 C ATOM 257 CG ASP A 16 -7.346 12.967 0.890 1.00 71.22 C ATOM 258 OD1 ASP A 16 -8.230 13.819 0.665 1.00 14.35 O ATOM 259 OD2 ASP A 16 -7.451 11.767 0.557 1.00 5.43 O ATOM 0 H ASP A 16 -6.746 15.428 -0.333 1.00 52.33 H new ATOM 0 HA ASP A 16 -4.449 14.789 1.395 1.00 2.22 H new ATOM 0 HB2 ASP A 16 -5.457 12.540 1.800 1.00 33.21 H new ATOM 0 HB3 ASP A 16 -6.346 13.841 2.568 1.00 33.21 H new ATOM 264 N ALA A 17 -3.501 14.145 -0.825 1.00 50.31 N ATOM 265 CA ALA A 17 -2.854 13.595 -2.010 1.00 34.33 C ATOM 266 C ALA A 17 -1.748 12.617 -1.627 1.00 54.10 C ATOM 267 O ALA A 17 -1.220 12.644 -0.515 1.00 51.23 O ATOM 268 CB ALA A 17 -2.295 14.715 -2.875 1.00 35.24 C ATOM 0 H ALA A 17 -2.935 14.820 -0.310 1.00 50.31 H new ATOM 0 HA ALA A 17 -3.604 13.049 -2.583 1.00 34.33 H new ATOM 0 HB1 ALA A 17 -1.815 14.289 -3.756 1.00 35.24 H new ATOM 0 HB2 ALA A 17 -3.106 15.374 -3.186 1.00 35.24 H new ATOM 0 HB3 ALA A 17 -1.563 15.286 -2.303 1.00 35.24 H new ATOM 274 N PRO A 18 -1.389 11.731 -2.568 1.00 2.41 N ATOM 275 CA PRO A 18 -0.342 10.728 -2.352 1.00 12.01 C ATOM 276 C PRO A 18 1.048 11.349 -2.266 1.00 53.45 C ATOM 277 O PRO A 18 1.213 12.552 -2.467 1.00 5.22 O ATOM 278 CB PRO A 18 -0.451 9.830 -3.587 1.00 35.14 C ATOM 279 CG PRO A 18 -1.051 10.700 -4.636 1.00 50.44 C ATOM 280 CD PRO A 18 -1.976 11.642 -3.915 1.00 70.54 C ATOM 0 HA PRO A 18 -0.475 10.198 -1.409 1.00 12.01 H new ATOM 0 HB2 PRO A 18 0.527 9.458 -3.893 1.00 35.14 H new ATOM 0 HB3 PRO A 18 -1.076 8.959 -3.389 1.00 35.14 H new ATOM 0 HG2 PRO A 18 -0.279 11.248 -5.176 1.00 50.44 H new ATOM 0 HG3 PRO A 18 -1.594 10.106 -5.371 1.00 50.44 H new ATOM 0 HD2 PRO A 18 -2.016 12.617 -4.401 1.00 70.54 H new ATOM 0 HD3 PRO A 18 -2.996 11.259 -3.884 1.00 70.54 H new ATOM 288 N ALA A 19 2.044 10.521 -1.968 1.00 53.43 N ATOM 289 CA ALA A 19 3.420 10.990 -1.859 1.00 73.22 C ATOM 290 C ALA A 19 4.368 9.838 -1.544 1.00 42.11 C ATOM 291 O ALA A 19 4.050 8.963 -0.739 1.00 43.42 O ATOM 292 CB ALA A 19 3.526 12.071 -0.794 1.00 23.45 C ATOM 0 H ALA A 19 1.924 9.523 -1.798 1.00 53.43 H new ATOM 0 HA ALA A 19 3.712 11.414 -2.820 1.00 73.22 H new ATOM 0 HB1 ALA A 19 4.559 12.412 -0.723 1.00 23.45 H new ATOM 0 HB2 ALA A 19 2.884 12.910 -1.062 1.00 23.45 H new ATOM 0 HB3 ALA A 19 3.211 11.666 0.168 1.00 23.45 H new ATOM 298 N GLU A 20 5.533 9.845 -2.184 1.00 62.25 N ATOM 299 CA GLU A 20 6.527 8.799 -1.972 1.00 73.34 C ATOM 300 C GLU A 20 7.564 9.234 -0.941 1.00 53.21 C ATOM 301 O GLU A 20 8.202 8.401 -0.299 1.00 1.33 O ATOM 302 CB GLU A 20 7.219 8.447 -3.291 1.00 0.21 C ATOM 303 CG GLU A 20 6.768 7.121 -3.880 1.00 44.34 C ATOM 304 CD GLU A 20 7.520 5.939 -3.299 1.00 54.23 C ATOM 305 OE1 GLU A 20 8.467 6.164 -2.517 1.00 73.42 O ATOM 306 OE2 GLU A 20 7.159 4.789 -3.627 1.00 4.00 O ATOM 0 H GLU A 20 5.812 10.563 -2.853 1.00 62.25 H new ATOM 0 HA GLU A 20 6.012 7.916 -1.593 1.00 73.34 H new ATOM 0 HB2 GLU A 20 7.028 9.240 -4.014 1.00 0.21 H new ATOM 0 HB3 GLU A 20 8.296 8.415 -3.129 1.00 0.21 H new ATOM 0 HG2 GLU A 20 5.701 6.992 -3.700 1.00 44.34 H new ATOM 0 HG3 GLU A 20 6.909 7.141 -4.961 1.00 44.34 H new ATOM 313 N GLU A 21 7.725 10.545 -0.790 1.00 0.12 N ATOM 314 CA GLU A 21 8.685 11.091 0.162 1.00 3.01 C ATOM 315 C GLU A 21 8.462 12.587 0.363 1.00 40.23 C ATOM 316 O GLU A 21 8.330 13.341 -0.601 1.00 54.34 O ATOM 317 CB GLU A 21 10.115 10.838 -0.320 1.00 62.21 C ATOM 318 CG GLU A 21 11.026 10.261 0.751 1.00 13.42 C ATOM 319 CD GLU A 21 12.145 11.209 1.137 1.00 63.53 C ATOM 320 OE1 GLU A 21 12.829 11.720 0.225 1.00 23.42 O ATOM 321 OE2 GLU A 21 12.338 11.438 2.349 1.00 51.42 O ATOM 0 H GLU A 21 7.204 11.248 -1.314 1.00 0.12 H new ATOM 0 HA GLU A 21 8.536 10.588 1.117 1.00 3.01 H new ATOM 0 HB2 GLU A 21 10.088 10.154 -1.169 1.00 62.21 H new ATOM 0 HB3 GLU A 21 10.539 11.775 -0.679 1.00 62.21 H new ATOM 0 HG2 GLU A 21 10.435 10.023 1.636 1.00 13.42 H new ATOM 0 HG3 GLU A 21 11.455 9.325 0.393 1.00 13.42 H new ATOM 328 N VAL A 22 8.421 13.010 1.622 1.00 32.23 N ATOM 329 CA VAL A 22 8.214 14.415 1.951 1.00 41.21 C ATOM 330 C VAL A 22 9.373 14.963 2.777 1.00 74.41 C ATOM 331 O VAL A 22 9.734 14.397 3.809 1.00 32.32 O ATOM 332 CB VAL A 22 6.901 14.623 2.728 1.00 33.42 C ATOM 333 CG1 VAL A 22 5.704 14.268 1.859 1.00 51.21 C ATOM 334 CG2 VAL A 22 6.903 13.799 4.007 1.00 4.23 C ATOM 0 H VAL A 22 8.529 12.399 2.432 1.00 32.23 H new ATOM 0 HA VAL A 22 8.157 14.955 1.006 1.00 41.21 H new ATOM 0 HB VAL A 22 6.823 15.676 3.000 1.00 33.42 H new ATOM 0 HG11 VAL A 22 4.785 14.421 2.425 1.00 51.21 H new ATOM 0 HG12 VAL A 22 5.695 14.904 0.974 1.00 51.21 H new ATOM 0 HG13 VAL A 22 5.773 13.224 1.554 1.00 51.21 H new ATOM 0 HG21 VAL A 22 5.968 13.958 4.544 1.00 4.23 H new ATOM 0 HG22 VAL A 22 7.004 12.742 3.759 1.00 4.23 H new ATOM 0 HG23 VAL A 22 7.739 14.105 4.636 1.00 4.23 H new ATOM 344 N ILE A 23 9.951 16.067 2.316 1.00 32.41 N ATOM 345 CA ILE A 23 11.068 16.691 3.014 1.00 52.54 C ATOM 346 C ILE A 23 10.759 18.145 3.354 1.00 10.52 C ATOM 347 O ILE A 23 10.335 18.919 2.495 1.00 42.52 O ATOM 348 CB ILE A 23 12.358 16.635 2.174 1.00 11.44 C ATOM 349 CG1 ILE A 23 12.717 15.184 1.847 1.00 14.40 C ATOM 350 CG2 ILE A 23 13.501 17.315 2.914 1.00 54.44 C ATOM 351 CD1 ILE A 23 13.679 15.047 0.688 1.00 73.41 C ATOM 0 H ILE A 23 9.665 16.547 1.463 1.00 32.41 H new ATOM 0 HA ILE A 23 11.219 16.129 3.935 1.00 52.54 H new ATOM 0 HB ILE A 23 12.188 17.167 1.238 1.00 11.44 H new ATOM 0 HG12 ILE A 23 13.156 14.719 2.730 1.00 14.40 H new ATOM 0 HG13 ILE A 23 11.804 14.635 1.618 1.00 14.40 H new ATOM 0 HG21 ILE A 23 14.406 17.268 2.308 1.00 54.44 H new ATOM 0 HG22 ILE A 23 13.244 18.358 3.101 1.00 54.44 H new ATOM 0 HG23 ILE A 23 13.673 16.808 3.863 1.00 54.44 H new ATOM 0 HD11 ILE A 23 13.889 13.992 0.512 1.00 73.41 H new ATOM 0 HD12 ILE A 23 13.235 15.483 -0.207 1.00 73.41 H new ATOM 0 HD13 ILE A 23 14.608 15.568 0.922 1.00 73.41 H new ATOM 363 N LEU A 24 10.976 18.511 4.613 1.00 54.23 N ATOM 364 CA LEU A 24 10.722 19.874 5.068 1.00 64.02 C ATOM 365 C LEU A 24 11.519 20.183 6.332 1.00 75.33 C ATOM 366 O LEU A 24 11.955 19.287 7.054 1.00 23.42 O ATOM 367 CB LEU A 24 9.229 20.076 5.330 1.00 70.01 C ATOM 368 CG LEU A 24 8.473 18.863 5.873 1.00 52.00 C ATOM 369 CD1 LEU A 24 7.313 19.306 6.751 1.00 55.45 C ATOM 370 CD2 LEU A 24 7.976 17.989 4.731 1.00 62.23 C ATOM 0 H LEU A 24 11.327 17.883 5.336 1.00 54.23 H new ATOM 0 HA LEU A 24 11.042 20.559 4.282 1.00 64.02 H new ATOM 0 HB2 LEU A 24 9.112 20.898 6.037 1.00 70.01 H new ATOM 0 HB3 LEU A 24 8.756 20.387 4.399 1.00 70.01 H new ATOM 0 HG LEU A 24 9.159 18.275 6.482 1.00 52.00 H new ATOM 0 HD11 LEU A 24 6.787 18.429 7.128 1.00 55.45 H new ATOM 0 HD12 LEU A 24 7.693 19.890 7.589 1.00 55.45 H new ATOM 0 HD13 LEU A 24 6.626 19.917 6.165 1.00 55.45 H new ATOM 0 HD21 LEU A 24 7.440 17.131 5.136 1.00 62.23 H new ATOM 0 HD22 LEU A 24 7.306 18.568 4.095 1.00 62.23 H new ATOM 0 HD23 LEU A 24 8.825 17.642 4.142 1.00 62.23 H new ATOM 382 N PRO A 25 11.711 21.481 6.608 1.00 51.12 N ATOM 383 CA PRO A 25 12.453 21.938 7.787 1.00 53.33 C ATOM 384 C PRO A 25 11.698 21.673 9.085 1.00 2.20 C ATOM 385 O PRO A 25 10.512 21.980 9.198 1.00 13.54 O ATOM 386 CB PRO A 25 12.600 23.444 7.551 1.00 33.35 C ATOM 387 CG PRO A 25 11.456 23.802 6.666 1.00 4.21 C ATOM 388 CD PRO A 25 11.219 22.603 5.791 1.00 73.13 C ATOM 0 HA PRO A 25 13.403 21.416 7.899 1.00 53.33 H new ATOM 0 HB2 PRO A 25 12.563 23.997 8.489 1.00 33.35 H new ATOM 0 HB3 PRO A 25 13.554 23.680 7.080 1.00 33.35 H new ATOM 0 HG2 PRO A 25 10.568 24.039 7.252 1.00 4.21 H new ATOM 0 HG3 PRO A 25 11.687 24.683 6.067 1.00 4.21 H new ATOM 0 HD2 PRO A 25 10.163 22.488 5.545 1.00 73.13 H new ATOM 0 HD3 PRO A 25 11.760 22.681 4.848 1.00 73.13 H new ATOM 396 N SER A 26 12.394 21.101 10.062 1.00 3.44 N ATOM 397 CA SER A 26 11.789 20.792 11.352 1.00 34.13 C ATOM 398 C SER A 26 12.697 21.229 12.498 1.00 71.53 C ATOM 399 O SER A 26 13.682 21.937 12.290 1.00 43.44 O ATOM 400 CB SER A 26 11.500 19.293 11.458 1.00 45.12 C ATOM 401 OG SER A 26 10.657 19.012 12.562 1.00 43.35 O ATOM 0 H SER A 26 13.378 20.842 9.985 1.00 3.44 H new ATOM 0 HA SER A 26 10.851 21.342 11.426 1.00 34.13 H new ATOM 0 HB2 SER A 26 11.029 18.945 10.539 1.00 45.12 H new ATOM 0 HB3 SER A 26 12.437 18.746 11.563 1.00 45.12 H new ATOM 0 HG SER A 26 10.112 18.222 12.365 1.00 43.35 H new ATOM 407 N THR A 27 12.358 20.800 13.710 1.00 41.02 N ATOM 408 CA THR A 27 13.141 21.147 14.889 1.00 33.54 C ATOM 409 C THR A 27 14.625 20.884 14.661 1.00 12.21 C ATOM 410 O THR A 27 15.449 21.795 14.752 1.00 53.25 O ATOM 411 CB THR A 27 12.675 20.354 16.125 1.00 30.23 C ATOM 412 OG1 THR A 27 12.065 19.124 15.717 1.00 11.23 O ATOM 413 CG2 THR A 27 11.688 21.167 16.949 1.00 32.32 C ATOM 0 H THR A 27 11.547 20.212 13.900 1.00 41.02 H new ATOM 0 HA THR A 27 12.987 22.211 15.069 1.00 33.54 H new ATOM 0 HB THR A 27 13.548 20.139 16.741 1.00 30.23 H new ATOM 0 HG1 THR A 27 11.773 18.625 16.509 1.00 11.23 H new ATOM 0 HG21 THR A 27 11.373 20.587 17.816 1.00 32.32 H new ATOM 0 HG22 THR A 27 12.165 22.088 17.283 1.00 32.32 H new ATOM 0 HG23 THR A 27 10.818 21.409 16.339 1.00 32.32 H new ATOM 421 N THR A 28 14.961 19.633 14.364 1.00 61.22 N ATOM 422 CA THR A 28 16.347 19.250 14.123 1.00 53.42 C ATOM 423 C THR A 28 16.910 19.967 12.901 1.00 61.52 C ATOM 424 O THR A 28 18.123 20.010 12.699 1.00 11.10 O ATOM 425 CB THR A 28 16.483 17.729 13.920 1.00 14.45 C ATOM 426 OG1 THR A 28 15.221 17.172 13.535 1.00 22.23 O ATOM 427 CG2 THR A 28 16.973 17.056 15.193 1.00 22.12 C ATOM 0 H THR A 28 14.292 18.867 14.284 1.00 61.22 H new ATOM 0 HA THR A 28 16.914 19.543 15.007 1.00 53.42 H new ATOM 0 HB THR A 28 17.213 17.553 13.130 1.00 14.45 H new ATOM 0 HG1 THR A 28 15.316 16.205 13.406 1.00 22.23 H new ATOM 0 HG21 THR A 28 17.062 15.982 15.026 1.00 22.12 H new ATOM 0 HG22 THR A 28 17.947 17.462 15.468 1.00 22.12 H new ATOM 0 HG23 THR A 28 16.263 17.241 15.999 1.00 22.12 H new ATOM 435 N GLY A 29 16.021 20.528 12.087 1.00 11.33 N ATOM 436 CA GLY A 29 16.450 21.236 10.895 1.00 75.10 C ATOM 437 C GLY A 29 15.994 20.554 9.621 1.00 74.45 C ATOM 438 O GLY A 29 15.489 21.206 8.707 1.00 34.41 O ATOM 0 H GLY A 29 15.012 20.505 12.232 1.00 11.33 H new ATOM 0 HA2 GLY A 29 16.058 22.253 10.919 1.00 75.10 H new ATOM 0 HA3 GLY A 29 17.537 21.313 10.893 1.00 75.10 H new ATOM 442 N GLN A 30 16.174 19.238 9.558 1.00 13.24 N ATOM 443 CA GLN A 30 15.779 18.468 8.385 1.00 51.33 C ATOM 444 C GLN A 30 14.775 17.382 8.758 1.00 2.53 C ATOM 445 O GLN A 30 14.959 16.665 9.742 1.00 34.25 O ATOM 446 CB GLN A 30 17.007 17.839 7.725 1.00 60.12 C ATOM 447 CG GLN A 30 17.520 18.619 6.525 1.00 73.21 C ATOM 448 CD GLN A 30 17.667 17.756 5.287 1.00 31.44 C ATOM 449 OE1 GLN A 30 18.699 17.116 5.082 1.00 52.04 O ATOM 450 NE2 GLN A 30 16.633 17.733 4.455 1.00 74.41 N ATOM 0 H GLN A 30 16.591 18.683 10.306 1.00 13.24 H new ATOM 0 HA GLN A 30 15.304 19.148 7.679 1.00 51.33 H new ATOM 0 HB2 GLN A 30 17.805 17.759 8.463 1.00 60.12 H new ATOM 0 HB3 GLN A 30 16.761 16.825 7.410 1.00 60.12 H new ATOM 0 HG2 GLN A 30 16.836 19.441 6.311 1.00 73.21 H new ATOM 0 HG3 GLN A 30 18.485 19.063 6.770 1.00 73.21 H new ATOM 0 HE21 GLN A 30 15.797 18.279 4.665 1.00 74.41 H new ATOM 0 HE22 GLN A 30 16.674 17.169 3.606 1.00 74.41 H new ATOM 459 N LEU A 31 13.714 17.267 7.967 1.00 1.44 N ATOM 460 CA LEU A 31 12.680 16.269 8.215 1.00 20.41 C ATOM 461 C LEU A 31 12.425 15.428 6.968 1.00 54.51 C ATOM 462 O LEU A 31 12.473 15.933 5.847 1.00 60.52 O ATOM 463 CB LEU A 31 11.384 16.948 8.661 1.00 72.32 C ATOM 464 CG LEU A 31 10.620 16.259 9.793 1.00 44.52 C ATOM 465 CD1 LEU A 31 10.122 14.893 9.347 1.00 4.35 C ATOM 466 CD2 LEU A 31 11.499 16.132 11.028 1.00 24.05 C ATOM 0 H LEU A 31 13.547 17.853 7.149 1.00 1.44 H new ATOM 0 HA LEU A 31 13.029 15.610 9.010 1.00 20.41 H new ATOM 0 HB2 LEU A 31 11.620 17.965 8.975 1.00 72.32 H new ATOM 0 HB3 LEU A 31 10.723 17.026 7.798 1.00 72.32 H new ATOM 0 HG LEU A 31 9.755 16.872 10.048 1.00 44.52 H new ATOM 0 HD11 LEU A 31 9.581 14.418 10.165 1.00 4.35 H new ATOM 0 HD12 LEU A 31 9.457 15.010 8.492 1.00 4.35 H new ATOM 0 HD13 LEU A 31 10.971 14.271 9.064 1.00 4.35 H new ATOM 0 HD21 LEU A 31 10.940 15.640 11.824 1.00 24.05 H new ATOM 0 HD22 LEU A 31 12.383 15.541 10.786 1.00 24.05 H new ATOM 0 HD23 LEU A 31 11.805 17.124 11.360 1.00 24.05 H new ATOM 478 N GLY A 32 12.150 14.143 7.172 1.00 1.50 N ATOM 479 CA GLY A 32 11.889 13.254 6.055 1.00 12.33 C ATOM 480 C GLY A 32 10.995 12.091 6.437 1.00 12.31 C ATOM 481 O GLY A 32 11.366 11.261 7.268 1.00 53.52 O ATOM 0 H GLY A 32 12.103 13.702 8.091 1.00 1.50 H new ATOM 0 HA2 GLY A 32 11.422 13.818 5.247 1.00 12.33 H new ATOM 0 HA3 GLY A 32 12.834 12.871 5.671 1.00 12.33 H new