USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1101 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 125 HIS : no HD1:sc= 0.409 K(o=1.4,f=-4) USER MOD Set 1.2: A 130 ASN : amide:sc= 0.972 K(o=1.4,f=-0.79) USER MOD Set 2.1: A 115 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 119 HIS : no HD1:sc= -0.656 K(o=-0.66,f=0.17) USER MOD Set 3.1: A 82 ASN : amide:sc= 0.645 X(o=-6.3,f=-6.2!) USER MOD Set 3.2: A 83 ASN : amide:sc= -6.92! C(o=-6.3!,f=-1.9!) USER MOD Set 4.1: A 29 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 30 ASN : amide:sc= -0.435 K(o=-0.44,f=-5.6!) USER MOD Set 5.1: A 11 ASN : amide:sc= 0.655 K(o=0.63,f=-3.5!) USER MOD Set 5.2: A 74 GLN : amide:sc= -0.0277 K(o=0.63,f=-2.9!) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 165:sc= -0.0699 (180deg=-0.338) USER MOD Single : A 13 GLN : amide:sc= -3.94! C(o=-3.9!,f=-4.6!) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot -17:sc= 0.22 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= 0.0821 K(o=0.082,f=-5.1!) USER MOD Single : A 36 MET CE :methyl -145:sc= -0.124 (180deg=-1.03) USER MOD Single : A 37 ASN : amide:sc= -1.69! C(o=-1.7!,f=-7.7!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 81:sc= 0.745 USER MOD Single : A 47 HIS : no HD1:sc= 0.68 K(o=0.68,f=-2.1!) USER MOD Single : A 55 THR OG1 : rot -169:sc= -0.637! USER MOD Single : A 58 SER OG : rot 180:sc= 0.119 USER MOD Single : A 68 THR OG1 : rot 114:sc= 0.601 USER MOD Single : A 70 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0353) USER MOD Single : A 84 ASN : amide:sc= -0.471 K(o=-0.47,f=-3.5!) USER MOD Single : A 94 GLN : amide:sc= -4.15! C(o=-4.2!,f=-11!) USER MOD Single : A 101 THR OG1 : rot 132:sc= 0.804 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 MET CE :methyl -157:sc= -1.73 (180deg=-2.77!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 110:sc= 0.939 USER MOD Single : A 136 SER OG : rot -17:sc= -0.746 USER MOD Single : A 143 GLN : amide:sc= 0 K(o=0,f=-0.58) USER MOD Single : A 144 GLN : amide:sc= 0.281 K(o=0.28,f=-3.6!) USER MOD ----------------------------------------------------------------- ATOM 44 N VAL A 3 5.289 -3.457 17.832 1.00 40.12 N ATOM 45 CA VAL A 3 6.354 -3.539 16.825 1.00 53.32 C ATOM 46 C VAL A 3 6.235 -4.814 15.971 1.00 42.41 C ATOM 47 O VAL A 3 6.028 -5.911 16.495 1.00 31.13 O ATOM 48 CB VAL A 3 7.755 -3.493 17.489 1.00 54.40 C ATOM 49 CG1 VAL A 3 8.864 -3.577 16.439 1.00 3.01 C ATOM 50 CG2 VAL A 3 7.907 -2.230 18.339 1.00 15.33 C ATOM 0 HA VAL A 3 6.237 -2.673 16.173 1.00 53.32 H new ATOM 0 HB VAL A 3 7.847 -4.360 18.143 1.00 54.40 H new ATOM 0 HG11 VAL A 3 9.835 -3.543 16.932 1.00 3.01 H new ATOM 0 HG12 VAL A 3 8.771 -4.511 15.885 1.00 3.01 H new ATOM 0 HG13 VAL A 3 8.777 -2.737 15.750 1.00 3.01 H new ATOM 0 HG21 VAL A 3 8.896 -2.216 18.796 1.00 15.33 H new ATOM 0 HG22 VAL A 3 7.787 -1.350 17.707 1.00 15.33 H new ATOM 0 HG23 VAL A 3 7.146 -2.223 19.120 1.00 15.33 H new ATOM 60 N TYR A 4 6.358 -4.655 14.654 1.00 61.01 N ATOM 61 CA TYR A 4 6.327 -5.787 13.717 1.00 4.21 C ATOM 62 C TYR A 4 7.587 -5.835 12.846 1.00 64.33 C ATOM 63 O TYR A 4 8.091 -4.804 12.398 1.00 20.22 O ATOM 64 CB TYR A 4 5.099 -5.706 12.797 1.00 1.31 C ATOM 65 CG TYR A 4 3.795 -6.119 13.447 1.00 42.52 C ATOM 66 CD1 TYR A 4 3.046 -5.215 14.188 1.00 73.22 C ATOM 67 CD2 TYR A 4 3.306 -7.414 13.304 1.00 52.01 C ATOM 68 CE1 TYR A 4 1.851 -5.588 14.766 1.00 54.05 C ATOM 69 CE2 TYR A 4 2.112 -7.794 13.882 1.00 5.33 C ATOM 70 CZ TYR A 4 1.387 -6.877 14.611 1.00 62.43 C ATOM 71 OH TYR A 4 0.198 -7.255 15.191 1.00 34.23 O ATOM 0 H TYR A 4 6.481 -3.747 14.205 1.00 61.01 H new ATOM 0 HA TYR A 4 6.277 -6.692 14.322 1.00 4.21 H new ATOM 0 HB2 TYR A 4 5.001 -4.683 12.434 1.00 1.31 H new ATOM 0 HB3 TYR A 4 5.272 -6.338 11.926 1.00 1.31 H new ATOM 0 HD1 TYR A 4 3.405 -4.204 14.314 1.00 73.22 H new ATOM 0 HD2 TYR A 4 3.871 -8.134 12.731 1.00 52.01 H new ATOM 0 HE1 TYR A 4 1.280 -4.872 15.339 1.00 54.05 H new ATOM 0 HE2 TYR A 4 1.748 -8.804 13.764 1.00 5.33 H new ATOM 0 HH TYR A 4 0.017 -8.195 14.983 1.00 34.23 H new ATOM 81 N LYS A 5 8.092 -7.041 12.624 1.00 34.10 N ATOM 82 CA LYS A 5 9.154 -7.281 11.646 1.00 12.02 C ATOM 83 C LYS A 5 8.565 -7.979 10.406 1.00 73.21 C ATOM 84 O LYS A 5 7.434 -8.471 10.452 1.00 65.21 O ATOM 85 CB LYS A 5 10.254 -8.159 12.268 1.00 4.23 C ATOM 86 CG LYS A 5 10.835 -7.612 13.566 1.00 43.14 C ATOM 87 CD LYS A 5 11.602 -6.310 13.357 1.00 71.01 C ATOM 88 CE LYS A 5 12.194