ATOM 485 N ILE A 33 9.814 12.031 5.831 1.00 12.21 N ATOM 486 CA ILE A 33 8.865 10.962 6.113 1.00 34.52 C ATOM 487 C ILE A 33 8.553 10.157 4.856 1.00 42.24 C ATOM 488 O ILE A 33 8.605 10.681 3.742 1.00 75.22 O ATOM 489 CB ILE A 33 7.550 11.514 6.694 1.00 12.32 C ATOM 490 CG1 ILE A 33 7.842 12.500 7.828 1.00 61.43 C ATOM 491 CG2 ILE A 33 6.669 10.376 7.188 1.00 2.22 C ATOM 492 CD1 ILE A 33 6.601 13.144 8.403 1.00 15.21 C ATOM 0 H ILE A 33 9.492 12.710 5.142 1.00 12.21 H new ATOM 0 HA ILE A 33 9.334 10.312 6.851 1.00 34.52 H new ATOM 0 HB ILE A 33 7.016 12.044 5.905 1.00 12.32 H new ATOM 0 HG12 ILE A 33 8.373 11.978 8.624 1.00 61.43 H new ATOM 0 HG13 ILE A 33 8.508 13.280 7.458 1.00 61.43 H new ATOM 0 HG21 ILE A 33 5.744 10.783 7.596 1.00 2.22 H new ATOM 0 HG22 ILE A 33 6.437 9.709 6.358 1.00 2.22 H new ATOM 0 HG23 ILE A 33 7.194 9.820 7.965 1.00 2.22 H new ATOM 0 HD11 ILE A 33 6.884 13.830 9.201 1.00 15.21 H new ATOM 0 HD12 ILE A 33 6.080 13.694 7.619 1.00 15.21 H new ATOM 0 HD13 ILE A 33 5.943 12.373 8.804 1.00 15.21 H new ATOM 504 N LEU A 34 8.228 8.882 5.041 1.00 45.52 N ATOM 505 CA LEU A 34 7.906 8.005 3.921 1.00 21.31 C ATOM 506 C LEU A 34 6.757 7.067 4.278 1.00 64.42 C ATOM 507 O LEU A 34 6.237 7.103 5.393 1.00 73.34 O ATOM 508 CB LEU A 34 9.136 7.191 3.514 1.00 2.44 C ATOM 509 CG LEU A 34 10.475 7.928 3.566 1.00 50.43 C ATOM 510 CD1 LEU A 34 11.178 7.667 4.889 1.00 70.34 C ATOM 511 CD2 LEU A 34 11.358 7.512 2.399 1.00 62.43 C ATOM 0 H LEU A 34 8.181 8.433 5.956 1.00 45.52 H new ATOM 0 HA LEU A 34 7.596 8.627 3.081 1.00 21.31 H new ATOM 0 HB2 LEU A 34 9.199 6.317 4.162 1.00 2.44 H new ATOM 0 HB3 LEU A 34 8.985 6.824 2.499 1.00 2.44 H new ATOM 0 HG LEU A 34 10.282 8.998 3.486 1.00 50.43 H new ATOM 0 HD11 LEU A 34 12.129 8.200 4.907 1.00 70.34 H new ATOM 0 HD12 LEU A 34 10.551 8.016 5.709 1.00 70.34 H new ATOM 0 HD13 LEU A 34 11.359 6.598 5.000 1.00 70.34 H new ATOM 0 HD21 LEU A 34 12.307 8.046 2.452 1.00 62.43 H new ATOM 0 HD22 LEU A 34 11.543 6.439 2.447 1.00 62.43 H new ATOM 0 HD23 LEU A 34 10.858 7.752 1.461 1.00 62.43 H new ATOM 523 N SER A 35 6.369 6.226 3.324 1.00 14.23 N ATOM 524 CA SER A 35 5.280 5.279 3.537 1.00 4.12 C ATOM 525 C SER A 35 5.679 4.213 4.554 1.00 52.53 C ATOM 526 O SER A 35 4.914 3.889 5.461 1.00 72.43 O ATOM 527 CB SER A 35 4.886 4.617 2.215 1.00 2.24 C ATOM 528 OG SER A 35 5.476 5.286 1.114 1.00 25.12 O ATOM 0 H SER A 35 6.792 6.181 2.397 1.00 14.23 H new ATOM 0 HA SER A 35 4.424 5.829 3.929 1.00 4.12 H new ATOM 0 HB2 SER A 35 5.199 3.573 2.220 1.00 2.24 H new ATOM 0 HB3 SER A 35 3.801 4.624 2.110 1.00 2.24 H new ATOM 0 HG SER A 35 5.919 4.633 0.533 1.00 25.12 H new ATOM 534 N ASN A 36 6.883 3.673 4.394 1.00 14.22 N ATOM 535 CA ASN A 36 7.384 2.643 5.297 1.00 11.40 C ATOM 536 C ASN A 36 7.516 3.183 6.718 1.00 72.00 C ATOM 537 O ASN A 36 7.611 2.418 7.678 1.00 31.40 O ATOM 538 CB ASN A 36 8.738 2.123 4.809 1.00 13.23 C ATOM 539 CG ASN A 36 8.596 1.004 3.796 1.00 51.13 C ATOM 540 OD1 ASN A 36 7.517 0.435 3.630 1.00 60.03 O ATOM 541 ND2 ASN A 36 9.688 0.683 3.112 1.00 4.33 N ATOM 0 H ASN A 36 7.529 3.931 3.648 1.00 14.22 H new ATOM 0 HA ASN A 36 6.668 1.821 5.305 1.00 11.40 H new ATOM 0 HB2 ASN A 36 9.300 2.944 4.363 1.00 13.23 H new ATOM 0 HB3 ASN A 36 9.316 1.767 5.662 1.00 13.23 H new ATOM 0 HD21 ASN A 36 9.653 -0.062 2.416 1.00 4.33 H new ATOM 0 HD22 ASN A 36 10.561 1.182 3.282 1.00 4.33 H new ATOM 548 N HIS A 37 7.520 4.506 6.845 1.00 43.24 N ATOM 549 CA HIS A 37 7.639 5.149 8.149 1.00 42.04 C ATOM 550 C HIS A 37 6.640 4.558 9.139 1.00 53.55 C ATOM 551 O HIS A 37 5.641 3.958 8.743 1.00 20.12 O ATOM 552 CB HIS A 37 7.417 6.656 8.020 1.00 43.32 C ATOM 553 CG HIS A 37 8.086 7.454 9.096 1.00 0.35 C ATOM 554 ND1 HIS A 37 7.487 7.737 10.306 1.00 61.21 N ATOM 555 CD2 HIS A 37 9.310 8.029 9.141 1.00 5.52 C ATOM 556 CE1 HIS A 37 8.313 8.453 11.047 1.00 25.24 C ATOM 557 NE2 HIS A 37 9.427 8.644 10.364 1.00 64.22 N ATOM 0 H HIS A 37 7.442 5.154 6.061 1.00 43.24 H new ATOM 0 HA HIS A 37 8.646 4.969 8.525 1.00 42.04 H new ATOM 0 HB2 HIS A 37 7.787 6.988 7.050 1.00 43.32 H new ATOM 0 HB3 HIS A 37 6.346 6.860 8.040 1.00 43.32 H new ATOM 0 HD1 HIS A 37 6.552 7.440 10.585 1.00 61.21 H new ATOM 0 HD2 HIS A 37 10.056 8.008 8.361 1.00 5.52 H new ATOM 0 HE1 HIS A 37 8.112 8.820 12.043 1.00 25.24 H new ATOM 565 N ALA A 38 6.917 4.733 10.427 1.00 75.04 N ATOM 566 CA ALA A 38 6.041 4.219 11.473 1.00 63.44 C ATOM 567 C ALA A 38 5.111 5.308 11.995 1.00 0.10 C ATOM 568 O ALA A 38 5.323 6.500 11.769 1.00 32.31 O ATOM 569 CB ALA A 38 6.865 3.635 12.611 1.00 44.03 C ATOM 0 H ALA A 38 7.741 5.227 10.771 1.00 75.04 H new ATOM 0 HA ALA A 38 5.426 3.429 11.042 1.00 63.44 H new ATOM 0 HB1 ALA A 38 6.198 3.255 13.385 1.00 44.03 H new ATOM 0 HB2 ALA A 38 7.483 2.821 12.232 1.00 44.03 H new ATOM 0 HB3 ALA A 38 7.505 4.410 13.032 1.00 44.03 H new ATOM 575 N PRO A 39 4.055 4.893 12.710 1.00 71.20 N ATOM 576 CA PRO A 39 3.071 5.818 13.279 1.00 11.41 C ATOM 577 C PRO A 39 3.646 6.643 14.425 1.00 3.52 C ATOM 578 O PRO A 39 3.790 6.153 15.546 1.00 65.23 O ATOM 579 CB PRO A 39 1.966 4.891 13.790 1.00 34.13 C ATOM 580 CG PRO A 39 2.650 3.593 14.048 1.00 34.21 C ATOM 581 CD PRO A 39 3.740 3.488 13.018 1.00 23.33 C ATOM 0 HA PRO A 39 2.728 6.549 12.547 1.00 11.41 H new ATOM 0 HB2 PRO A 39 1.508 5.284 14.697 1.00 34.13 H new ATOM 0 HB3 PRO A 39 1.170 4.780 13.053 1.00 34.13 H new ATOM 0 HG2 PRO A 39 3.062 3.563 15.057 1.00 34.21 H new ATOM 0 HG3 PRO A 39 1.952 2.760 13.964 1.00 34.21 H new ATOM 0 HD2 PRO A 39 4.609 2.957 13.406 1.00 23.33 H new ATOM 0 HD3 PRO A 39 3.405 2.948 12.132 1.00 23.33 H new ATOM 589 N LEU A 40 3.973 7.899 14.138 1.00 21.33 N ATOM 590 CA LEU A 40 4.533 8.793 15.146 1.00 73.01 C ATOM 591 C LEU A 40 4.098 10.234 14.897 1.00 35.43 C ATOM 592 O LEU A 40 3.844 10.629 13.759 1.00 52.23 O ATOM 593 CB LEU A 40 6.060 8.702 15.145 1.00 13.13 C ATOM 594 CG LEU A 40 6.782 9.541 16.200 1.00 24.20 C ATOM 595 CD1 LEU A 40 7.801 8.695 16.949 1.00 74.13 C ATOM 596 CD2 LEU A 40 7.456 10.743 15.555 1.00 2.33 C ATOM 0 H LEU A 40 3.860 8.321 13.216 1.00 21.33 H new ATOM 0 HA LEU A 40 4.157 8.482 16.121 1.00 73.01 H new ATOM 0 HB2 LEU A 40 6.342 7.658 15.284 1.00 13.13 H new ATOM 0 HB3 LEU A 40 6.421 9.002 14.161 1.00 13.13 H new ATOM 0 HG LEU A 40 6.044 9.903 16.916 1.00 24.20 H new ATOM 0 HD11 LEU A 40 8.305 9.309 17.696 1.00 74.13 H new ATOM 0 HD12 LEU A 40 7.293 7.866 17.443 1.00 74.13 H new ATOM 0 HD13 LEU A 40 8.536 8.303 16.246 1.00 74.13 H new ATOM 0 HD21 LEU A 40 7.965 11.329 16.320 1.00 2.33 H new ATOM 0 HD22 LEU A 40 8.182 10.401 14.817 1.00 2.33 H new ATOM 0 HD23 LEU A 40 6.705 11.362 15.064 1.00 2.33 H new ATOM 608 N LEU A 41 4.015 11.014 15.969 1.00 42.41 N ATOM 609 CA LEU A 41 3.613 12.413 15.867 1.00 10.04 C ATOM 610 C LEU A 41 4.794 13.340 16.138 1.00 15.11 C ATOM 611 O LEU A 41 5.640 13.055 16.986 1.00 70.10 O ATOM 612 CB LEU A 41 2.480 12.711 16.851 1.00 71.01 C ATOM 613 CG LEU A 41 2.773 12.414 18.322 1.00 14.30 C ATOM 614 CD1 LEU A 41 2.044 13.401 19.221 1.00 43.41 C ATOM 615 CD2 LEU A 41 2.379 10.985 18.667 1.00 54.44 C ATOM 0 H LEU A 41 4.220 10.702 16.918 1.00 42.41 H new ATOM 0 HA LEU A 41 3.260 12.591 14.851 1.00 10.04 H new ATOM 0 HB2 LEU A 41 2.214 13.764 16.760 1.00 71.01 H new ATOM 0 HB3 LEU A 41 1.605 12.134 16.552 1.00 71.01 H new ATOM 0 HG LEU A 41 3.845 12.524 18.488 1.00 14.30 H new ATOM 0 HD11 LEU A 41 2.264 13.174 20.264 1.00 43.41 H new ATOM 0 HD12 LEU A 41 2.374 14.414 18.992 1.00 43.41 H new ATOM 0 HD13 LEU A 41 0.970 13.323 19.052 1.00 43.41 H new ATOM 0 HD21 LEU A 41 2.595 10.792 19.718 1.00 54.44 H new ATOM 0 HD22 LEU A 41 1.313 10.847 18.484 1.00 54.44 H new ATOM 0 HD23 LEU A 41 2.946 10.291 18.047 1.00 54.44 H new ATOM 627 N THR A 42 4.844 14.454 15.413 1.00 35.43 N ATOM 628 CA THR A 42 5.919 15.424 15.576 1.00 61.55 C ATOM 629 C THR A 42 5.422 16.843 15.324 1.00 64.55 C ATOM 630 O THR A 42 4.280 17.047 14.914 1.00 61.23 O ATOM 631 CB THR A 42 7.092 15.126 14.623 1.00 25.21 C ATOM 632 OG1 THR A 42 6.663 14.250 13.575 1.00 55.33 O ATOM 633 CG2 THR A 42 8.253 14.492 15.376 1.00 51.43 C ATOM 0 H THR A 42 4.152 14.706 14.707 1.00 35.43 H new ATOM 0 HA THR A 42 6.267 15.342 16.606 1.00 61.55 H new ATOM 0 HB THR A 42 7.429 16.069 14.192 1.00 25.21 H new ATOM 0 HG1 THR A 42 7.415 14.067 12.973 1.00 55.33 H new ATOM 0 HG21 THR A 42 9.070 14.290 14.683 1.00 51.43 H new ATOM 0 HG22 THR A 42 8.597 15.173 16.154 1.00 51.43 H new ATOM 0 HG23 THR A 42 7.925 13.558 15.831 1.00 51.43 H new ATOM 641 N ALA A 43 6.288 17.820 15.571 1.00 41.14 N ATOM 642 CA ALA A 43 5.938 19.220 15.367 1.00 14.35 C ATOM 643 C ALA A 43 6.783 19.843 14.262 1.00 42.12 C ATOM 644 O ALA A 43 7.984 19.586 14.165 1.00 10.31 O ATOM 645 CB ALA A 43 6.104 19.999 16.664 1.00 54.31 C ATOM 0 H ALA A 43 7.237 17.668 15.913 1.00 41.14 H new ATOM 0 HA ALA A 43 4.894 19.266 15.058 1.00 14.35 H new ATOM 0 HB1 ALA A 43 5.839 21.043 16.498 1.00 54.31 H new ATOM 0 HB2 ALA A 43 5.452 19.577 17.428 1.00 54.31 H new ATOM 0 HB3 ALA A 43 7.140 19.936 16.996 1.00 54.31 H new ATOM 651 N LEU A 44 6.150 20.662 13.429 1.00 11.14 N ATOM 652 CA LEU A 44 6.844 21.322 12.329 1.00 23.30 C ATOM 653 C LEU A 44 6.577 22.823 12.339 1.00 43.42 C ATOM 654 O LEU A 44 5.532 23.274 12.806 1.00 2.13 O ATOM 655 CB LEU A 44 6.406 20.723 10.991 1.00 20.14 C ATOM 656 CG LEU A 44 7.212 19.521 10.498 1.00 61.03 C ATOM 657 CD1 LEU A 44 8.632 19.938 10.147 1.00 52.34 C ATOM 658 CD2 LEU A 44 7.222 18.418 11.547 1.00 43.55 C ATOM 0 H LEU A 44 5.157 20.885 13.495 1.00 11.14 H new ATOM 0 HA LEU A 44 7.914 21.162 12.459 1.00 23.30 H new ATOM 0 HB2 LEU A 44 5.361 20.425 11.074 1.00 20.14 H new ATOM 0 HB3 LEU A 44 6.455 21.504 10.232 1.00 20.14 H new ATOM 0 HG LEU A 44 6.736 19.134 9.597 1.00 61.03 H new ATOM 0 HD11 LEU A 44 9.191 19.069 9.798 1.00 52.34 H new ATOM 0 HD12 LEU A 44 8.606 20.692 9.361 1.00 52.34 H new ATOM 0 HD13 LEU A 44 9.119 20.351 11.030 1.00 52.34 H new ATOM 0 HD21 LEU A 44 7.800 17.571 11.179 1.00 43.55 H new ATOM 0 HD22 LEU A 44 7.673 18.793 12.465 1.00 43.55 H new ATOM 0 HD23 LEU A 44 6.200 18.099 11.749 1.00 43.55 H new ATOM 670 N GLU A 45 7.529 23.592 11.818 1.00 73.14 N ATOM 671 CA GLU A 45 7.395 25.043 11.766 1.00 75.04 C ATOM 672 C GLU A 45 6.951 25.499 10.379 1.00 42.05 C ATOM 673 O GLU A 45 6.772 24.685 9.472 1.00 72.01 O ATOM 674 CB GLU A 45 8.719 25.713 12.136 1.00 42.42 C ATOM 675 CG GLU A 45 8.763 26.228 13.565 1.00 74.40 C ATOM 676 CD GLU A 45 9.584 27.495 13.704 1.00 31.44 C ATOM 677 OE1 GLU A 45 10.666 27.570 13.086 1.00 43.32 O ATOM 678 OE2 GLU A 45 9.145 28.410 14.432 1.00 60.24 O ATOM 0 H GLU A 45 8.400 23.234 11.426 1.00 73.14 H new ATOM 0 HA GLU A 45 6.633 25.338 12.487 1.00 75.04 H new ATOM 0 HB2 GLU A 45 9.530 25.000 11.991 1.00 42.42 H new ATOM 0 HB3 GLU A 45 8.899 26.544 11.454 1.00 42.42 H new ATOM 0 HG2 GLU A 45 7.747 26.419 13.910 1.00 74.40 H new ATOM 0 HG3 GLU A 45 9.180 25.457 14.212 1.00 74.40 H new ATOM 685 N THR A 46 6.775 26.807 10.220 1.00 4.31 N ATOM 686 CA THR A 46 6.352 27.373 8.946 1.00 74.35 C ATOM 687 C THR A 46 7.432 27.204 7.883 1.00 54.30 C ATOM 688 O THR A 46 8.620 27.150 8.195 1.00 23.13 O ATOM 689 CB THR A 46 6.009 28.868 9.081 1.00 41.45 C ATOM 690 OG1 THR A 46 5.730 29.425 7.791 1.00 10.43 O ATOM 691 CG2 THR A 46 7.155 29.629 9.730 1.00 10.41 C ATOM 0 H THR A 46 6.919 27.495 10.959 1.00 4.31 H new ATOM 0 HA THR A 46 5.458 26.830 8.641 1.00 74.35 H new ATOM 0 HB THR A 46 5.127 28.960 9.715 1.00 41.45 H new ATOM 0 HG1 THR A 46 5.668 30.400 7.862 1.00 10.43 H new ATOM 0 HG21 THR A 46 6.890 30.683 9.815 1.00 10.41 H new ATOM 0 HG22 THR A 46 7.346 29.222 10.723 1.00 10.41 H new ATOM 0 HG23 THR A 46 8.051 29.528 9.118 1.00 10.41 H new ATOM 699 N GLY A 47 7.010 27.123 6.625 1.00 71.34 N ATOM 700 CA GLY A 47 7.955 26.962 5.535 1.00 75.13 C ATOM 701 C GLY A 47 7.345 26.258 4.338 1.00 0.52 C ATOM 702 O GLY A 47 6.152 25.956 4.328 1.00 32.12 O ATOM 0 H GLY A 47 6.031 27.166 6.341 1.00 71.34 H new ATOM 0 HA2 GLY A 47 8.322 27.942 5.228 1.00 75.13 H new ATOM 0 HA3 GLY A 47 8.817 26.395 5.886 1.00 75.13 H new ATOM 706 N VAL A 48 8.166 25.999 3.325 1.00 35.42 N ATOM 707 CA VAL A 48 7.700 25.327 2.118 1.00 63.04 C ATOM 708 C VAL A 48 7.983 23.830 2.178 1.00 41.14 C ATOM 709 O VAL A 48 9.094 23.411 2.501 1.00 32.42 O ATOM 710 CB VAL A 48 8.365 25.914 0.858 1.00 75.42 C ATOM 711 CG1 VAL A 48 8.004 27.383 0.699 1.00 73.34 C ATOM 712 CG2 VAL A 48 9.873 25.730 0.917 1.00 5.21 C ATOM 0 H VAL A 48 9.156 26.244 3.316 1.00 35.42 H new ATOM 0 HA VAL A 48 6.623 25.488 2.061 1.00 63.04 H new ATOM 0 HB VAL A 48 7.991 25.377 -0.013 1.00 75.42 H new ATOM 0 HG11 VAL A 48 8.483 27.780 -0.196 1.00 73.34 H new ATOM 0 HG12 VAL A 48 6.923 27.484 0.608 1.00 73.34 H new ATOM 0 HG13 VAL A 48 8.348 27.939 1.571 1.00 73.34 H new ATOM 0 HG21 VAL A 48 10.326 26.150 0.019 1.00 5.21 H new ATOM 0 HG22 VAL A 48 10.268 26.240 1.796 1.00 5.21 H new ATOM 0 HG23 VAL A 48 10.108 24.667 0.978 1.00 5.21 H new ATOM 722 N MET A 49 6.970 23.029 1.863 1.00 44.10 N ATOM 723 CA MET A 49 7.111 21.578 1.880 1.00 71.35 C ATOM 724 C MET A 49 7.290 21.033 0.466 1.00 34.31 C ATOM 725 O MET A 49 6.526 21.367 -0.439 1.00 55.34 O ATOM 726 CB MET A 49 5.889 20.933 2.536 1.00 12.05 C ATOM 727 CG MET A 49 5.833 19.423 2.367 1.00 5.44 C ATOM 728 SD MET A 49 4.555 18.657 3.382 1.00 1.21 S ATOM 729 CE MET A 49 3.234 18.481 2.186 1.00 72.42 C ATOM 0 H MET A 49 6.044 23.360 1.593 1.00 44.10 H new ATOM 0 HA MET A 49 7.999 21.331 2.461 1.00 71.35 H new ATOM 0 HB2 MET A 49 5.890 21.171 3.600 1.00 12.05 H new ATOM 0 HB3 MET A 49 4.986 21.371 2.112 1.00 12.05 H new ATOM 0 HG2 MET A 49 5.650 19.185 1.319 1.00 5.44 H new ATOM 0 HG3 MET A 49 6.802 18.996 2.626 1.00 5.44 H new ATOM 0 HE1 MET A 49 2.272 18.560 2.692 1.00 72.42 H new ATOM 0 HE2 MET A 49 3.315 19.268 1.436 1.00 72.42 H new ATOM 0 HE3 MET A 49 3.310 17.508 1.701 1.00 72.42 H new ATOM 739 N ARG A 50 8.303 20.192 0.284 1.00 0.34 N ATOM 740 CA ARG A 50 8.582 19.603 -1.019 1.00 63.44 C ATOM 741 C ARG A 50 8.075 18.165 -1.086 1.00 0.02 C ATOM 742 O ARG A 50 8.593 17.281 -0.404 1.00 21.41 O ATOM 743 CB ARG A 50 10.084 19.639 -1.308 1.00 21.30 C ATOM 744 CG ARG A 50 10.670 21.041 -1.310 1.00 25.01 C ATOM 745 CD ARG A 50 12.091 21.050 -1.853 1.00 52.22 C ATOM 746 NE ARG A 50 13.075 21.318 -0.808 1.00 31.10 N ATOM 747 CZ ARG A 50 13.354 22.535 -0.356 1.00 2.40 C ATOM 748 NH1 ARG A 50 12.727 23.591 -0.855 1.00 14.43 N ATOM 749 NH2 ARG A 50 14.263 22.698 0.597 1.00 14.34 N ATOM 0 H ARG A 50 8.944 19.904 1.023 1.00 0.34 H new ATOM 0 HA ARG A 50 8.059 20.190 -1.774 1.00 63.44 H new ATOM 0 HB2 ARG A 50 10.604 19.038 -0.562 1.00 21.30 H new ATOM 0 HB3 ARG A 50 10.270 19.175 -2.277 1.00 21.30 H new ATOM 0 HG2 ARG A 50 10.044 21.697 -1.915 1.00 25.01 H new ATOM 0 HG3 ARG A 50 10.664 21.440 -0.296 1.00 25.01 H new ATOM 0 HD2 ARG A 50 12.308 20.088 -2.317 1.00 52.22 H new ATOM 0 HD3 ARG A 50 12.176 21.806 -2.633 1.00 52.22 H new ATOM 0 HE ARG A 50 13.576 20.527 -0.403 1.00 31.10 H new ATOM 0 HH11 ARG A 50 12.028 23.470 -1.588 1.00 14.43 H new ATOM 0 HH12 ARG A 50 12.943 24.525 -0.506 1.00 14.43 H new ATOM 0 HH21 ARG A 50 14.748 21.888 0.983 1.00 14.34 H new ATOM 0 HH22 ARG A 50 14.477 23.633 0.943 1.00 14.34 H new ATOM 763 N VAL A 51 7.058 17.939 -1.912 1.00 1.34 N ATOM 764 CA VAL A 51 6.481 16.610 -2.068 1.00 31.52 C ATOM 765 C VAL A 51 7.157 15.847 -3.202 1.00 32.24 C ATOM 766 O VAL A 51 7.401 16.398 -4.275 1.00 22.10 O ATOM 767 CB VAL A 51 4.967 16.684 -2.344 1.00 64.43 C ATOM 768 CG1 VAL A 51 4.360 15.289 -2.371 1.00 4.13 C ATOM 769 CG2 VAL A 51 4.278 17.554 -1.305 1.00 4.44 C ATOM 0 H VAL A 51 6.617 18.660 -2.483 1.00 1.34 H new ATOM 0 HA VAL A 51 6.646 16.081 -1.129 1.00 31.52 H new ATOM 0 HB VAL A 51 4.816 17.139 -3.323 1.00 64.43 H new ATOM 0 HG11 VAL A 51 3.290 15.361 -2.567 1.00 4.13 H new ATOM 0 HG12 VAL A 51 4.834 14.701 -3.157 1.00 4.13 H new ATOM 0 HG13 VAL A 51 4.520 14.804 -1.408 1.00 4.13 H new ATOM 0 HG21 VAL A 51 3.209 17.595 -1.516 1.00 4.44 H new ATOM 0 HG22 VAL A 51 4.436 17.131 -0.313 1.00 4.44 H new ATOM 0 HG23 VAL A 51 4.694 18.561 -1.340 1.00 4.44 H new ATOM 779 N ARG A 52 7.456 14.575 -2.956 1.00 40.41 N ATOM 780 CA ARG A 52 8.105 13.736 -3.956 1.00 53.35 C ATOM 781 C ARG A 52 7.232 12.535 -4.307 1.00 54.03 C ATOM 782 O ARG A 52 7.236 11.526 -3.602 1.00 51.34 O ATOM 783 CB ARG A 52 9.466 13.259 -3.448 1.00 3.42 C ATOM 784 CG ARG A 52 10.464 12.971 -4.557 1.00 60.25 C ATOM 785 CD ARG A 52 11.710 12.284 -4.021 1.00 63.23 C ATOM 786 NE ARG A 52 11.826 10.909 -4.499 1.00 73.41 N ATOM 787 CZ ARG A 52 12.957 10.213 -4.471 1.00 43.41 C ATOM 788 NH1 ARG A 52 14.064 10.762 -3.990 1.00 64.12 N ATOM 789 NH2 ARG A 52 12.983 8.966 -4.924 1.00 53.52 N ATOM 0 H ARG A 52 7.259 14.104 -2.073 1.00 40.41 H new ATOM 0 HA ARG A 52 8.250 14.334 -4.856 1.00 53.35 H new ATOM 0 HB2 ARG A 52 9.882 14.017 -2.784 1.00 3.42 H new ATOM 0 HB3 ARG A 52 9.326 12.356 -2.853 1.00 3.42 H new ATOM 0 HG2 ARG A 52 9.997 12.341 -5.314 1.00 60.25 H new ATOM 0 HG3 ARG A 52 10.744 13.903 -5.047 1.00 60.25 H new ATOM 0 HD2 ARG A 52 12.593 12.848 -4.322 1.00 63.23 H new ATOM 0 HD3 ARG A 52 11.686 12.288 -2.931 1.00 63.23 H new ATOM 0 HE ARG A 52 10.992 10.458 -4.875 1.00 73.41 H new ATOM 0 HH11 ARG A 52 14.048 11.720 -3.641 1.00 64.12 H new ATOM 0 HH12 ARG A 52 14.932 10.226 -3.969 1.00 64.12 H new ATOM 0 HH21 ARG A 52 12.133 8.540 -5.295 1.00 53.52 H new ATOM 0 HH22 ARG A 52 13.853 8.433 -4.902 1.00 53.52 H new ATOM 803 N GLN A 53 6.484 12.652 -5.400 1.00 43.22 N ATOM 804 CA GLN A 53 5.606 11.576 -5.843 1.00 54.21 C ATOM 805 C GLN A 53 6.359 10.587 -6.726 1.00 72.21 C ATOM 806 O GLN A 53 5.766 9.668 -7.292 1.00 14.22 O ATOM 807 CB GLN A 53 4.408 12.148 -6.604 1.00 20.10 C ATOM 808 CG GLN A 53 3.146 12.253 -5.762 1.00 45.24 C ATOM 809 CD GLN A 53 2.398 10.938 -5.665 1.00 42.33 C ATOM 810 OE1 GLN A 53 2.558 10.189 -4.701 1.00 43.41 O ATOM 811 NE2 GLN A 53 1.575 10.650 -6.666 1.00 54.34 N ATOM 0 H GLN A 53 6.469 13.481 -5.994 1.00 43.22 H new ATOM 0 HA GLN A 53 5.248 11.046 -4.960 1.00 54.21 H new ATOM 0 HB2 GLN A 53 4.667 13.137 -6.981 1.00 20.10 H new ATOM 0 HB3 GLN A 53 4.205 11.519 -7.471 1.00 20.10 H new ATOM 0 HG2 GLN A 53 3.410 12.591 -4.760 1.00 45.24 H new ATOM 0 HG3 GLN A 53 2.489 13.009 -6.191 1.00 45.24 H new ATOM 0 HE21 GLN A 53 1.473 11.300 -7.445 1.00 54.34 H new ATOM 0 HE22 GLN A 53 1.045 9.779 -6.656 1.00 54.34 H new ATOM 820 N ASP A 54 7.668 10.781 -6.840 1.00 20.11 N ATOM 821 CA ASP A 54 8.503 9.905 -7.654 1.00 10.03 C ATOM 822 C ASP A 54 8.138 10.024 -9.130 1.00 50.21 C ATOM 823 O ASP A 54 8.527 9.188 -9.945 1.00 64.14 O ATOM 824 CB ASP A 54 8.356 8.454 -7.195 1.00 34.53 C ATOM 825 CG ASP A 54 9.525 7.589 -7.623 1.00 4.42 C ATOM 826 OD1 ASP A 54 10.434 8.114 -8.300 1.00 12.33 O ATOM 827 OD2 ASP A 54 9.532 6.388 -7.282 1.00 21.24 O ATOM 0 H ASP A 54 8.174 11.537 -6.379 1.00 20.11 H new ATOM 0 HA ASP A 54 9.541 10.214 -7.529 1.00 10.03 H new ATOM 0 HB2 ASP A 54 8.267 8.427 -6.109 1.00 34.53 H new ATOM 0 HB3 ASP A 54 7.433 8.039 -7.601 1.00 34.53 H new ATOM 832 N ARG A 55 7.387 11.068 -9.466 1.00 44.15 N ATOM 833 CA ARG A 55 6.968 11.295 -10.844 1.00 52.21 C ATOM 834 C ARG A 55 6.121 12.560 -10.953 1.00 43.11 C ATOM 835 O ARG A 55 6.191 13.280 -11.948 1.00 52.43 O ATOM 836 CB ARG A 55 6.177 10.093 -11.364 1.00 0.14 C ATOM 837 CG ARG A 55 6.834 9.396 -12.543 1.00 62.53 C ATOM 838 CD ARG A 55 5.816 9.027 -13.611 1.00 34.15 C ATOM 839 NE ARG A 55 6.219 7.845 -14.368 1.00 4.14 N ATOM 840 CZ ARG A 55 5.401 7.168 -15.165 1.00 33.11 C ATOM 841 NH1 ARG A 55 4.140 7.554 -15.309 1.00 25.03 N ATOM 842 NH2 ARG A 55 5.842 6.102 -15.821 1.00 3.32 N ATOM 0 H ARG A 55 7.056 11.769 -8.803 1.00 44.15 H new ATOM 0 HA ARG A 55 7.863 11.423 -11.453 1.00 52.21 H new ATOM 0 HB2 ARG A 55 6.049 9.375 -10.554 1.00 0.14 H new ATOM 0 HB3 ARG A 55 5.181 10.424 -11.657 1.00 0.14 H new ATOM 0 HG2 ARG A 55 7.595 10.047 -12.974 1.00 62.53 H new ATOM 0 HG3 ARG A 55 7.343 8.496 -12.197 1.00 62.53 H new ATOM 0 HD2 ARG A 55 4.849 8.845 -13.142 1.00 34.15 H new ATOM 0 HD3 ARG A 55 5.686 9.867 -14.293 1.00 34.15 H new ATOM 0 HE ARG A 55 7.182 7.522 -14.280 1.00 4.14 H new ATOM 0 HH11 ARG A 55 3.797 8.373 -14.807 1.00 25.03 H new ATOM 0 HH12 ARG A 55 3.514 7.032 -15.922 1.00 25.03 H new ATOM 0 HH21 ARG A 55 6.811 5.802 -15.713 1.00 3.32 H new ATOM 0 HH22 ARG A 55 5.212 5.583 -16.433 1.00 3.32 H new ATOM 856 N GLU A 56 5.323 12.822 -9.923 1.00 52.31 N ATOM 857 CA GLU A 56 4.462 13.999 -9.905 1.00 2.32 C ATOM 858 C GLU A 56 4.831 14.925 -8.749 1.00 71.10 C ATOM 859 O GLU A 56 4.027 15.159 -7.847 1.00 13.21 O ATOM 860 CB GLU A 56 2.994 13.583 -9.791 1.00 41.42 C ATOM 861 CG GLU A 56 2.439 12.956 -11.059 1.00 23.11 C ATOM 862 CD GLU A 56 1.107 12.268 -10.835 1.00 13.05 C ATOM 863 OE1 GLU A 56 1.083 11.232 -10.138 1.00 60.23 O ATOM 864 OE2 GLU A 56 0.087 12.767 -11.356 1.00 22.05 O ATOM 0 H GLU A 56 5.255 12.236 -9.091 1.00 52.31 H new ATOM 0 HA GLU A 56 4.607 14.538 -10.841 1.00 2.32 H new ATOM 0 HB2 GLU A 56 2.889 12.875 -8.969 1.00 41.42 H new ATOM 0 HB3 GLU A 56 2.396 14.458 -9.536 1.00 41.42 H new ATOM 0 HG2 GLU A 56 2.322 13.728 -11.820 1.00 23.11 H new ATOM 0 HG3 GLU A 56 3.157 12.233 -11.446 1.00 23.11 H new ATOM 871 N TRP A 57 6.051 15.447 -8.784 1.00 5.13 N ATOM 872 CA TRP A 57 6.528 16.347 -7.739 1.00 73.30 C ATOM 873 C TRP A 57 5.546 17.492 -7.518 1.00 41.20 C ATOM 874 O TRP A 57 4.897 17.956 -8.456 1.00 0.24 O ATOM 875 CB TRP A 57 7.905 16.902 -8.105 1.00 0.33 C ATOM 876 CG TRP A 57 9.023 15.939 -7.842 1.00 10.33 C ATOM 877 CD1 TRP A 57 8.954 14.576 -7.872 1.00 22.34 C ATOM 878 CD2 TRP A 57 10.376 16.268 -7.507 1.00 32.51 C ATOM 879 NE1 TRP A 57 10.183 14.036 -7.576 1.00 12.45 N ATOM 880 CE2 TRP A 57 11.072 15.053 -7.349 1.00 1.33 C ATOM 881 CE3 TRP A 57 11.067 17.469 -7.327 1.00 61.44 C ATOM 882 CZ2 TRP A 57 12.424 15.008 -7.019 1.00 10.33 C ATOM 883 CZ3 TRP A 57 12.409 17.422 -7.000 1.00 13.34 C ATOM 884 CH2 TRP A 57 13.076 16.199 -6.849 1.00 10.43 C ATOM 0 H TRP A 57 6.728 15.263 -9.524 1.00 5.13 H new ATOM 0 HA TRP A 57 6.609 15.779 -6.812 1.00 73.30 H new ATOM 0 HB2 TRP A 57 7.910 17.174 -9.160 1.00 0.33 H new ATOM 0 HB3 TRP A 57 8.082 17.817 -7.539 1.00 0.33 H new ATOM 0 HD1 TRP A 57 8.065 14.006 -8.095 1.00 22.34 H new ATOM 0 HE1 TRP A 57 10.398 13.040 -7.532 1.00 12.45 H new ATOM 0 HE3 TRP A 57 10.562 18.417 -7.441 1.00 61.44 H new ATOM 0 HZ2 TRP A 57 12.940 14.066 -6.901 1.00 10.33 H new ATOM 0 HZ3 TRP A 57 12.953 18.344 -6.858 1.00 13.34 H new ATOM 0 HH2 TRP A 57 14.125 16.196 -6.593 1.00 10.43 H new ATOM 895 N VAL A 58 5.442 17.945 -6.272 1.00 70.25 N ATOM 896 CA VAL A 58 4.540 19.038 -5.929 1.00 71.41 C ATOM 897 C VAL A 58 5.141 19.927 -4.846 1.00 71.41 C ATOM 898 O VAL A 58 5.911 19.463 -4.005 1.00 52.52 O ATOM 899 CB VAL A 58 3.176 18.509 -5.446 1.00 3.02 C ATOM 900 CG1 VAL A 58 2.189 19.654 -5.276 1.00 63.22 C ATOM 901 CG2 VAL A 58 2.636 17.467 -6.414 1.00 11.24 C ATOM 0 H VAL A 58 5.971 17.572 -5.484 1.00 70.25 H new ATOM 0 HA VAL A 58 4.393 19.624 -6.836 1.00 71.41 H new ATOM 0 HB VAL A 58 3.313 18.033 -4.475 1.00 3.02 H new ATOM 0 HG11 VAL A 58 1.231 19.261 -4.934 1.00 63.22 H new ATOM 0 HG12 VAL A 58 2.574 20.361 -4.541 1.00 63.22 H new ATOM 0 HG13 VAL A 58 2.053 20.162 -6.231 1.00 63.22 H new ATOM 0 HG21 VAL A 58 1.672 17.104 -6.057 1.00 11.24 H new ATOM 0 HG22 VAL A 58 2.513 17.915 -7.400 1.00 11.24 H new ATOM 0 HG23 VAL A 58 3.336 16.634 -6.479 1.00 11.24 H new ATOM 911 N ALA A 59 4.783 21.206 -4.873 1.00 2.32 N ATOM 912 CA ALA A 59 5.285 22.160 -3.892 1.00 0.32 C ATOM 913 C ALA A 59 4.142 22.935 -3.245 1.00 40.53 C ATOM 914 O ALA A 59 3.215 23.376 -3.926 1.00 63.01 O ATOM 915 CB ALA A 59 6.272 23.117 -4.543 1.00 42.43 C ATOM 0 H ALA A 59 4.147 21.606 -5.563 1.00 2.32 H new ATOM 0 HA ALA A 59 5.799 21.602 -3.110 1.00 0.32 H new ATOM 0 HB1 ALA A 59 6.639 23.824 -3.798 1.00 42.43 H new ATOM 0 HB2 ALA A 59 7.110 22.553 -4.951 1.00 42.43 H new ATOM 0 HB3 ALA A 59 5.775 23.661 -5.346 1.00 42.43 H new ATOM 921 N ILE A 60 4.214 23.098 -1.928 1.00 73.35 N ATOM 922 CA ILE A 60 3.185 23.820 -1.191 1.00 54.11 C ATOM 923 C ILE A 60 3.793 24.636 -0.056 1.00 14.44 C ATOM 924 O ILE A 60 4.626 24.140 0.702 1.00 15.13 O ATOM 925 CB ILE A 60 2.129 22.860 -0.611 1.00 4.35 C ATOM 926 CG1 ILE A 60 1.480 22.044 -1.730 1.00 22.31 C ATOM 927 CG2 ILE A 60 1.076 23.637 0.165 1.00 41.52 C ATOM 928 CD1 ILE A 60 0.460 21.043 -1.234 1.00 61.11 C ATOM 0 H ILE A 60 4.974 22.740 -1.350 1.00 73.35 H new ATOM 0 HA ILE A 60 2.702 24.492 -1.900 1.00 54.11 H new ATOM 0 HB ILE A 60 2.623 22.172 0.075 1.00 4.35 H new ATOM 0 HG12 ILE A 60 0.998 22.724 -2.432 1.00 22.31 H new ATOM 0 HG13 ILE A 60 2.258 21.515 -2.281 1.00 22.31 H new ATOM 0 HG21 ILE A 60 0.337 22.945 0.569 1.00 41.52 H new ATOM 0 HG22 ILE A 60 1.552 24.177 0.983 1.00 41.52 H new ATOM 0 HG23 ILE A 60 0.584 24.346 -0.500 1.00 41.52 H new ATOM 0 HD11 ILE A 60 0.041 20.500 -2.081 1.00 61.11 H new ATOM 0 HD12 ILE A 60 0.941 20.339 -0.555 1.00 61.11 H new ATOM 0 HD13 ILE A 60 -0.338 21.567 -0.708 1.00 61.11 H new ATOM 940 N ALA A 61 3.369 25.891 0.057 1.00 72.12 N ATOM 941 CA ALA A 61 3.868 26.775 1.102 1.00 4.33 C ATOM 942 C ALA A 61 2.917 26.809 2.294 1.00 62.03 C ATOM 943 O ALA A 61 1.880 27.472 2.255 1.00 41.53 O ATOM 944 CB ALA A 61 4.078 28.178 0.552 1.00 54.14 C ATOM 0 H ALA A 61 2.681 26.318 -0.563 1.00 72.12 H new ATOM 0 HA ALA A 61 4.826 26.384 1.446 1.00 4.33 H new ATOM 0 HB1 ALA A 61 4.451 28.827 1.344 1.00 54.14 H new ATOM 0 HB2 ALA A 61 4.803 28.145 -0.262 1.00 54.14 H new ATOM 0 HB3 ALA A 61 3.131 28.568 0.179 1.00 54.14 H new ATOM 950 N LEU A 62 3.276 26.090 3.351 1.00 34.34 N ATOM 951 CA LEU A 62 2.453 26.037 4.555 1.00 20.31 C ATOM 952 C LEU A 62 3.104 26.814 5.694 1.00 1.52 C ATOM 953 O LEU A 62 4.261 27.223 5.598 1.00 21.32 O ATOM 954 CB LEU A 62 2.226 24.584 4.978 1.00 4.32 C ATOM 955 CG LEU A 62 1.797 23.622 3.870 1.00 21.44 C ATOM 956 CD1 LEU A 62 2.958 22.730 3.459 1.00 62.14 C ATOM 957 CD2 LEU A 62 0.612 22.782 4.323 1.00 32.25 C ATOM 0 H LEU A 62 4.131 25.536 3.400 1.00 34.34 H new ATOM 0 HA LEU A 62 1.491 26.498 4.329 1.00 20.31 H new ATOM 0 HB2 LEU A 62 3.148 24.208 5.422 1.00 4.32 H new ATOM 0 HB3 LEU A 62 1.466 24.568 5.759 1.00 4.32 H new ATOM 0 HG LEU A 62 1.491 24.209 3.004 1.00 21.44 H new ATOM 0 HD11 LEU A 62 2.634 22.052 2.669 1.00 62.14 H new ATOM 0 HD12 LEU A 62 3.779 23.347 3.093 1.00 62.14 H new ATOM 0 HD13 LEU A 62 3.294 22.151 4.319 1.00 62.14 H new ATOM 0 HD21 LEU A 62 0.320 22.103 3.522 1.00 32.25 H new ATOM 0 HD22 LEU A 62 0.891 22.205 5.204 1.00 32.25 H new ATOM 0 HD23 LEU A 62 -0.225 23.436 4.568 1.00 32.25 H new ATOM 969 N MET A 63 2.353 27.014 6.773 1.00 64.14 N ATOM 970 CA MET A 63 2.859 27.740 7.932 1.00 62.22 C ATOM 971 C MET A 63 2.995 26.814 9.136 1.00 25.42 C ATOM 972 O MET A 63 2.890 25.595 9.009 1.00 71.50 O ATOM 973 CB MET A 63 1.932 28.907 8.274 1.00 54.31 C ATOM 974 CG MET A 63 2.664 30.220 8.499 1.00 24.11 C ATOM 975 SD MET A 63 2.695 31.260 7.027 1.00 73.05 S ATOM 976 CE MET A 63 3.259 30.088 5.795 1.00 33.45 C ATOM 0 H MET A 63 1.393 26.684 6.868 1.00 64.14 H new ATOM 0 HA MET A 63 3.846 28.130 7.683 1.00 62.22 H new ATOM 0 HB2 MET A 63 1.211 29.036 7.467 1.00 54.31 H new ATOM 0 HB3 MET A 63 1.365 28.659 9.171 1.00 54.31 H new ATOM 0 HG2 MET A 63 2.185 30.764 9.313 1.00 24.11 H new ATOM 0 HG3 MET A 63 3.687 30.012 8.814 1.00 24.11 H new ATOM 0 HE1 MET A 63 3.549 30.622 4.891 1.00 33.45 H new ATOM 0 HE2 MET A 63 4.116 29.537 6.182 1.00 33.45 H new ATOM 0 HE3 MET A 63 2.455 29.390 5.562 1.00 33.45 H new ATOM 986 N GLY A 64 3.231 27.401 10.306 1.00 50.14 N ATOM 987 CA GLY A 64 3.378 26.613 11.515 1.00 2.13 C ATOM 988 C GLY A 64 2.228 25.648 11.722 1.00 15.34 C ATOM 989 O GLY A 64 1.069 25.996 11.499 1.00 12.13 O ATOM 0 H GLY A 64 3.323 28.408 10.437 1.00 50.14 H new ATOM 0 HA2 GLY A 64 4.313 26.055 11.469 1.00 2.13 H new ATOM 0 HA3 GLY A 64 3.447 27.281 12.374 1.00 2.13 H new ATOM 993 N GLY A 65 2.548 24.430 12.149 1.00 13.44 N ATOM 994 CA GLY A 65 1.521 23.431 12.377 1.00 31.44 C ATOM 995 C GLY A 65 2.083 22.141 12.942 1.00 73.22 C ATOM 996 O GLY A 65 3.265 22.065 13.278 1.00 73.53 O ATOM 0 H GLY A 65 3.500 24.118 12.341 1.00 13.44 H new ATOM 0 HA2 GLY A 65 0.776 23.831 13.064 1.00 31.44 H new ATOM 0 HA3 GLY A 65 1.009 23.220 11.438 1.00 31.44 H new ATOM 1000 N PHE A 66 1.234 21.124 13.048 1.00 33.02 N ATOM 1001 CA PHE A 66 1.652 19.831 13.579 1.00 54.54 C ATOM 1002 C PHE A 66 1.623 18.762 12.490 1.00 1.15 C ATOM 1003 O PHE A 66 0.732 18.748 11.642 1.00 11.31 O ATOM 1004 CB PHE A 66 0.747 19.417 14.741 1.00 72.32 C ATOM 1005 CG PHE A 66 1.339 19.700 16.092 1.00 55.41 C ATOM 1006 CD1 PHE A 66 1.165 20.937 16.693 1.00 32.42 C ATOM 1007 CD2 PHE A 66 2.068 18.731 16.761 1.00 70.22 C ATOM 1008 CE1 PHE A 66 1.709 21.200 17.936 1.00 50.31 C ATOM 1009 CE2 PHE A 66 2.614 18.989 18.004 1.00 21.41 C ATOM 1010 CZ PHE A 66 2.433 20.225 18.593 1.00 64.22 C ATOM 0 H PHE A 66 0.253 21.170 12.773 1.00 33.02 H new ATOM 0 HA PHE A 66 2.675 19.928 13.942 1.00 54.54 H new ATOM 0 HB2 PHE A 66 -0.205 19.940 14.654 1.00 72.32 H new ATOM 0 HB3 PHE A 66 0.533 18.351 14.663 1.00 72.32 H new ATOM 0 HD1 PHE A 66 0.598 21.703 16.185 1.00 32.42 H new ATOM 0 HD2 PHE A 66 2.212 17.762 16.306 1.00 70.22 H new ATOM 0 HE1 PHE A 66 1.568 22.168 18.393 1.00 50.31 H new ATOM 0 HE2 PHE A 66 3.182 18.225 18.514 1.00 21.41 H new ATOM 0 HZ PHE A 66 2.857 20.428 19.565 1.00 64.22 H new ATOM 1020 N ALA A 67 2.606 17.868 12.522 1.00 32.13 N ATOM 1021 CA ALA A 67 2.693 16.794 11.541 1.00 65.04 C ATOM 1022 C ALA A 67 2.697 15.429 12.220 1.00 65.44 C ATOM 1023 O ALA A 67 3.466 15.191 13.150 1.00 4.04 O ATOM 1024 CB ALA A 67 3.939 16.963 10.683 1.00 20.03 C ATOM 0 H ALA A 67 3.353 17.867 13.217 1.00 32.13 H new ATOM 0 HA ALA A 67 1.813 16.849 10.900 1.00 65.04 H new ATOM 0 HB1 ALA A 67 3.992 16.154 9.954 1.00 20.03 H new ATOM 0 HB2 ALA A 67 3.895 17.919 10.161 1.00 20.03 H new ATOM 0 HB3 ALA A 67 4.824 16.937 11.318 1.00 20.03 H new ATOM 1030 N GLU A 68 1.833 14.535 11.748 1.00 42.53 N ATOM 1031 CA GLU A 68 1.737 13.194 12.312 1.00 43.23 C ATOM 1032 C GLU A 68 1.534 12.155 11.213 1.00 52.22 C ATOM 1033 O GLU A 68 0.510 12.151 10.528 1.00 5.33 O ATOM 1034 CB GLU A 68 0.587 13.121 13.318 1.00 74.15 C ATOM 1035 CG GLU A 68 0.569 14.274 14.307 1.00 54.02 C ATOM 1036 CD GLU A 68 -0.423 14.060 15.434 1.00 54.43 C ATOM 1037 OE1 GLU A 68 -0.849 12.905 15.639 1.00 72.20 O ATOM 1038 OE2 GLU A 68 -0.773 15.050 16.111 1.00 54.04 O ATOM 0 H GLU A 68 1.190 14.715 10.977 1.00 42.53 H new ATOM 0 HA GLU A 68 2.673 12.975 12.826 1.00 43.23 H new ATOM 0 HB2 GLU A 68 -0.358 13.104 12.776 1.00 74.15 H new ATOM 0 HB3 GLU A 68 0.656 12.183 13.868 1.00 74.15 H new ATOM 0 HG2 GLU A 68 1.567 14.404 14.726 1.00 54.02 H new ATOM 0 HG3 GLU A 68 0.322 15.196 13.780 1.00 54.02 H new ATOM 1045 N VAL A 69 2.516 11.275 11.049 1.00 23.14 N ATOM 1046 CA VAL A 69 2.446 10.230 10.035 1.00 41.34 C ATOM 1047 C VAL A 69 2.177 8.869 10.665 1.00 33.23 C ATOM 1048 O VAL A 69 2.635 8.585 11.771 1.00 24.12 O ATOM 1049 CB VAL A 69 3.748 10.156 9.215 1.00 71.41 C ATOM 1050 CG1 VAL A 69 4.834 9.438 10.002 1.00 70.25 C ATOM 1051 CG2 VAL A 69 3.499 9.466 7.882 1.00 30.32 C ATOM 0 H VAL A 69 3.370 11.265 11.606 1.00 23.14 H new ATOM 0 HA VAL A 69 1.621 10.488 9.371 1.00 41.34 H new ATOM 0 HB VAL A 69 4.089 11.171 9.014 1.00 71.41 H new ATOM 0 HG11 VAL A 69 5.746 9.395 9.407 1.00 70.25 H new ATOM 0 HG12 VAL A 69 5.030 9.978 10.928 1.00 70.25 H new ATOM 0 HG13 VAL A 69 4.505 8.425 10.235 1.00 70.25 H new ATOM 0 HG21 VAL A 69 4.429 9.422 7.316 1.00 30.32 H new ATOM 0 HG22 VAL A 69 3.134 8.454 8.059 1.00 30.32 H new ATOM 0 HG23 VAL A 69 2.755 10.026 7.316 1.00 30.32 H new ATOM 1061 N GLU A 70 1.430 8.030 9.954 1.00 40.25 N ATOM 1062 CA GLU A 70 1.099 6.698 10.445 1.00 65.32 C ATOM 1063 C GLU A 70 0.395 5.880 9.366 1.00 33.44 C ATOM 1064 O GLU A 70 -0.647 6.281 8.850 1.00 50.13 O ATOM 1065 CB GLU A 70 0.213 6.794 11.688 1.00 22.44 C ATOM 1066 CG GLU A 70 -1.000 7.689 11.503 1.00 13.14 C ATOM 1067 CD GLU A 70 -1.003 8.871 12.453 1.00 13.13 C ATOM 1068 OE1 GLU A 70 -0.904 8.649 13.678 1.00 32.00 O ATOM 1069 OE2 GLU A 70 -1.105 10.019 11.971 1.00 23.30 O ATOM 0 H GLU A 70 1.043 8.249 9.036 1.00 40.25 H new ATOM 0 HA GLU A 70 2.029 6.194 10.709 1.00 65.32 H new ATOM 0 HB2 GLU A 70 -0.122 5.794 11.963 1.00 22.44 H new ATOM 0 HB3 GLU A 70 0.808 7.170 12.520 1.00 22.44 H new ATOM 0 HG2 GLU A 70 -1.025 8.053 10.476 1.00 13.14 H new ATOM 0 HG3 GLU A 70 -1.906 7.103 11.656 1.00 13.14 H new ATOM 1076 N ASN A 71 0.972 4.730 9.032 1.00 0.10 N ATOM 1077 CA ASN A 71 0.401 3.855 8.015 1.00 54.45 C ATOM 1078 C ASN A 71 0.074 4.637 6.746 1.00 43.42 C ATOM 1079 O ASN A 71 -1.057 4.613 6.263 1.00 10.24 O ATOM 1080 CB ASN A 71 -0.863 3.176 8.547 1.00 4.03 C ATOM 1081 CG ASN A 71 -0.756 2.832 10.020 1.00 33.43 C ATOM 1082 OD1 ASN A 71 -1.137 3.773 10.877 1.00 54.44 O flip ATOM 1083 ND2 ASN A 71 -0.337 1.732 10.384 1.00 62.43 N flip ATOM 0 H ASN A 71 1.835 4.383 9.451 1.00 0.10 H new ATOM 0 HA ASN A 71 1.141 3.092 7.771 1.00 54.45 H new ATOM 0 HB2 ASN A 71 -1.719 3.833 8.391 1.00 4.03 H new ATOM 0 HB3 ASN A 71 -1.051 2.266 7.977 1.00 4.03 H new ATOM 0 HD21 ASN A 71 -0.055 1.039 9.691 1.00 62.43 H new ATOM 0 HD22 ASN A 71 -0.272 1.515 11.378 1.00 62.43 H new ATOM 1090 N ASN A 72 1.075 5.330 6.210 1.00 35.14 N ATOM 1091 CA ASN A 72 0.894 6.119 4.997 1.00 3.34 C ATOM 1092 C ASN A 72 -0.206 7.160 5.184 1.00 5.11 C ATOM 1093 O ASN A 72 -0.960 7.452 4.257 1.00 15.04 O ATOM 1094 CB ASN A 72 0.554 5.208 3.817 1.00 62.25 C ATOM 1095 CG ASN A 72 1.580 4.109 3.620 1.00 24.44 C ATOM 1096 OD1 ASN A 72 2.682 4.167 4.167 1.00 12.54 O ATOM 1097 ND2 ASN A 72 1.223 3.098 2.836 1.00 14.42 N ATOM 0 H ASN A 72 2.018 5.361 6.597 1.00 35.14 H new ATOM 0 HA ASN A 72 1.829 6.638 4.788 1.00 3.34 H new ATOM 0 HB2 ASN A 72 -0.427 4.761 3.978 1.00 62.25 H new ATOM 0 HB3 ASN A 72 0.487 5.806 2.908 1.00 62.25 H new ATOM 0 HD21 ASN A 72 1.872 2.330 2.667 1.00 14.42 H new ATOM 0 HD22 ASN A 72 0.300 3.090 2.403 1.00 14.42 H new ATOM 1104 N GLU A 73 -0.288 7.716 6.389 1.00 54.02 N ATOM 1105 CA GLU A 73 -1.296 8.724 6.697 1.00 51.15 C ATOM 1106 C GLU A 73 -0.678 9.899 7.449 1.00 32.02 C ATOM 1107 O GLU A 73 -0.446 9.825 8.656 1.00 70.31 O ATOM 1108 CB GLU A 73 -2.426 8.111 7.526 1.00 74.24 C ATOM 1109 CG GLU A 73 -3.802 8.652 7.174 1.00 1.42 C ATOM 1110 CD GLU A 73 -4.922 7.733 7.620 1.00 13.13 C ATOM 1111 OE1 GLU A 73 -4.665 6.851 8.466 1.00 75.44 O ATOM 1112 OE2 GLU A 73 -6.057 7.897 7.124 1.00 65.13 O ATOM 0 H GLU A 73 0.331 7.486 7.167 1.00 54.02 H new ATOM 0 HA GLU A 73 -1.705 9.092 5.756 1.00 51.15 H new ATOM 0 HB2 GLU A 73 -2.423 7.030 7.386 1.00 74.24 H new ATOM 0 HB3 GLU A 73 -2.232 8.296 8.582 1.00 74.24 H new ATOM 0 HG2 GLU A 73 -3.933 9.630 7.637 1.00 1.42 H new ATOM 0 HG3 GLU A 73 -3.865 8.799 6.096 1.00 1.42 H new ATOM 1119 N VAL A 74 -0.414 10.983 6.727 1.00 4.43 N ATOM 1120 CA VAL A 74 0.177 12.175 7.325 1.00 33.25 C ATOM 1121 C VAL A 74 -0.886 13.229 7.615 1.00 72.41 C ATOM 1122 O VAL A 74 -1.776 13.470 6.799 1.00 53.22 O ATOM 1123 CB VAL A 74 1.255 12.786 6.411 1.00 11.42 C ATOM 1124 CG1 VAL A 74 2.175 13.700 7.207 1.00 34.11 C ATOM 1125 CG2 VAL A 74 2.049 11.690 5.717 1.00 10.13 C ATOM 0 H VAL A 74 -0.600 11.061 5.727 1.00 4.43 H new ATOM 0 HA VAL A 74 0.640 11.863 8.261 1.00 33.25 H new ATOM 0 HB VAL A 74 0.761 13.385 5.646 1.00 11.42 H new ATOM 0 HG11 VAL A 74 2.930 14.123 6.544 1.00 34.11 H new ATOM 0 HG12 VAL A 74 1.591 14.506 7.652 1.00 34.11 H new ATOM 0 HG13 VAL A 74 2.663 13.127 7.995 1.00 34.11 H new ATOM 0 HG21 VAL A 74 2.806 12.140 5.075 1.00 10.13 H new ATOM 0 HG22 VAL A 74 2.534 11.063 6.465 1.00 10.13 H new ATOM 0 HG23 VAL A 74 1.377 11.081 5.113 1.00 10.13 H new ATOM 1135 N THR A 75 -0.788 13.855 8.783 1.00 3.43 N ATOM 1136 CA THR A 75 -1.741 14.884 9.182 1.00 64.43 C ATOM 1137 C THR A 75 -1.038 16.208 9.457 1.00 64.11 C ATOM 1138 O THR A 75 -0.372 16.367 10.481 1.00 53.02 O ATOM 1139 CB THR A 75 -2.529 14.463 10.437 1.00 44.22 C ATOM 1140 OG1 THR A 75 -1.991 13.247 10.968 1.00 1.12 O ATOM 1141 CG2 THR A 75 -4.002 14.273 10.112 1.00 74.31 C ATOM 0 H THR A 75 -0.058 13.668 9.470 1.00 3.43 H new ATOM 0 HA THR A 75 -2.435 15.011 8.352 1.00 64.43 H new ATOM 0 HB THR A 75 -2.437 15.255 11.180 1.00 44.22 H new ATOM 0 HG1 THR A 75 -2.496 12.987 11.766 1.00 1.12 H new ATOM 0 HG21 THR A 75 -4.538 13.976 11.013 1.00 74.31 H new ATOM 0 HG22 THR A 75 -4.415 15.209 9.736 1.00 74.31 H new ATOM 0 HG23 THR A 75 -4.110 13.498 9.353 1.00 74.31 H new ATOM 1149 N ILE A 76 -1.190 17.155 8.538 1.00 43.23 N ATOM 1150 CA ILE A 76 -0.570 18.467 8.683 1.00 33.43 C ATOM 1151 C ILE A 76 -1.590 19.510 9.128 1.00 61.21 C ATOM 1152 O ILE A 76 -2.294 20.096 8.305 1.00 51.13 O ATOM 1153 CB ILE A 76 0.082 18.931 7.367 1.00 34.44 C ATOM 1154 CG1 ILE A 76 0.959 17.819 6.788 1.00 75.14 C ATOM 1155 CG2 ILE A 76 0.900 20.192 7.598 1.00 53.43 C ATOM 1156 CD1 ILE A 76 2.086 17.399 7.704 1.00 23.00 C ATOM 0 H ILE A 76 -1.737 17.039 7.685 1.00 43.23 H new ATOM 0 HA ILE A 76 0.202 18.369 9.446 1.00 33.43 H new ATOM 0 HB ILE A 76 -0.705 19.159 6.648 1.00 34.44 H new ATOM 0 HG12 ILE A 76 0.336 16.952 6.571 1.00 75.14 H new ATOM 0 HG13 ILE A 76 1.379 18.155 5.840 1.00 75.14 H new ATOM 0 HG21 ILE A 76 1.355 20.508 6.659 1.00 53.43 H new ATOM 0 HG22 ILE A 76 0.250 20.984 7.971 1.00 53.43 H new ATOM 0 HG23 ILE A 76 1.682 19.989 8.330 1.00 53.43 H new ATOM 0 HD11 ILE A 76 2.666 16.608 7.229 1.00 23.00 H new ATOM 0 HD12 ILE A 76 2.733 18.254 7.901 1.00 23.00 H new ATOM 0 HD13 ILE A 76 1.673 17.032 8.644 1.00 23.00 H new ATOM 1168 N LEU A 77 -1.663 19.738 10.434 1.00 3.35 N ATOM 1169 CA LEU A 77 -2.595 20.713 10.990 1.00 52.21 C ATOM 1170 C LEU A 77 -1.957 22.097 11.064 1.00 62.53 C ATOM 1171 O LEU A 77 -1.507 22.528 12.125 1.00 2.42 O ATOM 1172 CB LEU A 77 -3.053 20.275 12.382 1.00 5.03 C ATOM 1173 CG LEU A 77 -4.149 19.210 12.424 1.00 11.23 C ATOM 1174 CD1 LEU A 77 -3.721 18.037 13.293 1.00 52.33 C ATOM 1175 CD2 LEU A 77 -5.452 19.807 12.935 1.00 35.22 C ATOM 0 H LEU A 77 -1.088 19.261 11.128 1.00 3.35 H new ATOM 0 HA LEU A 77 -3.461 20.767 10.330 1.00 52.21 H new ATOM 0 HB2 LEU A 77 -2.187 19.898 12.926 1.00 5.03 H new ATOM 0 HB3 LEU A 77 -3.408 21.154 12.919 1.00 5.03 H new ATOM 0 HG LEU A 77 -4.313 18.844 11.411 1.00 11.23 H new ATOM 0 HD11 LEU A 77 -4.514 17.289 13.311 1.00 52.33 H new ATOM 0 HD12 LEU A 77 -2.813 17.594 12.884 1.00 52.33 H new ATOM 0 HD13 LEU A 77 -3.529 18.387 14.307 1.00 52.33 H new ATOM 0 HD21 LEU A 77 -6.221 19.035 12.958 1.00 35.22 H new ATOM 0 HD22 LEU A 77 -5.302 20.201 13.940 1.00 35.22 H new ATOM 0 HD23 LEU A 77 -5.767 20.613 12.273 1.00 35.22 H new ATOM 1187 N VAL A 78 -1.923 22.788 9.929 1.00 2.41 N ATOM 1188 CA VAL A 78 -1.343 24.125 9.866 1.00 61.44 C ATOM 1189 C VAL A 78 -2.417 25.197 10.007 1.00 51.14 C ATOM 1190 O VAL A 78 -3.568 24.991 9.624 1.00 41.45 O ATOM 1191 CB VAL A 78 -0.584 24.345 8.544 1.00 63.43 C ATOM 1192 CG1 VAL A 78 0.641 23.445 8.475 1.00 3.52 C ATOM 1193 CG2 VAL A 78 -1.502 24.100 7.355 1.00 4.25 C ATOM 0 H VAL A 78 -2.290 22.445 9.041 1.00 2.41 H new ATOM 0 HA VAL A 78 -0.642 24.206 10.697 1.00 61.44 H new ATOM 0 HB VAL A 78 -0.247 25.381 8.507 1.00 63.43 H new ATOM 0 HG11 VAL A 78 1.164 23.614 7.534 1.00 3.52 H new ATOM 0 HG12 VAL A 78 1.307 23.673 9.307 1.00 3.52 H new ATOM 0 HG13 VAL A 78 0.330 22.402 8.534 1.00 3.52 H new ATOM 0 HG21 VAL A 78 -0.949 24.260 6.429 1.00 4.25 H new ATOM 0 HG22 VAL A 78 -1.870 23.075 7.385 1.00 4.25 H new ATOM 0 HG23 VAL A 78 -2.345 24.790 7.398 1.00 4.25 H new ATOM 1203 N ASN A 79 -2.032 26.343 10.559 1.00 54.23 N ATOM 1204 CA ASN A 79 -2.963 27.450 10.751 1.00 70.44 C ATOM 1205 C ASN A 79 -2.875 28.441 9.595 1.00 43.52 C ATOM 1206 O ASN A 79 -3.174 29.624 9.754 1.00 44.23 O ATOM 1207 CB ASN A 79 -2.674 28.163 12.073 1.00 40.01 C ATOM 1208 CG ASN A 79 -2.692 27.216 13.257 1.00 32.30 C ATOM 1209 OD1 ASN A 79 -3.678 26.517 13.492 1.00 61.43 O ATOM 1210 ND2 ASN A 79 -1.599 27.189 14.010 1.00 3.10 N ATOM 0 H ASN A 79 -1.082 26.530 10.881 1.00 54.23 H new ATOM 0 HA ASN A 79 -3.973 27.042 10.780 1.00 70.44 H new ATOM 0 HB2 ASN A 79 -1.700 28.649 12.015 1.00 40.01 H new ATOM 0 HB3 ASN A 79 -3.414 28.948 12.228 1.00 40.01 H new ATOM 0 HD21 ASN A 79 -1.553 26.571 14.821 1.00 3.10 H new ATOM 0 HD22 ASN A 79 -0.805 27.786 13.778 1.00 3.10 H new ATOM 1217 N GLY A 80 -2.462 27.950 8.430 1.00 33.22 N ATOM 1218 CA GLY A 80 -2.342 28.806 7.264 1.00 34.34 C ATOM 1219 C GLY A 80 -1.393 28.241 6.226 1.00 55.22 C ATOM 1220 O GLY A 80 -0.366 27.657 6.567 1.00 5.00 O ATOM 0 H GLY A 80 -2.208 26.975 8.273 1.00 33.22 H new ATOM 0 HA2 GLY A 80 -3.326 28.944 6.816 1.00 34.34 H new ATOM 0 HA3 GLY A 80 -1.992 29.791 7.574 1.00 34.34 H new ATOM 1224 N ALA A 81 -1.739 28.414 4.954 1.00 13.33 N ATOM 1225 CA ALA A 81 -0.910 27.918 3.863 1.00 55.01 C ATOM 1226 C ALA A 81 -1.267 28.603 2.548 1.00 63.12 C ATOM 1227 O ALA A 81 -2.013 29.581 2.530 1.00 44.32 O ATOM 1228 CB ALA A 81 -1.059 26.409 3.732 1.00 45.44 C ATOM 0 H ALA A 81 -2.588 28.894 4.654 1.00 13.33 H new ATOM 0 HA ALA A 81 0.130 28.151 4.093 1.00 55.01 H new ATOM 0 HB1 ALA A 81 -0.434 26.051 2.913 1.00 45.44 H new ATOM 0 HB2 ALA A 81 -0.748 25.931 4.661 1.00 45.44 H new ATOM 0 HB3 ALA A 81 -2.101 26.163 3.528 1.00 45.44 H new ATOM 1234 N GLU A 82 -0.728 28.082 1.450 1.00 41.23 N ATOM 1235 CA GLU A 82 -0.989 28.646 0.130 1.00 22.24 C ATOM 1236 C GLU A 82 -0.416 27.752 -0.966 1.00 55.00 C ATOM 1237 O GLU A 82 0.771 27.426 -0.959 1.00 34.21 O ATOM 1238 CB GLU A 82 -0.390 30.050 0.024 1.00 62.24 C ATOM 1239 CG GLU A 82 -1.076 30.927 -1.009 1.00 52.44 C ATOM 1240 CD GLU A 82 -0.826 32.405 -0.778 1.00 52.13 C ATOM 1241 OE1 GLU A 82 0.224 32.906 -1.231 1.00 5.21 O ATOM 1242 OE2 GLU A 82 -1.680 33.060 -0.145 1.00 71.01 O ATOM 0 H GLU A 82 -0.109 27.271 1.448 1.00 41.23 H new ATOM 0 HA GLU A 82 -2.069 28.709 -0.004 1.00 22.24 H new ATOM 0 HB2 GLU A 82 -0.449 30.536 0.998 1.00 62.24 H new ATOM 0 HB3 GLU A 82 0.667 29.967 -0.227 1.00 62.24 H new ATOM 0 HG2 GLU A 82 -0.724 30.654 -2.004 1.00 52.44 H new ATOM 0 HG3 GLU A 82 -2.149 30.736 -0.987 1.00 52.44 H new ATOM 1249 N ARG A 83 -1.269 27.359 -1.907 1.00 14.45 N ATOM 1250 CA ARG A 83 -0.850 26.502 -3.009 1.00 10.14 C ATOM 1251 C ARG A 83 -0.423 27.335 -4.214 1.00 11.35 C ATOM 1252 O ARG A 83 -1.157 28.214 -4.665 1.00 25.12 O ATOM 1253 CB ARG A 83 -1.984 25.555 -3.406 1.00 23.21 C ATOM 1254 CG ARG A 83 -1.511 24.156 -3.765 1.00 23.44 C ATOM 1255 CD ARG A 83 -2.481 23.095 -3.267 1.00 44.24 C ATOM 1256 NE ARG A 83 -2.196 21.782 -3.840 1.00 32.14 N ATOM 1257 CZ ARG A 83 -2.508 21.440 -5.085 1.00 21.33 C ATOM 1258 NH1 ARG A 83 -3.110 22.309 -5.884 1.00 14.43 N ATOM 1259 NH2 ARG A 83 -2.216 20.225 -5.533 1.00 15.21 N ATOM 0 H ARG A 83 -2.255 27.621 -1.928 1.00 14.45 H new ATOM 0 HA ARG A 83 0.005 25.914 -2.674 1.00 10.14 H new ATOM 0 HB2 ARG A 83 -2.696 25.489 -2.583 1.00 23.21 H new ATOM 0 HB3 ARG A 83 -2.519 25.978 -4.256 1.00 23.21 H new ATOM 0 HG2 ARG A 83 -1.404 24.073 -4.847 1.00 23.44 H new ATOM 0 HG3 ARG A 83 -0.526 23.982 -3.333 1.00 23.44 H new ATOM 0 HD2 ARG A 83 -2.427 23.036 -2.180 1.00 44.24 H new ATOM 0 HD3 ARG A 83 -3.500 23.388 -3.520 1.00 44.24 H new ATOM 0 HE ARG A 83 -1.732 21.090 -3.252 1.00 32.14 H new ATOM 0 HH11 ARG A 83 -3.335 23.244 -5.544 1.00 14.43 H new ATOM 0 HH12 ARG A 83 -3.348 22.043 -6.840 1.00 14.43 H new ATOM 0 HH21 ARG A 83 -1.752 19.554 -4.921 1.00 15.21 H new ATOM 0 HH22 ARG A 83 -2.456 19.963 -6.489 1.00 15.21 H new ATOM 1273 N GLY A 84 0.769 27.053 -4.730 1.00 23.33 N ATOM 1274 CA GLY A 84 1.273 27.785 -5.877 1.00 25.03 C ATOM 1275 C GLY A 84 0.392 27.626 -7.099 1.00 53.13 C ATOM 1276 O GLY A 84 0.494 28.399 -8.052 1.00 4.31 O ATOM 0 H GLY A 84 1.395 26.330 -4.374 1.00 23.33 H new ATOM 0 HA2 GLY A 84 1.350 28.842 -5.624 1.00 25.03 H new ATOM 0 HA3 GLY A 84 2.280 27.439 -6.111 1.00 25.03 H new ATOM 1280 N ASP A 85 -0.476 26.621 -7.074 1.00 71.42 N ATOM 1281 CA ASP A 85 -1.379 26.362 -8.190 1.00 13.15 C ATOM 1282 C ASP A 85 -2.669 27.164 -8.042 1.00 23.13 C ATOM 1283 O ASP A 85 -3.343 27.464 -9.028 1.00 0.14 O ATOM 1284 CB ASP A 85 -1.700 24.869 -8.279 1.00 1.25 C ATOM 1285 CG ASP A 85 -2.153 24.456 -9.665 1.00 62.00 C ATOM 1286 OD1 ASP A 85 -1.526 24.898 -10.651 1.00 23.03 O ATOM 1287 OD2 ASP A 85 -3.134 23.690 -9.765 1.00 23.15 O ATOM 0 H ASP A 85 -0.574 25.972 -6.293 1.00 71.42 H new ATOM 0 HA ASP A 85 -0.881 26.674 -9.108 1.00 13.15 H new ATOM 0 HB2 ASP A 85 -0.817 24.293 -8.002 1.00 1.25 H new ATOM 0 HB3 ASP A 85 -2.479 24.624 -7.557 1.00 1.25 H new ATOM 1292 N THR A 86 -3.007 27.508 -6.803 1.00 32.31 N ATOM 1293 CA THR A 86 -4.216 28.272 -6.525 1.00 54.43 C ATOM 1294 C THR A 86 -3.915 29.764 -6.434 1.00 60.05 C ATOM 1295 O THR A 86 -4.522 30.482 -5.639 1.00 71.04 O ATOM 1296 CB THR A 86 -4.882 27.814 -5.214 1.00 54.12 C ATOM 1297 OG1 THR A 86 -4.684 26.408 -5.030 1.00 34.04 O ATOM 1298 CG2 THR A 86 -6.372 28.124 -5.226 1.00 44.44 C ATOM 0 H THR A 86 -2.460 27.269 -5.976 1.00 32.31 H new ATOM 0 HA THR A 86 -4.901 28.092 -7.354 1.00 54.43 H new ATOM 0 HB THR A 86 -4.421 28.357 -4.389 1.00 54.12 H new ATOM 0 HG1 THR A 86 -5.109 26.125 -4.194 1.00 34.04 H new ATOM 0 HG21 THR A 86 -6.820 27.791 -4.290 1.00 44.44 H new ATOM 0 HG22 THR A 86 -6.519 29.198 -5.337 1.00 44.44 H new ATOM 0 HG23 THR A 86 -6.845 27.605 -6.059 1.00 44.44 H new ATOM 1306 N ILE A 87 -2.975 30.224 -7.253 1.00 71.24 N ATOM 1307 CA ILE A 87 -2.595 31.631 -7.266 1.00 33.00 C ATOM 1308 C ILE A 87 -3.219 32.358 -8.452 1.00 54.30 C ATOM 1309 O ILE A 87 -3.285 31.821 -9.558 1.00 11.40 O ATOM 1310 CB ILE A 87 -1.066 31.801 -7.321 1.00 65.32 C ATOM 1311 CG1 ILE A 87 -0.522 31.290 -8.657 1.00 62.11 C ATOM 1312 CG2 ILE A 87 -0.409 31.068 -6.161 1.00 31.31 C ATOM 1313 CD1 ILE A 87 0.977 31.438 -8.796 1.00 2.13 C ATOM 0 H ILE A 87 -2.463 29.643 -7.916 1.00 71.24 H new ATOM 0 HA ILE A 87 -2.967 32.067 -6.339 1.00 33.00 H new ATOM 0 HB ILE A 87 -0.830 32.862 -7.235 1.00 65.32 H new ATOM 0 HG12 ILE A 87 -0.787 30.239 -8.770 1.00 62.11 H new ATOM 0 HG13 ILE A 87 -1.009 31.830 -9.469 1.00 62.11 H new ATOM 0 HG21 ILE A 87 0.672 31.198 -6.214 1.00 31.31 H new ATOM 0 HG22 ILE A 87 -0.777 31.474 -5.219 1.00 31.31 H new ATOM 0 HG23 ILE A 87 -0.650 30.007 -6.218 1.00 31.31 H new ATOM 0 HD11 ILE A 87 1.292 31.055 -9.767 1.00 2.13 H new ATOM 0 HD12 ILE A 87 1.248 32.491 -8.716 1.00 2.13 H new ATOM 0 HD13 ILE A 87 1.473 30.875 -8.006 1.00 2.13 H new ATOM 1325 N ASP A 88 -3.675 33.583 -8.215 1.00 3.45 N ATOM 1326 CA ASP A 88 -4.291 34.387 -9.264 1.00 32.21 C ATOM 1327 C ASP A 88 -3.463 35.636 -9.550 1.00 21.44 C ATOM 1328 O ASP A 88 -2.641 36.064 -8.739 1.00 15.41 O ATOM 1329 CB ASP A 88 -5.713 34.783 -8.863 1.00 50.34 C ATOM 1330 CG ASP A 88 -6.743 33.756 -9.291 1.00 42.34 C ATOM 1331 OD1 ASP A 88 -6.615 32.582 -8.885 1.00 10.34 O ATOM 1332 OD2 ASP A 88 -7.677 34.127 -10.032 1.00 61.35 O ATOM 0 H ASP A 88 -3.630 34.041 -7.305 1.00 3.45 H new ATOM 0 HA ASP A 88 -4.332 33.785 -10.172 1.00 32.21 H new ATOM 0 HB2 ASP A 88 -5.760 34.911 -7.782 1.00 50.34 H new ATOM 0 HB3 ASP A 88 -5.958 35.747 -9.309 1.00 50.34 H new ATOM 1337 N PRO A 89 -3.681 36.234 -10.730 1.00 75.21 N ATOM 1338 CA PRO A 89 -2.965 37.441 -11.150 1.00 44.53 C ATOM 1339 C PRO A 89 -3.373 38.668 -10.342 1.00 44.51 C ATOM 1340 O PRO A 89 -2.527 39.471 -9.948 1.00 14.35 O ATOM 1341 CB PRO A 89 -3.375 37.606 -12.616 1.00 31.32 C ATOM 1342 CG PRO A 89 -4.695 36.923 -12.718 1.00 52.02 C ATOM 1343 CD PRO A 89 -4.646 35.778 -11.745 1.00 63.42 C ATOM 0 HA PRO A 89 -1.889 37.348 -11.002 1.00 44.53 H new ATOM 0 HB2 PRO A 89 -3.451 38.658 -12.890 1.00 31.32 H new ATOM 0 HB3 PRO A 89 -2.643 37.155 -13.285 1.00 31.32 H new ATOM 0 HG2 PRO A 89 -5.508 37.607 -12.475 1.00 52.02 H new ATOM 0 HG3 PRO A 89 -4.872 36.566 -13.732 1.00 52.02 H new ATOM 0 HD2 PRO A 89 -5.625 35.580 -11.308 1.00 63.42 H new ATOM 0 HD3 PRO A 89 -4.318 34.856 -12.225 1.00 63.42 H new ATOM 1351 N GLN A 90 -4.672 38.806 -10.099 1.00 50.45 N ATOM 1352 CA GLN A 90 -5.191 39.937 -9.338 1.00 63.50 C ATOM 1353 C GLN A 90 -4.635 39.937 -7.918 1.00 3.31 C ATOM 1354 O GLN A 90 -4.541 40.985 -7.279 1.00 71.21 O ATOM 1355 CB GLN A 90 -6.719 39.894 -9.300 1.00 13.41 C ATOM 1356 CG GLN A 90 -7.379 40.811 -10.317 1.00 42.43 C ATOM 1357 CD GLN A 90 -8.639 41.464 -9.784 1.00 71.12 C ATOM 1358 OE1 GLN A 90 -9.245 40.981 -8.827 1.00 4.32 O ATOM 1359 NE2 GLN A 90 -9.042 42.568 -10.403 1.00 25.12 N ATOM 0 H GLN A 90 -5.384 38.149 -10.418 1.00 50.45 H new ATOM 0 HA GLN A 90 -4.873 40.854 -9.834 1.00 63.50 H new ATOM 0 HB2 GLN A 90 -7.050 38.871 -9.477 1.00 13.41 H new ATOM 0 HB3 GLN A 90 -7.057 40.170 -8.301 1.00 13.41 H new ATOM 0 HG2 GLN A 90 -6.672 41.585 -10.615 1.00 42.43 H new ATOM 0 HG3 GLN A 90 -7.622 40.239 -11.212 1.00 42.43 H new ATOM 0 HE21 GLN A 90 -8.509 42.934 -11.192 1.00 25.12 H new ATOM 0 HE22 GLN A 90 -9.884 43.050 -10.089 1.00 25.12 H new ATOM 1368 N GLU A 91 -4.268 38.756 -7.431 1.00 2.14 N ATOM 1369 CA GLU A 91 -3.722 38.622 -6.085 1.00 72.30 C ATOM 1370 C GLU A 91 -2.548 39.574 -5.876 1.00 60.25 C ATOM 1371 O GLU A 91 -2.302 40.039 -4.764 1.00 34.00 O ATOM 1372 CB GLU A 91 -3.275 37.180 -5.834 1.00 10.24 C ATOM 1373 CG GLU A 91 -3.123 36.838 -4.361 1.00 1.20 C ATOM 1374 CD GLU A 91 -2.414 35.516 -4.139 1.00 73.03 C ATOM 1375 OE1 GLU A 91 -2.932 34.481 -4.609 1.00 25.53 O ATOM 1376 OE2 GLU A 91 -1.344 35.516 -3.497 1.00 3.31 O ATOM 0 H GLU A 91 -4.339 37.879 -7.947 1.00 2.14 H new ATOM 0 HA GLU A 91 -4.507 38.881 -5.375 1.00 72.30 H new ATOM 0 HB2 GLU A 91 -3.999 36.500 -6.283 1.00 10.24 H new ATOM 0 HB3 GLU A 91 -2.323 37.010 -6.338 1.00 10.24 H new ATOM 0 HG2 GLU A 91 -2.567 37.632 -3.863 1.00 1.20 H new ATOM 0 HG3 GLU A 91 -4.109 36.800 -3.897 1.00 1.20 H new ATOM 1383 N ALA A 92 -1.826 39.858 -6.955 1.00 44.12 N ATOM 1384 CA ALA A 92 -0.678 40.755 -6.892 1.00 14.13 C ATOM 1385 C ALA A 92 -1.080 42.122 -6.348 1.00 41.23 C ATOM 1386 O ALA A 92 -0.395 42.686 -5.496 1.00 3.22 O ATOM 1387 CB ALA A 92 -0.043 40.897 -8.267 1.00 10.42 C ATOM 0 H ALA A 92 -2.016 39.480 -7.883 1.00 44.12 H new ATOM 0 HA ALA A 92 0.054 40.322 -6.210 1.00 14.13 H new ATOM 0 HB1 ALA A 92 0.813 41.569 -8.205 1.00 10.42 H new ATOM 0 HB2 ALA A 92 0.288 39.920 -8.617 1.00 10.42 H new ATOM 0 HB3 ALA A 92 -0.774 41.304 -8.965 1.00 10.42 H new ATOM 1393 N GLN A 93 -2.193 42.649 -6.848 1.00 32.20 N ATOM 1394 CA GLN A 93 -2.684 43.951 -6.413 1.00 20.04 C ATOM 1395 C GLN A 93 -3.275 43.869 -5.009 1.00 61.51 C ATOM 1396 O GLN A 93 -3.105 44.780 -4.200 1.00 42.10 O ATOM 1397 CB GLN A 93 -3.735 44.477 -7.391 1.00 74.45 C ATOM 1398 CG GLN A 93 -3.285 45.704 -8.167 1.00 63.45 C ATOM 1399 CD GLN A 93 -2.942 45.388 -9.610 1.00 42.31 C ATOM 1400 OE1 GLN A 93 -3.651 45.793 -10.532 1.00 34.34 O ATOM 1401 NE2 GLN A 93 -1.849 44.663 -9.814 1.00 23.50 N ATOM 0 H GLN A 93 -2.772 42.194 -7.554 1.00 32.20 H new ATOM 0 HA GLN A 93 -1.840 44.640 -6.393 1.00 20.04 H new ATOM 0 HB2 GLN A 93 -3.992 43.686 -8.096 1.00 74.45 H new ATOM 0 HB3 GLN A 93 -4.643 44.719 -6.839 1.00 74.45 H new ATOM 0 HG2 GLN A 93 -4.074 46.455 -8.141 1.00 63.45 H new ATOM 0 HG3 GLN A 93 -2.414 46.140 -7.677 1.00 63.45 H new ATOM 0 HE21 GLN A 93 -1.290 44.348 -9.021 1.00 23.50 H new ATOM 0 HE22 GLN A 93 -1.568 44.421 -10.764 1.00 23.50 H new ATOM 1410 N GLN A 94 -3.970 42.771 -4.728 1.00 64.34 N ATOM 1411 CA GLN A 94 -4.587 42.571 -3.422 1.00 65.24 C ATOM 1412 C GLN A 94 -3.531 42.530 -2.322 1.00 51.42 C ATOM 1413 O GLN A 94 -3.608 43.276 -1.345 1.00 33.53 O ATOM 1414 CB GLN A 94 -5.401 41.276 -3.412 1.00 65.23 C ATOM 1415 CG GLN A 94 -6.830 41.460 -2.929 1.00 72.44 C ATOM 1416 CD GLN A 94 -7.742 42.019 -4.004 1.00 3.34 C ATOM 1417 OE1 GLN A 94 -7.906 41.422 -5.068 1.00 3.11 O ATOM 1418 NE2 GLN A 94 -8.341 43.172 -3.730 1.00 51.21 N ATOM 0 H GLN A 94 -4.120 42.007 -5.387 1.00 64.34 H new ATOM 0 HA GLN A 94 -5.253 43.412 -3.230 1.00 65.24 H new ATOM 0 HB2 GLN A 94 -5.417 40.859 -4.419 1.00 65.23 H new ATOM 0 HB3 GLN A 94 -4.901 40.547 -2.774 1.00 65.23 H new ATOM 0 HG2 GLN A 94 -7.221 40.501 -2.589 1.00 72.44 H new ATOM 0 HG3 GLN A 94 -6.835 42.130 -2.069 1.00 72.44 H new ATOM 0 HE21 GLN A 94 -8.176 43.632 -2.835 1.00 51.21 H new ATOM 0 HE22 GLN A 94 -8.966 43.597 -4.415 1.00 51.21 H new ATOM 1427 N THR A 95 -2.544 41.655 -2.487 1.00 73.12 N ATOM 1428 CA THR A 95 -1.474 41.516 -1.508 1.00 30.02 C ATOM 1429 C THR A 95 -0.719 42.828 -1.329 1.00 63.00 C ATOM 1430 O THR A 95 -0.360 43.202 -0.212 1.00 4.32 O ATOM 1431 CB THR A 95 -0.478 40.415 -1.917 1.00 24.21 C ATOM 1432 OG1 THR A 95 -1.179 39.313 -2.504 1.00 40.10 O ATOM 1433 CG2 THR A 95 0.319 39.932 -0.714 1.00 43.33 C ATOM 0 H THR A 95 -2.464 41.032 -3.290 1.00 73.12 H new ATOM 0 HA THR A 95 -1.943 41.238 -0.564 1.00 30.02 H new ATOM 0 HB THR A 95 0.214 40.835 -2.647 1.00 24.21 H new ATOM 0 HG1 THR A 95 -1.261 39.455 -3.470 1.00 40.10 H new ATOM 0 HG21 THR A 95 1.016 39.155 -1.027 1.00 43.33 H new ATOM 0 HG22 THR A 95 0.875 40.767 -0.287 1.00 43.33 H new ATOM 0 HG23 THR A 95 -0.362 39.528 0.035 1.00 43.33 H new ATOM 1441 N LEU A 96 -0.481 43.524 -2.435 1.00 63.44 N ATOM 1442 CA LEU A 96 0.232 44.796 -2.401 1.00 10.03 C ATOM 1443 C LEU A 96 -0.560 45.843 -1.623 1.00 24.50 C ATOM 1444 O LEU A 96 0.015 46.666 -0.912 1.00 12.21 O ATOM 1445 CB LEU A 96 0.497 45.293 -3.823 1.00 2.53 C ATOM 1446 CG LEU A 96 1.658 46.276 -3.985 1.00 33.13 C ATOM 1447 CD1 LEU A 96 2.971 45.528 -4.154 1.00 32.43 C ATOM 1448 CD2 LEU A 96 1.412 47.201 -5.168 1.00 65.51 C ATOM 0 H LEU A 96 -0.772 43.229 -3.367 1.00 63.44 H new ATOM 0 HA LEU A 96 1.184 44.637 -1.895 1.00 10.03 H new ATOM 0 HB2 LEU A 96 0.688 44.429 -4.459 1.00 2.53 H new ATOM 0 HB3 LEU A 96 -0.410 45.769 -4.195 1.00 2.53 H new ATOM 0 HG LEU A 96 1.724 46.883 -3.082 1.00 33.13 H new ATOM 0 HD11 LEU A 96 3.785 46.244 -4.268 1.00 32.43 H new ATOM 0 HD12 LEU A 96 3.152 44.908 -3.276 1.00 32.43 H new ATOM 0 HD13 LEU A 96 2.918 44.895 -5.040 1.00 32.43 H new ATOM 0 HD21 LEU A 96 2.248 47.894 -5.268 1.00 65.51 H new ATOM 0 HD22 LEU A 96 1.319 46.610 -6.079 1.00 65.51 H new ATOM 0 HD23 LEU A 96 0.493 47.763 -5.005 1.00 65.51 H new ATOM 1460 N GLU A 97 -1.881 45.802 -1.762 1.00 60.24 N ATOM 1461 CA GLU A 97 -2.751 46.746 -1.071 1.00 42.32 C ATOM 1462 C GLU A 97 -2.668 46.556 0.441 1.00 72.14 C ATOM 1463 O GLU A 97 -2.637 47.526 1.198 1.00 1.40 O ATOM 1464 CB GLU A 97 -4.198 46.578 -1.539 1.00 62.32 C ATOM 1465 CG GLU A 97 -4.849 47.876 -1.985 1.00 4.42 C ATOM 1466 CD GLU A 97 -4.586 48.190 -3.445 1.00 24.21 C ATOM 1467 OE1 GLU A 97 -4.565 47.243 -4.260 1.00 11.43 O ATOM 1468 OE2 GLU A 97 -4.400 49.380 -3.773 1.00 11.22 O ATOM 0 H GLU A 97 -2.372 45.126 -2.347 1.00 60.24 H new ATOM 0 HA GLU A 97 -2.414 47.754 -1.312 1.00 42.32 H new ATOM 0 HB2 GLU A 97 -4.224 45.866 -2.364 1.00 62.32 H new ATOM 0 HB3 GLU A 97 -4.785 46.147 -0.728 1.00 62.32 H new ATOM 0 HG2 GLU A 97 -5.924 47.814 -1.819 1.00 4.42 H new ATOM 0 HG3 GLU A 97 -4.478 48.695 -1.369 1.00 4.42 H new ATOM 1475 N ILE A 98 -2.634 45.300 0.872 1.00 61.42 N ATOM 1476 CA ILE A 98 -2.555 44.982 2.292 1.00 24.21 C ATOM 1477 C ILE A 98 -1.199 45.375 2.868 1.00 24.24 C ATOM 1478 O ILE A 98 -1.120 46.025 3.910 1.00 14.02 O ATOM 1479 CB ILE A 98 -2.793 43.482 2.548 1.00 72.14 C ATOM 1480 CG1 ILE A 98 -4.140 43.051 1.963 1.00 31.34 C ATOM 1481 CG2 ILE A 98 -2.736 43.183 4.038 1.00 31.12 C ATOM 1482 CD1 ILE A 98 -4.315 41.550 1.892 1.00 32.14 C ATOM 0 H ILE A 98 -2.660 44.486 0.258 1.00 61.42 H new ATOM 0 HA ILE A 98 -3.339 45.555 2.788 1.00 24.21 H new ATOM 0 HB ILE A 98 -2.005 42.914 2.054 1.00 72.14 H new ATOM 0 HG12 ILE A 98 -4.942 43.474 2.568 1.00 31.34 H new ATOM 0 HG13 ILE A 98 -4.242 43.468 0.961 1.00 31.34 H new ATOM 0 HG21 ILE A 98 -2.906 42.119 4.202 1.00 31.12 H new ATOM 0 HG22 ILE A 98 -1.756 43.458 4.427 1.00 31.12 H new ATOM 0 HG23 ILE A 98 -3.505 43.757 4.554 1.00 31.12 H new ATOM 0 HD11 ILE A 98 -5.292 41.317 1.468 1.00 32.14 H new ATOM 0 HD12 ILE A 98 -3.535 41.122 1.263 1.00 32.14 H new ATOM 0 HD13 ILE A 98 -4.245 41.128 2.894 1.00 32.14 H new ATOM 1494 N ALA A 99 -0.132 44.977 2.182 1.00 33.32 N ATOM 1495 CA ALA A 99 1.221 45.291 2.623 1.00 30.55 C ATOM 1496 C ALA A 99 1.447 46.798 2.673 1.00 34.22 C ATOM 1497 O ALA A 99 2.078 47.309 3.597 1.00 14.53 O ATOM 1498 CB ALA A 99 2.241 44.632 1.707 1.00 41.15 C ATOM 0 H ALA A 99 -0.179 44.436 1.318 1.00 33.32 H new ATOM 0 HA ALA A 99 1.348 44.898 3.632 1.00 30.55 H new ATOM 0 HB1 ALA A 99 3.247 44.875 2.048 1.00 41.15 H new ATOM 0 HB2 ALA A 99 2.103 43.551 1.726 1.00 41.15 H new ATOM 0 HB3 ALA A 99 2.105 44.997 0.689 1.00 41.15 H new ATOM 1504 N GLU A 100 0.927 47.503 1.673 1.00 63.43 N ATOM 1505 CA GLU A 100 1.074 48.952 1.603 1.00 25.30 C ATOM 1506 C GLU A 100 0.343 49.629 2.759 1.00 64.03 C ATOM 1507 O GLU A 100 0.835 50.599 3.334 1.00 13.51 O ATOM 1508 CB GLU A 100 0.540 49.477 0.269 1.00 1.31 C ATOM 1509 CG GLU A 100 1.059 50.859 -0.092 1.00 54.13 C ATOM 1510 CD GLU A 100 -0.051 51.812 -0.493 1.00 43.03 C ATOM 1511 OE1 GLU A 100 -0.775 51.504 -1.463 1.00 43.02 O ATOM 1512 OE2 GLU A 100 -0.195 52.865 0.162 1.00 43.10 O ATOM 0 H GLU A 100 0.401 47.094 0.901 1.00 63.43 H new ATOM 0 HA GLU A 100 2.135 49.188 1.679 1.00 25.30 H new ATOM 0 HB2 GLU A 100 0.812 48.778 -0.522 1.00 1.31 H new ATOM 0 HB3 GLU A 100 -0.549 49.506 0.309 1.00 1.31 H new ATOM 0 HG2 GLU A 100 1.599 51.274 0.759 1.00 54.13 H new ATOM 0 HG3 GLU A 100 1.773 50.773 -0.911 1.00 54.13 H new ATOM 1519 N ALA A 101 -0.834 49.110 3.092 1.00 63.21 N ATOM 1520 CA ALA A 101 -1.632 49.662 4.179 1.00 52.41 C ATOM 1521 C ALA A 101 -0.857 49.647 5.492 1.00 33.12 C ATOM 1522 O ALA A 101 -0.830 50.639 6.219 1.00 2.00 O ATOM 1523 CB ALA A 101 -2.935 48.889 4.323 1.00 25.01 C ATOM 0 H ALA A 101 -1.256 48.308 2.624 1.00 63.21 H new ATOM 0 HA ALA A 101 -1.863 50.699 3.936 1.00 52.41 H new ATOM 0 HB1 ALA A 101 -3.521 49.312 5.139 1.00 25.01 H new ATOM 0 HB2 ALA A 101 -3.503 48.957 3.395 1.00 25.01 H new ATOM 0 HB3 ALA A 101 -2.716 47.843 4.538 1.00 25.01 H new ATOM 1529 N ASN A 102 -0.229 48.514 5.790 1.00 15.01 N ATOM 1530 CA ASN A 102 0.545 48.369 7.017 1.00 1.44 C ATOM 1531 C ASN A 102 1.848 49.159 6.935 1.00 70.04 C ATOM 1532 O ASN A 102 2.294 49.748 7.920 1.00 34.03 O ATOM 1533 CB ASN A 102 0.846 46.893 7.284 1.00 44.20 C ATOM 1534 CG ASN A 102 -0.311 45.989 6.906 1.00 13.51 C ATOM 1535 OD1 ASN A 102 -0.153 45.055 6.120 1.00 0.22 O ATOM 1536 ND2 ASN A 102 -1.484 46.265 7.466 1.00 64.33 N ATOM 0 H ASN A 102 -0.241 47.683 5.198 1.00 15.01 H new ATOM 0 HA ASN A 102 -0.049 48.766 7.840 1.00 1.44 H new ATOM 0 HB2 ASN A 102 1.732 46.598 6.722 1.00 44.20 H new ATOM 0 HB3 ASN A 102 1.079 46.758 8.340 1.00 44.20 H new ATOM 0 HD21 ASN A 102 -2.300 45.692 7.250 1.00 64.33 H new ATOM 0 HD22 ASN A 102 -1.569 47.050 8.112 1.00 64.33 H new ATOM 1543 N LEU A 103 2.454 49.167 5.752 1.00 10.45 N ATOM 1544 CA LEU A 103 3.706 49.885 5.540 1.00 51.34 C ATOM 1545 C LEU A 103 3.528 51.378 5.796 1.00 51.30 C ATOM 1546 O LEU A 103 4.480 52.076 6.148 1.00 74.43 O ATOM 1547 CB LEU A 103 4.211 49.658 4.114 1.00 61.32 C ATOM 1548 CG LEU A 103 5.169 48.481 3.921 1.00 55.23 C ATOM 1549 CD1 LEU A 103 4.994 47.873 2.538 1.00 65.22 C ATOM 1550 CD2 LEU A 103 6.609 48.925 4.133 1.00 54.24 C ATOM 0 H LEU A 103 2.099 48.685 4.926 1.00 10.45 H new ATOM 0 HA LEU A 103 4.441 49.499 6.246 1.00 51.34 H new ATOM 0 HB2 LEU A 103 3.349 49.509 3.464 1.00 61.32 H new ATOM 0 HB3 LEU A 103 4.711 50.566 3.778 1.00 61.32 H new ATOM 0 HG LEU A 103 4.933 47.719 4.663 1.00 55.23 H new ATOM 0 HD11 LEU A 103 5.683 47.037 2.418 1.00 65.22 H new ATOM 0 HD12 LEU A 103 3.970 47.518 2.424 1.00 65.22 H new ATOM 0 HD13 LEU A 103 5.203 48.628 1.780 1.00 65.22 H new ATOM 0 HD21 LEU A 103 7.276 48.075 3.992 1.00 54.24 H new ATOM 0 HD22 LEU A 103 6.859 49.706 3.414 1.00 54.24 H new ATOM 0 HD23 LEU A 103 6.725 49.313 5.145 1.00 54.24 H new ATOM 1562 N ARG A 104 2.303 51.862 5.619 1.00 34.25 N ATOM 1563 CA ARG A 104 2.000 53.272 5.833 1.00 74.23 C ATOM 1564 C ARG A 104 2.484 53.731 7.205 1.00 30.50 C ATOM 1565 O ARG A 104 3.439 54.499 7.313 1.00 4.54 O ATOM 1566 CB ARG A 104 0.495 53.517 5.703 1.00 43.53 C ATOM 1567 CG ARG A 104 0.107 54.984 5.794 1.00 5.24 C ATOM 1568 CD ARG A 104 -1.205 55.259 5.078 1.00 53.22 C ATOM 1569 NE ARG A 104 -2.284 55.572 6.012 1.00 44.13 N ATOM 1570 CZ ARG A 104 -3.566 55.609 5.668 1.00 71.23 C ATOM 1571 NH1 ARG A 104 -3.928 55.353 4.418 1.00 34.03 N ATOM 1572 NH2 ARG A 104 -4.489 55.901 6.575 1.00 54.42 N ATOM 0 H ARG A 104 1.504 51.298 5.328 1.00 34.25 H new ATOM 0 HA ARG A 104 2.523 53.850 5.071 1.00 74.23 H new ATOM 0 HB2 ARG A 104 0.151 53.117 4.749 1.00 43.53 H new ATOM 0 HB3 ARG A 104 -0.024 52.963 6.486 1.00 43.53 H new ATOM 0 HG2 ARG A 104 0.019 55.274 6.841 1.00 5.24 H new ATOM 0 HG3 ARG A 104 0.896 55.598 5.359 1.00 5.24 H new ATOM 0 HD2 ARG A 104 -1.073 56.090 4.386 1.00 53.22 H new ATOM 0 HD3 ARG A 104 -1.482 54.389 4.482 1.00 53.22 H new ATOM 0 HE ARG A 104 -2.039 55.773 6.982 1.00 44.13 H new ATOM 0 HH11 ARG A 104 -3.221 55.127 3.718 1.00 34.03 H new ATOM 0 HH12 ARG A 104 -4.913 55.382 4.156 1.00 34.03 H new ATOM 0 HH21 ARG A 104 -4.214 56.097 7.537 1.00 54.42 H new ATOM 0 HH22 ARG A 104 -5.474 55.929 6.310 1.00 54.42 H new ATOM 1586 N LYS A 105 1.818 53.254 8.251 1.00 21.14 N ATOM 1587 CA LYS A 105 2.180 53.613 9.617 1.00 13.44 C ATOM 1588 C LYS A 105 2.634 52.386 10.401 1.00 44.03 C ATOM 1589 O LYS A 105 3.584 52.453 11.180 1.00 23.43 O ATOM 1590 CB LYS A 105 0.993 54.272 10.325 1.00 61.04 C ATOM 1591 CG LYS A 105 0.593 55.609 9.724 1.00 30.34 C ATOM 1592 CD LYS A 105 -0.917 55.777 9.694 1.00 21.21 C ATOM 1593 CE LYS A 105 -1.453 56.243 11.039 1.00 41.52 C ATOM 1594 NZ LYS A 105 -2.701 55.525 11.418 1.00 23.32 N ATOM 0 H LYS A 105 1.024 52.618 8.179 1.00 21.14 H new ATOM 0 HA LYS A 105 3.008 54.321 9.572 1.00 13.44 H new ATOM 0 HB2 LYS A 105 0.138 53.596 10.289 1.00 61.04 H new ATOM 0 HB3 LYS A 105 1.242 54.415 11.377 1.00 61.04 H new ATOM 0 HG2 LYS A 105 1.039 56.417 10.304 1.00 30.34 H new ATOM 0 HG3 LYS A 105 0.989 55.687 8.711 1.00 30.34 H new ATOM 0 HD2 LYS A 105 -1.189 56.498 8.923 1.00 21.21 H new ATOM 0 HD3 LYS A 105 -1.384 54.830 9.423 1.00 21.21 H new ATOM 0 HE2 LYS A 105 -0.695 56.084 11.806 1.00 41.52 H new ATOM 0 HE3 LYS A 105 -1.648 57.315 11.001 1.00 41.52 H new ATOM 0 HZ1 LYS A 105 -3.034 55.871 12.340 1.00 23.32 H new ATOM 0 HZ2 LYS A 105 -3.432 55.697 10.699 1.00 23.32 H new ATOM 0 HZ3 LYS A 105 -2.509 54.505 11.480 1.00 23.32 H new ATOM 1608 N ALA A 106 1.951 51.267 10.187 1.00 71.51 N ATOM 1609 CA ALA A 106 2.287 50.024 10.870 1.00 23.23 C ATOM 1610 C ALA A 106 3.616 49.466 10.372 1.00 21.42 C ATOM 1611 O ALA A 106 4.296 50.091 9.559 1.00 31.31 O ATOM 1612 CB ALA A 106 1.178 49.000 10.680 1.00 20.11 C ATOM 0 H ALA A 106 1.161 51.195 9.546 1.00 71.51 H new ATOM 0 HA ALA A 106 2.389 50.239 11.934 1.00 23.23 H new ATOM 0 HB1 ALA A 106 1.443 48.077 11.196 1.00 20.11 H new ATOM 0 HB2 ALA A 106 0.247 49.391 11.091 1.00 20.11 H new ATOM 0 HB3 ALA A 106 1.048 48.797 9.617 1.00 20.11 H new ATOM 1618 N GLU A 107 3.980 48.286 10.866 1.00 12.22 N ATOM 1619 CA GLU A 107 5.229 47.646 10.471 1.00 31.32 C ATOM 1620 C GLU A 107 5.363 46.270 11.117 1.00 32.24 C ATOM 1621 O GLU A 107 5.822 46.147 12.252 1.00 22.20 O ATOM 1622 CB GLU A 107 6.422 48.522 10.859 1.00 31.21 C ATOM 1623 CG GLU A 107 7.768 47.867 10.597 1.00 1.53 C ATOM 1624 CD GLU A 107 8.606 47.733 11.854 1.00 13.01 C ATOM 1625 OE1 GLU A 107 9.168 48.753 12.305 1.00 64.53 O ATOM 1626 OE2 GLU A 107 8.698 46.607 12.387 1.00 11.31 O ATOM 0 H GLU A 107 3.428 47.755 11.540 1.00 12.22 H new ATOM 0 HA GLU A 107 5.217 47.521 9.388 1.00 31.32 H new ATOM 0 HB2 GLU A 107 6.369 49.459 10.305 1.00 31.21 H new ATOM 0 HB3 GLU A 107 6.349 48.773 11.917 1.00 31.21 H new ATOM 0 HG2 GLU A 107 7.609 46.880 10.164 1.00 1.53 H new ATOM 0 HG3 GLU A 107 8.316 48.454 9.860 1.00 1.53 H new ATOM 1633 N GLY A 108 4.957 45.237 10.385 1.00 30.55 N ATOM 1634 CA GLY A 108 5.039 43.883 10.903 1.00 12.20 C ATOM 1635 C GLY A 108 4.899 42.837 9.815 1.00 22.00 C ATOM 1636 O GLY A 108 3.986 42.905 8.993 1.00 44.03 O ATOM 0 H GLY A 108 4.573 45.313 9.443 1.00 30.55 H new ATOM 0 HA2 GLY A 108 5.994 43.749 11.411 1.00 12.20 H new ATOM 0 HA3 GLY A 108 4.258 43.734 11.648 1.00 12.20 H new ATOM 1640 N ALA A 109 5.808 41.867 9.809 1.00 13.00 N ATOM 1641 CA ALA A 109 5.782 40.802 8.814 1.00 14.11 C ATOM 1642 C ALA A 109 4.537 39.935 8.970 1.00 13.41 C ATOM 1643 O ALA A 109 4.086 39.303 8.015 1.00 32.42 O ATOM 1644 CB ALA A 109 7.037 39.949 8.921 1.00 43.55 C ATOM 0 H ALA A 109 6.571 41.797 10.482 1.00 13.00 H new ATOM 0 HA ALA A 109 5.751 41.262 7.826 1.00 14.11 H new ATOM 0 HB1 ALA A 109 7.004 39.158 8.172 1.00 43.55 H new ATOM 0 HB2 ALA A 109 7.916 40.572 8.753 1.00 43.55 H new ATOM 0 HB3 ALA A 109 7.092 39.506 9.915 1.00 43.55 H new ATOM 1650 N ARG A 110 3.986 39.911 10.180 1.00 62.15 N ATOM 1651 CA ARG A 110 2.794 39.120 10.460 1.00 22.14 C ATOM 1652 C ARG A 110 1.658 39.493 9.512 1.00 64.40 C ATOM 1653 O ARG A 110 0.833 38.652 9.157 1.00 20.41 O ATOM 1654 CB ARG A 110 2.350 39.325 11.910 1.00 23.40 C ATOM 1655 CG ARG A 110 1.444 38.221 12.431 1.00 2.12 C ATOM 1656 CD ARG A 110 2.129 37.403 13.515 1.00 1.40 C ATOM 1657 NE ARG A 110 1.334 36.244 13.911 1.00 51.12 N ATOM 1658 CZ ARG A 110 1.182 35.164 13.153 1.00 70.20 C ATOM 1659 NH1 ARG A 110 1.768 35.095 11.966 1.00 62.02 N ATOM 1660 NH2 ARG A 110 0.443 34.149 13.583 1.00 54.25 N ATOM 0 H ARG A 110 4.346 40.430 10.981 1.00 62.15 H new ATOM 0 HA ARG A 110 3.041 38.070 10.307 1.00 22.14 H new ATOM 0 HB2 ARG A 110 3.233 39.389 12.546 1.00 23.40 H new ATOM 0 HB3 ARG A 110 1.829 40.279 11.990 1.00 23.40 H new ATOM 0 HG2 ARG A 110 0.528 38.658 12.828 1.00 2.12 H new ATOM 0 HG3 ARG A 110 1.155 37.567 11.608 1.00 2.12 H new ATOM 0 HD2 ARG A 110 3.103 37.069 13.156 1.00 1.40 H new ATOM 0 HD3 ARG A 110 2.309 38.034 14.386 1.00 1.40 H new ATOM 0 HE ARG A 110 0.870 36.265 14.819 1.00 51.12 H new ATOM 0 HH11 ARG A 110 2.338 35.873 11.632 1.00 62.02 H new ATOM 0 HH12 ARG A 110 1.649 34.264 11.386 1.00 62.02 H new ATOM 0 HH21 ARG A 110 -0.009 34.198 14.496 1.00 54.25 H new ATOM 0 HH22 ARG A 110 0.327 33.320 13.000 1.00 54.25 H new ATOM 1674 N GLN A 111 1.624 40.758 9.107 1.00 71.14 N ATOM 1675 CA GLN A 111 0.589 41.241 8.201 1.00 52.43 C ATOM 1676 C GLN A 111 0.592 40.449 6.898 1.00 64.05 C ATOM 1677 O GLN A 111 -0.447 39.962 6.451 1.00 3.24 O ATOM 1678 CB GLN A 111 0.792 42.729 7.907 1.00 21.25 C ATOM 1679 CG GLN A 111 0.839 43.594 9.156 1.00 0.34 C ATOM 1680 CD GLN A 111 -0.461 43.566 9.935 1.00 32.33 C ATOM 1681 OE1 GLN A 111 -1.470 43.043 9.462 1.00 35.41 O ATOM 1682 NE2 GLN A 111 -0.444 44.129 11.137 1.00 1.45 N ATOM 0 H GLN A 111 2.300 41.466 9.392 1.00 71.14 H new ATOM 0 HA GLN A 111 -0.377 41.102 8.687 1.00 52.43 H new ATOM 0 HB2 GLN A 111 1.720 42.858 7.351 1.00 21.25 H new ATOM 0 HB3 GLN A 111 -0.016 43.077 7.264 1.00 21.25 H new ATOM 0 HG2 GLN A 111 1.651 43.253 9.799 1.00 0.34 H new ATOM 0 HG3 GLN A 111 1.066 44.622 8.873 1.00 0.34 H new ATOM 0 HE21 GLN A 111 0.415 44.551 11.490 1.00 1.45 H new ATOM 0 HE22 GLN A 111 -1.290 44.139 11.707 1.00 1.45 H new ATOM 1691 N LYS A 112 1.768 40.323 6.291 1.00 53.54 N ATOM 1692 CA LYS A 112 1.908 39.589 5.039 1.00 42.55 C ATOM 1693 C LYS A 112 1.586 38.112 5.235 1.00 33.41 C ATOM 1694 O LYS A 112 1.064 37.455 4.333 1.00 43.51 O ATOM 1695 CB LYS A 112 3.328 39.744 4.490 1.00 64.14 C ATOM 1696 CG LYS A 112 3.584 41.090 3.835 1.00 43.23 C ATOM 1697 CD LYS A 112 4.229 42.068 4.803 1.00 63.41 C ATOM 1698 CE LYS A 112 3.820 43.501 4.503 1.00 13.40 C ATOM 1699 NZ LYS A 112 4.627 44.483 5.280 1.00 75.21 N ATOM 0 H LYS A 112 2.638 40.720 6.646 1.00 53.54 H new ATOM 0 HA LYS A 112 1.200 40.005 4.322 1.00 42.55 H new ATOM 0 HB2 LYS A 112 4.040 39.604 5.303 1.00 64.14 H new ATOM 0 HB3 LYS A 112 3.515 38.954 3.763 1.00 64.14 H new ATOM 0 HG2 LYS A 112 4.230 40.956 2.967 1.00 43.23 H new ATOM 0 HG3 LYS A 112 2.643 41.504 3.472 1.00 43.23 H new ATOM 0 HD2 LYS A 112 3.943 41.813 5.824 1.00 63.41 H new ATOM 0 HD3 LYS A 112 5.314 41.978 4.744 1.00 63.41 H new ATOM 0 HE2 LYS A 112 3.938 43.697 3.437 1.00 13.40 H new ATOM 0 HE3 LYS A 112 2.764 43.634 4.737 1.00 13.40 H new ATOM 0 HZ1 LYS A 112 4.317 45.448 5.047 1.00 75.21 H new ATOM 0 HZ2 LYS A 112 4.495 44.313 6.297 1.00 75.21 H new ATOM 0 HZ3 LYS A 112 5.633 44.374 5.038 1.00 75.21 H new ATOM 1713 N ILE A 113 1.898 37.595 6.419 1.00 54.02 N ATOM 1714 CA ILE A 113 1.638 36.196 6.733 1.00 21.43 C ATOM 1715 C ILE A 113 0.142 35.929 6.860 1.00 61.25 C ATOM 1716 O ILE A 113 -0.369 34.942 6.331 1.00 64.11 O ATOM 1717 CB ILE A 113 2.335 35.774 8.040 1.00 25.41 C ATOM 1718 CG1 ILE A 113 3.845 35.996 7.933 1.00 65.13 C ATOM 1719 CG2 ILE A 113 2.030 34.317 8.357 1.00 42.21 C ATOM 1720 CD1 ILE A 113 4.569 35.881 9.256 1.00 32.22 C ATOM 0 H ILE A 113 2.331 38.124 7.176 1.00 54.02 H new ATOM 0 HA ILE A 113 2.041 35.608 5.908 1.00 21.43 H new ATOM 0 HB ILE A 113 1.952 36.390 8.853 1.00 25.41 H new ATOM 0 HG12 ILE A 113 4.262 35.269 7.236 1.00 65.13 H new ATOM 0 HG13 ILE A 113 4.030 36.984 7.512 1.00 65.13 H new ATOM 0 HG21 ILE A 113 2.530 34.034 9.283 1.00 42.21 H new ATOM 0 HG22 ILE A 113 0.954 34.187 8.471 1.00 42.21 H new ATOM 0 HG23 ILE A 113 2.388 33.685 7.544 1.00 42.21 H new ATOM 0 HD11 ILE A 113 5.635 36.050 9.103 1.00 32.22 H new ATOM 0 HD12 ILE A 113 4.179 36.626 9.950 1.00 32.22 H new ATOM 0 HD13 ILE A 113 4.415 34.884 9.669 1.00 32.22 H new ATOM 1732 N GLU A 114 -0.555 36.817 7.562 1.00 23.41 N ATOM 1733 CA GLU A 114 -1.993 36.677 7.756 1.00 31.34 C ATOM 1734 C GLU A 114 -2.730 36.723 6.421 1.00 64.23 C ATOM 1735 O GLU A 114 -3.754 36.065 6.242 1.00 15.50 O ATOM 1736 CB GLU A 114 -2.516 37.781 8.678 1.00 45.13 C ATOM 1737 CG GLU A 114 -3.908 37.511 9.222 1.00 11.33 C ATOM 1738 CD GLU A 114 -3.970 37.598 10.735 1.00 62.11 C ATOM 1739 OE1 GLU A 114 -3.228 36.847 11.402 1.00 21.13 O ATOM 1740 OE2 GLU A 114 -4.760 38.416 11.251 1.00 25.22 O ATOM 0 H GLU A 114 -0.147 37.640 8.005 1.00 23.41 H new ATOM 0 HA GLU A 114 -2.178 35.708 8.220 1.00 31.34 H new ATOM 0 HB2 GLU A 114 -1.826 37.902 9.513 1.00 45.13 H new ATOM 0 HB3 GLU A 114 -2.525 38.724 8.132 1.00 45.13 H new ATOM 0 HG2 GLU A 114 -4.608 38.228 8.792 1.00 11.33 H new ATOM 0 HG3 GLU A 114 -4.232 36.520 8.905 1.00 11.33 H new ATOM 1747 N ALA A 115 -2.199 37.505 5.486 1.00 33.30 N ATOM 1748 CA ALA A 115 -2.804 37.636 4.166 1.00 14.15 C ATOM 1749 C ALA A 115 -2.726 36.324 3.394 1.00 74.14 C ATOM 1750 O ALA A 115 -3.730 35.839 2.873 1.00 42.13 O ATOM 1751 CB ALA A 115 -2.128 38.753 3.385 1.00 71.54 C ATOM 0 H ALA A 115 -1.352 38.057 5.618 1.00 33.30 H new ATOM 0 HA ALA A 115 -3.857 37.886 4.298 1.00 14.15 H new ATOM 0 HB1 ALA A 115 -2.589 38.840 2.401 1.00 71.54 H new ATOM 0 HB2 ALA A 115 -2.242 39.694 3.924 1.00 71.54 H new ATOM 0 HB3 ALA A 115 -1.068 38.527 3.270 1.00 71.54 H new ATOM 1757 N ASN A 116 -1.527 35.755 3.323 1.00 75.41 N ATOM 1758 CA ASN A 116 -1.319 34.498 2.612 1.00 43.41 C ATOM 1759 C ASN A 116 -2.308 33.436 3.082 1.00 1.30 C ATOM 1760 O ASN A 116 -3.080 32.897 2.289 1.00 72.35 O ATOM 1761 CB ASN A 116 0.114 34.004 2.818 1.00 24.32 C ATOM 1762 CG ASN A 116 1.059 34.504 1.743 1.00 43.41 C ATOM 1763 OD1 ASN A 116 0.719 35.400 0.969 1.00 32.45 O ATOM 1764 ND2 ASN A 116 2.254 33.927 1.690 1.00 71.24 N ATOM 0 H ASN A 116 -0.685 36.144 3.748 1.00 75.41 H new ATOM 0 HA ASN A 116 -1.486 34.678 1.550 1.00 43.41 H new ATOM 0 HB2 ASN A 116 0.472 34.333 3.794 1.00 24.32 H new ATOM 0 HB3 ASN A 116 0.122 32.914 2.826 1.00 24.32 H new ATOM 0 HD21 ASN A 116 2.932 34.223 0.988 1.00 71.24 H new ATOM 0 HD22 ASN A 116 2.493 33.188 2.351 1.00 71.24 H new ATOM 1771 N LEU A 117 -2.279 33.141 4.377 1.00 53.21 N ATOM 1772 CA LEU A 117 -3.174 32.144 4.954 1.00 21.13 C ATOM 1773 C LEU A 117 -4.633 32.539 4.752 1.00 52.12 C ATOM 1774 O LEU A 117 -5.497 31.684 4.560 1.00 12.05 O ATOM 1775 CB LEU A 117 -2.883 31.971 6.446 1.00 3.50 C ATOM 1776 CG LEU A 117 -2.878 33.252 7.281 1.00 11.24 C ATOM 1777 CD1 LEU A 117 -4.269 33.540 7.825 1.00 21.32 C ATOM 1778 CD2 LEU A 117 -1.871 33.144 8.417 1.00 11.42 C ATOM 0 H LEU A 117 -1.646 33.578 5.047 1.00 53.21 H new ATOM 0 HA LEU A 117 -2.999 31.197 4.443 1.00 21.13 H new ATOM 0 HB2 LEU A 117 -3.625 31.291 6.864 1.00 3.50 H new ATOM 0 HB3 LEU A 117 -1.912 31.487 6.553 1.00 3.50 H new ATOM 0 HG LEU A 117 -2.583 34.081 6.638 1.00 11.24 H new ATOM 0 HD11 LEU A 117 -4.246 34.455 8.417 1.00 21.32 H new ATOM 0 HD12 LEU A 117 -4.966 33.661 6.996 1.00 21.32 H new ATOM 0 HD13 LEU A 117 -4.593 32.710 8.453 1.00 21.32 H new ATOM 0 HD21 LEU A 117 -1.881 34.064 9.001 1.00 11.42 H new ATOM 0 HD22 LEU A 117 -2.136 32.304 9.059 1.00 11.42 H new ATOM 0 HD23 LEU A 117 -0.874 32.986 8.006 1.00 11.42 H new ATOM 1790 N ALA A 118 -4.900 33.840 4.793 1.00 4.42 N ATOM 1791 CA ALA A 118 -6.253 34.349 4.610 1.00 12.21 C ATOM 1792 C ALA A 118 -6.779 34.023 3.216 1.00 25.42 C ATOM 1793 O ALA A 118 -7.976 33.804 3.028 1.00 31.04 O ATOM 1794 CB ALA A 118 -6.290 35.851 4.851 1.00 3.05 C ATOM 0 H ALA A 118 -4.196 34.561 4.952 1.00 4.42 H new ATOM 0 HA ALA A 118 -6.899 33.859 5.338 1.00 12.21 H new ATOM 0 HB1 ALA A 118 -7.307 36.217 4.711 1.00 3.05 H new ATOM 0 HB2 ALA A 118 -5.965 36.064 5.869 1.00 3.05 H new ATOM 0 HB3 ALA A 118 -5.625 36.349 4.146 1.00 3.05 H new ATOM 1800 N LEU A 119 -5.877 33.992 2.241 1.00 24.35 N ATOM 1801 CA LEU A 119 -6.249 33.692 0.863 1.00 14.23 C ATOM 1802 C LEU A 119 -6.611 32.219 0.705 1.00 72.11 C ATOM 1803 O LEU A 119 -7.708 31.884 0.257 1.00 64.54 O ATOM 1804 CB LEU A 119 -5.105 34.053 -0.085 1.00 61.03 C ATOM 1805 CG LEU A 119 -5.383 35.188 -1.071 1.00 41.05 C ATOM 1806 CD1 LEU A 119 -4.160 36.080 -1.217 1.00 0.20 C ATOM 1807 CD2 LEU A 119 -5.802 34.629 -2.424 1.00 4.24 C ATOM 0 H LEU A 119 -4.882 34.171 2.379 1.00 24.35 H new ATOM 0 HA LEU A 119 -7.124 34.291 0.610 1.00 14.23 H new ATOM 0 HB2 LEU A 119 -4.235 34.324 0.514 1.00 61.03 H new ATOM 0 HB3 LEU A 119 -4.836 33.163 -0.653 1.00 61.03 H new ATOM 0 HG LEU A 119 -6.202 35.791 -0.679 1.00 41.05 H new ATOM 0 HD11 LEU A 119 -4.377 36.882 -1.923 1.00 0.20 H new ATOM 0 HD12 LEU A 119 -3.904 36.509 -0.248 1.00 0.20 H new ATOM 0 HD13 LEU A 119 -3.321 35.490 -1.585 1.00 0.20 H new ATOM 0 HD21 LEU A 119 -5.996 35.451 -3.113 1.00 4.24 H new ATOM 0 HD22 LEU A 119 -5.004 34.003 -2.822 1.00 4.24 H new ATOM 0 HD23 LEU A 119 -6.707 34.033 -2.307 1.00 4.24 H new ATOM 1819 N ARG A 120 -5.683 31.344 1.078 1.00 71.32 N ATOM 1820 CA ARG A 120 -5.905 29.906 0.978 1.00 3.20 C ATOM 1821 C ARG A 120 -7.088 29.477 1.840 1.00 15.41 C ATOM 1822 O ARG A 120 -8.002 28.802 1.366 1.00 50.01 O ATOM 1823 CB ARG A 120 -4.648 29.144 1.403 1.00 11.31 C ATOM 1824 CG ARG A 120 -4.574 27.733 0.845 1.00 63.44 C ATOM 1825 CD ARG A 120 -5.224 26.728 1.782 1.00 33.42 C ATOM 1826 NE ARG A 120 -4.260 25.763 2.305 1.00 13.10 N ATOM 1827 CZ ARG A 120 -3.668 24.838 1.558 1.00 21.35 C ATOM 1828 NH1 ARG A 120 -3.939 24.752 0.264 1.00 53.35 N ATOM 1829 NH2 ARG A 120 -2.802 23.996 2.107 1.00 24.41 N ATOM 0 H ARG A 120 -4.771 31.605 1.452 1.00 71.32 H new ATOM 0 HA ARG A 120 -6.131 29.670 -0.062 1.00 3.20 H new ATOM 0 HB2 ARG A 120 -3.769 29.701 1.078 1.00 11.31 H new ATOM 0 HB3 ARG A 120 -4.612 29.098 2.491 1.00 11.31 H new ATOM 0 HG2 ARG A 120 -5.068 27.698 -0.126 1.00 63.44 H new ATOM 0 HG3 ARG A 120 -3.532 27.459 0.683 1.00 63.44 H new ATOM 0 HD2 ARG A 120 -5.694 27.257 2.611 1.00 33.42 H new ATOM 0 HD3 ARG A 120 -6.016 26.198 1.252 1.00 33.42 H new ATOM 0 HE ARG A 120 -4.029 25.802 3.298 1.00 13.10 H new ATOM 0 HH11 ARG A 120 -4.604 25.397 -0.162 1.00 53.35 H new ATOM 0 HH12 ARG A 120 -3.482 24.040 -0.306 1.00 53.35 H new ATOM 0 HH21 ARG A 120 -2.591 24.059 3.103 1.00 24.41 H new ATOM 0 HH22 ARG A 120 -2.347 23.286 1.533 1.00 24.41 H new ATOM 1843 N ARG A 121 -7.065 29.874 3.108 1.00 4.13 N ATOM 1844 CA ARG A 121 -8.134 29.530 4.037 1.00 75.51 C ATOM 1845 C ARG A 121 -9.496 29.913 3.464 1.00 21.41 C ATOM 1846 O ARG A 121 -10.458 29.152 3.563 1.00 72.02 O ATOM 1847 CB ARG A 121 -7.919 30.230 5.380 1.00 43.14 C ATOM 1848 CG ARG A 121 -8.784 29.678 6.501 1.00 63.23 C ATOM 1849 CD ARG A 121 -9.309 30.788 7.397 1.00 33.13 C ATOM 1850 NE ARG A 121 -10.626 31.257 6.973 1.00 21.22 N ATOM 1851 CZ ARG A 121 -11.367 32.103 7.680 1.00 73.23 C ATOM 1852 NH1 ARG A 121 -10.924 32.570 8.838 1.00 5.43 N ATOM 1853 NH2 ARG A 121 -12.555 32.483 7.227 1.00 14.03 N ATOM 0 H ARG A 121 -6.317 30.435 3.516 1.00 4.13 H new ATOM 0 HA ARG A 121 -8.113 28.451 4.191 1.00 75.51 H new ATOM 0 HB2 ARG A 121 -6.870 30.139 5.663 1.00 43.14 H new ATOM 0 HB3 ARG A 121 -8.126 31.294 5.263 1.00 43.14 H new ATOM 0 HG2 ARG A 121 -9.622 29.124 6.077 1.00 63.23 H new ATOM 0 HG3 ARG A 121 -8.204 28.972 7.096 1.00 63.23 H new ATOM 0 HD2 ARG A 121 -9.366 30.428 8.424 1.00 33.13 H new ATOM 0 HD3 ARG A 121 -8.607 31.622 7.390 1.00 33.13 H new ATOM 0 HE ARG A 121 -10.997 30.916 6.086 1.00 21.22 H new ATOM 0 HH11 ARG A 121 -10.011 32.280 9.189 1.00 5.43 H new ATOM 0 HH12 ARG A 121 -11.496 33.219 9.378 1.00 5.43 H new ATOM 0 HH21 ARG A 121 -12.899 32.125 6.336 1.00 14.03 H new ATOM 0 HH22 ARG A 121 -13.124 33.133 7.770 1.00 14.03 H new ATOM 1867 N ALA A 122 -9.568 31.097 2.866 1.00 53.22 N ATOM 1868 CA ALA A 122 -10.811 31.581 2.276 1.00 25.42 C ATOM 1869 C ALA A 122 -11.176 30.778 1.032 1.00 15.12 C ATOM 1870 O ALA A 122 -12.317 30.342 0.877 1.00 70.51 O ATOM 1871 CB ALA A 122 -10.694 33.059 1.937 1.00 4.22 C ATOM 0 H ALA A 122 -8.781 31.739 2.777 1.00 53.22 H new ATOM 0 HA ALA A 122 -11.608 31.450 3.008 1.00 25.42 H new ATOM 0 HB1 ALA A 122 -11.629 33.407 1.497 1.00 4.22 H new ATOM 0 HB2 ALA A 122 -10.487 33.625 2.845 1.00 4.22 H new ATOM 0 HB3 ALA A 122 -9.882 33.206 1.225 1.00 4.22 H new ATOM 1877 N ARG A 123 -10.202 30.588 0.149 1.00 52.05 N ATOM 1878 CA ARG A 123 -10.423 29.840 -1.083 1.00 20.51 C ATOM 1879 C ARG A 123 -10.874 28.414 -0.779 1.00 74.11 C ATOM 1880 O ARG A 123 -11.579 27.791 -1.574 1.00 15.11 O ATOM 1881 CB ARG A 123 -9.146 29.813 -1.925 1.00 22.13 C ATOM 1882 CG ARG A 123 -9.113 30.871 -3.016 1.00 33.33 C ATOM 1883 CD ARG A 123 -7.742 31.519 -3.122 1.00 51.40 C ATOM 1884 NE ARG A 123 -7.510 32.094 -4.444 1.00 45.13 N ATOM 1885 CZ ARG A 123 -8.044 33.240 -4.852 1.00 75.42 C ATOM 1886 NH1 ARG A 123 -8.838 33.929 -4.044 1.00 51.24 N ATOM 1887 NH2 ARG A 123 -7.785 33.698 -6.070 1.00 74.43 N ATOM 0 H ARG A 123 -9.252 30.941 0.263 1.00 52.05 H new ATOM 0 HA ARG A 123 -11.211 30.341 -1.646 1.00 20.51 H new ATOM 0 HB2 ARG A 123 -8.286 29.952 -1.270 1.00 22.13 H new ATOM 0 HB3 ARG A 123 -9.043 28.829 -2.382 1.00 22.13 H new ATOM 0 HG2 ARG A 123 -9.377 30.418 -3.972 1.00 33.33 H new ATOM 0 HG3 ARG A 123 -9.862 31.634 -2.807 1.00 33.33 H new ATOM 0 HD2 ARG A 123 -7.650 32.299 -2.366 1.00 51.40 H new ATOM 0 HD3 ARG A 123 -6.973 30.777 -2.909 1.00 51.40 H new ATOM 0 HE ARG A 123 -6.904 31.588 -5.090 1.00 45.13 H new ATOM 0 HH11 ARG A 123 -9.040 33.579 -3.107 1.00 51.24 H new ATOM 0 HH12 ARG A 123 -9.247 34.809 -4.359 1.00 51.24 H new ATOM 0 HH21 ARG A 123 -7.175 33.170 -6.694 1.00 74.43 H new ATOM 0 HH22 ARG A 123 -8.196 34.578 -6.382 1.00 74.43 H new ATOM 1901 N THR A 124 -10.463 27.902 0.377 1.00 61.13 N ATOM 1902 CA THR A 124 -10.823 26.550 0.785 1.00 30.01 C ATOM 1903 C THR A 124 -12.298 26.464 1.161 1.00 22.41 C ATOM 1904 O THR A 124 -13.031 25.620 0.645 1.00 12.12 O ATOM 1905 CB THR A 124 -9.972 26.078 1.979 1.00 0.43 C ATOM 1906 OG1 THR A 124 -8.585 26.077 1.622 1.00 33.42 O ATOM 1907 CG2 THR A 124 -10.388 24.684 2.423 1.00 13.35 C ATOM 0 H THR A 124 -9.880 28.404 1.047 1.00 61.13 H new ATOM 0 HA THR A 124 -10.630 25.900 -0.068 1.00 30.01 H new ATOM 0 HB THR A 124 -10.133 26.768 2.807 1.00 0.43 H new ATOM 0 HG1 THR A 124 -8.277 27.000 1.505 1.00 33.42 H new ATOM 0 HG21 THR A 124 -9.773 24.372 3.267 1.00 13.35 H new ATOM 0 HG22 THR A 124 -11.436 24.695 2.722 1.00 13.35 H new ATOM 0 HG23 THR A 124 -10.253 23.984 1.598 1.00 13.35 H new ATOM 1915 N ARG A 125 -12.726 27.341 2.062 1.00 13.52 N ATOM 1916 CA ARG A 125 -14.114 27.364 2.507 1.00 34.54 C ATOM 1917 C ARG A 125 -15.064 27.486 1.320 1.00 74.14 C ATOM 1918 O ARG A 125 -16.145 26.897 1.312 1.00 33.34 O ATOM 1919 CB ARG A 125 -14.343 28.524 3.478 1.00 25.42 C ATOM 1920 CG ARG A 125 -15.714 28.509 4.134 1.00 62.44 C ATOM 1921 CD ARG A 125 -16.682 29.441 3.422 1.00 4.11 C ATOM 1922 NE ARG A 125 -17.979 29.498 4.091 1.00 62.43 N ATOM 1923 CZ ARG A 125 -19.041 30.112 3.583 1.00 73.25 C ATOM 1924 NH1 ARG A 125 -18.961 30.718 2.406 1.00 10.43 N ATOM 1925 NH2 ARG A 125 -20.187 30.120 4.251 1.00 34.31 N ATOM 0 H ARG A 125 -12.131 28.046 2.499 1.00 13.52 H new ATOM 0 HA ARG A 125 -14.319 26.424 3.020 1.00 34.54 H new ATOM 0 HB2 ARG A 125 -13.578 28.493 4.254 1.00 25.42 H new ATOM 0 HB3 ARG A 125 -14.216 29.465 2.943 1.00 25.42 H new ATOM 0 HG2 ARG A 125 -16.112 27.494 4.126 1.00 62.44 H new ATOM 0 HG3 ARG A 125 -15.622 28.807 5.179 1.00 62.44 H new ATOM 0 HD2 ARG A 125 -16.254 30.442 3.376 1.00 4.11 H new ATOM 0 HD3 ARG A 125 -16.819 29.105 2.394 1.00 4.11 H new ATOM 0 HE ARG A 125 -18.074 29.041 4.998 1.00 62.43 H new ATOM 0 HH11 ARG A 125 -18.082 30.713 1.889 1.00 10.43 H new ATOM 0 HH12 ARG A 125 -19.778 31.189 2.018 1.00 10.43 H new ATOM 0 HH21 ARG A 125 -20.253 29.654 5.156 1.00 34.31 H new ATOM 0 HH22 ARG A 125 -21.002 30.592 3.860 1.00 34.31 H new ATOM 1939 N VAL A 126 -14.654 28.255 0.317 1.00 44.54 N ATOM 1940 CA VAL A 126 -15.467 28.455 -0.877 1.00 12.03 C ATOM 1941 C VAL A 126 -15.538 27.182 -1.713 1.00 1.22 C ATOM 1942 O VAL A 126 -16.609 26.789 -2.172 1.00 75.21 O ATOM 1943 CB VAL A 126 -14.915 29.599 -1.748 1.00 65.51 C ATOM 1944 CG1 VAL A 126 -15.773 29.787 -2.989 1.00 54.42 C ATOM 1945 CG2 VAL A 126 -14.833 30.888 -0.945 1.00 63.10 C ATOM 0 H VAL A 126 -13.762 28.750 0.307 1.00 44.54 H new ATOM 0 HA VAL A 126 -16.468 28.719 -0.537 1.00 12.03 H new ATOM 0 HB VAL A 126 -13.908 29.334 -2.069 1.00 65.51 H new ATOM 0 HG11 VAL A 126 -15.368 30.599 -3.592 1.00 54.42 H new ATOM 0 HG12 VAL A 126 -15.774 28.867 -3.573 1.00 54.42 H new ATOM 0 HG13 VAL A 126 -16.793 30.030 -2.692 1.00 54.42 H new ATOM 0 HG21 VAL A 126 -14.441 31.686 -1.576 1.00 63.10 H new ATOM 0 HG22 VAL A 126 -15.828 31.161 -0.592 1.00 63.10 H new ATOM 0 HG23 VAL A 126 -14.172 30.743 -0.091 1.00 63.10 H new ATOM 1955 N GLU A 127 -14.388 26.543 -1.906 1.00 34.34 N ATOM 1956 CA GLU A 127 -14.321 25.314 -2.687 1.00 63.43 C ATOM 1957 C GLU A 127 -15.102 24.193 -2.008 1.00 31.23 C ATOM 1958 O GLU A 127 -15.809 23.428 -2.664 1.00 2.32 O ATOM 1959 CB GLU A 127 -12.864 24.888 -2.884 1.00 72.14 C ATOM 1960 CG GLU A 127 -12.698 23.702 -3.820 1.00 41.42 C ATOM 1961 CD GLU A 127 -11.561 23.892 -4.805 1.00 61.14 C ATOM 1962 OE1 GLU A 127 -10.397 23.653 -4.420 1.00 71.03 O ATOM 1963 OE2 GLU A 127 -11.834 24.279 -5.961 1.00 13.14 O ATOM 0 H GLU A 127 -13.492 26.856 -1.533 1.00 34.34 H new ATOM 0 HA GLU A 127 -14.771 25.508 -3.661 1.00 63.43 H new ATOM 0 HB2 GLU A 127 -12.297 25.732 -3.277 1.00 72.14 H new ATOM 0 HB3 GLU A 127 -12.433 24.638 -1.915 1.00 72.14 H new ATOM 0 HG2 GLU A 127 -12.518 22.802 -3.232 1.00 41.42 H new ATOM 0 HG3 GLU A 127 -13.627 23.544 -4.369 1.00 41.42 H new ATOM 1970 N ALA A 128 -14.968 24.102 -0.689 1.00 34.14 N ATOM 1971 CA ALA A 128 -15.662 23.077 0.081 1.00 72.53 C ATOM 1972 C ALA A 128 -17.152 23.384 0.187 1.00 0.24 C ATOM 1973 O ALA A 128 -17.979 22.476 0.264 1.00 32.20 O ATOM 1974 CB ALA A 128 -15.047 22.950 1.466 1.00 20.45 C ATOM 0 H ALA A 128 -14.385 24.726 -0.131 1.00 34.14 H new ATOM 0 HA ALA A 128 -15.550 22.127 -0.442 1.00 72.53 H new ATOM 0 HB1 ALA A 128 -15.575 22.181 2.030 1.00 20.45 H new ATOM 0 HB2 ALA A 128 -13.996 22.675 1.374 1.00 20.45 H new ATOM 0 HB3 ALA A 128 -15.128 23.903 1.989 1.00 20.45 H new ATOM 1980 N SER A 129 -17.487 24.670 0.193 1.00 50.44 N ATOM 1981 CA SER A 129 -18.877 25.098 0.295 1.00 75.34 C ATOM 1982 C SER A 129 -19.665 24.686 -0.946 1.00 4.50 C ATOM 1983 O SER A 129 -20.796 24.215 -0.848 1.00 35.41 O ATOM 1984 CB SER A 129 -18.955 26.614 0.482 1.00 43.10 C ATOM 1985 OG SER A 129 -18.794 26.968 1.845 1.00 53.54 O ATOM 0 H SER A 129 -16.814 25.434 0.128 1.00 50.44 H new ATOM 0 HA SER A 129 -19.318 24.609 1.164 1.00 75.34 H new ATOM 0 HB2 SER A 129 -18.183 27.098 -0.116 1.00 43.10 H new ATOM 0 HB3 SER A 129 -19.916 26.980 0.119 1.00 43.10 H new ATOM 0 HG SER A 129 -17.839 27.043 2.053 1.00 53.54 H new ATOM 1991 N ASN A 130 -19.056 24.870 -2.113 1.00 63.31 N ATOM 1992 CA ASN A 130 -19.699 24.519 -3.374 1.00 62.31 C ATOM 1993 C ASN A 130 -18.836 23.546 -4.172 1.00 73.23 C ATOM 1994 O ASN A 130 -18.641 23.715 -5.376 1.00 72.35 O ATOM 1995 CB ASN A 130 -19.967 25.777 -4.202 1.00 3.44 C ATOM 1996 CG ASN A 130 -21.083 25.580 -5.209 1.00 43.23 C ATOM 1997 OD1 ASN A 130 -21.079 24.617 -5.975 1.00 72.44 O ATOM 1998 ND2 ASN A 130 -22.045 26.495 -5.213 1.00 0.33 N ATOM 0 H ASN A 130 -18.119 25.260 -2.212 1.00 63.31 H new ATOM 0 HA ASN A 130 -20.648 24.033 -3.146 1.00 62.31 H new ATOM 0 HB2 ASN A 130 -20.225 26.600 -3.535 1.00 3.44 H new ATOM 0 HB3 ASN A 130 -19.055 26.065 -4.726 1.00 3.44 H new ATOM 0 HD21 ASN A 130 -22.822 26.416 -5.869 1.00 0.33 H new ATOM 0 HD22 ASN A 130 -22.007 27.277 -4.560 1.00 0.33 H new ATOM 2005 N THR A 131 -18.322 22.525 -3.493 1.00 44.22 N ATOM 2006 CA THR A 131 -17.480 21.525 -4.138 1.00 3.34 C ATOM 2007 C THR A 131 -18.153 20.959 -5.382 1.00 51.25 C ATOM 2008 O THR A 131 -17.523 20.819 -6.431 1.00 23.52 O ATOM 2009 CB THR A 131 -17.146 20.368 -3.177 1.00 53.21 C ATOM 2010 OG1 THR A 131 -16.469 19.324 -3.885 1.00 30.33 O ATOM 2011 CG2 THR A 131 -18.410 19.816 -2.536 1.00 14.04 C ATOM 0 H THR A 131 -18.474 22.369 -2.497 1.00 44.22 H new ATOM 0 HA THR A 131 -16.556 22.027 -4.425 1.00 3.34 H new ATOM 0 HB THR A 131 -16.497 20.753 -2.390 1.00 53.21 H new ATOM 0 HG1 THR A 131 -16.259 18.593 -3.267 1.00 30.33 H new ATOM 0 HG21 THR A 131 -18.150 19.000 -1.862 1.00 14.04 H new ATOM 0 HG22 THR A 131 -18.908 20.606 -1.974 1.00 14.04 H new ATOM 0 HG23 THR A 131 -19.080 19.445 -3.312 1.00 14.04 H new ATOM 2019 N ILE A 132 -19.436 20.637 -5.261 1.00 34.15 N ATOM 2020 CA ILE A 132 -20.195 20.088 -6.377 1.00 71.14 C ATOM 2021 C ILE A 132 -21.685 20.371 -6.222 1.00 13.41 C ATOM 2022 O ILE A 132 -22.361 19.761 -5.394 1.00 22.24 O ATOM 2023 CB ILE A 132 -19.984 18.568 -6.508 1.00 71.12 C ATOM 2024 CG1 ILE A 132 -20.117 17.893 -5.141 1.00 52.15 C ATOM 2025 CG2 ILE A 132 -18.623 18.273 -7.120 1.00 60.24 C ATOM 2026 CD1 ILE A 132 -20.967 16.642 -5.166 1.00 23.34 C ATOM 0 H ILE A 132 -19.972 20.747 -4.400 1.00 34.15 H new ATOM 0 HA ILE A 132 -19.827 20.577 -7.279 1.00 71.14 H new ATOM 0 HB ILE A 132 -20.752 18.165 -7.168 1.00 71.12 H new ATOM 0 HG12 ILE A 132 -19.123 17.640 -4.771 1.00 52.15 H new ATOM 0 HG13 ILE A 132 -20.549 18.602 -4.435 1.00 52.15 H new ATOM 0 HG21 ILE A 132 -18.489 17.195 -7.206 1.00 60.24 H new ATOM 0 HG22 ILE A 132 -18.563 18.726 -8.109 1.00 60.24 H new ATOM 0 HG23 ILE A 132 -17.841 18.686 -6.484 1.00 60.24 H new ATOM 0 HD11 ILE A 132 -21.018 16.216 -4.164 1.00 23.34 H new ATOM 0 HD12 ILE A 132 -21.972 16.892 -5.505 1.00 23.34 H new ATOM 0 HD13 ILE A 132 -20.524 15.915 -5.847 1.00 23.34 H new ATOM 2038 N SER A 133 -22.192 21.301 -7.026 1.00 33.15 N ATOM 2039 CA SER A 133 -23.603 21.667 -6.976 1.00 42.32 C ATOM 2040 C SER A 133 -24.363 21.063 -8.153 1.00 24.40 C ATOM 2041 O SER A 133 -24.191 21.481 -9.298 1.00 15.42 O ATOM 2042 CB SER A 133 -23.757 23.189 -6.983 1.00 43.52 C ATOM 2043 OG SER A 133 -23.828 23.701 -5.664 1.00 22.15 O ATOM 0 H SER A 133 -21.647 21.814 -7.719 1.00 33.15 H new ATOM 0 HA SER A 133 -24.023 21.270 -6.052 1.00 42.32 H new ATOM 0 HB2 SER A 133 -22.914 23.640 -7.507 1.00 43.52 H new ATOM 0 HB3 SER A 133 -24.658 23.464 -7.532 1.00 43.52 H new ATOM 0 HG SER A 133 -23.924 24.676 -5.696 1.00 22.15 H new ATOM 2049 N SER A 134 -25.203 20.075 -7.862 1.00 22.41 N ATOM 2050 CA SER A 134 -25.987 19.408 -8.895 1.00 42.53 C ATOM 2051 C SER A 134 -27.474 19.699 -8.721 1.00 13.23 C ATOM 2052 O SER A 134 -27.910 20.138 -7.658 1.00 13.42 O ATOM 2053 CB SER A 134 -25.743 17.899 -8.857 1.00 23.34 C ATOM 2054 OG SER A 134 -26.091 17.358 -7.594 1.00 23.12 O ATOM 0 H SER A 134 -25.358 19.719 -6.919 1.00 22.41 H new ATOM 0 HA SER A 134 -25.670 19.795 -9.863 1.00 42.53 H new ATOM 0 HB2 SER A 134 -26.328 17.413 -9.638 1.00 23.34 H new ATOM 0 HB3 SER A 134 -24.694 17.692 -9.069 1.00 23.34 H new ATOM 0 HG SER A 134 -25.928 16.392 -7.596 1.00 23.12 H new TER 2060 SER A 134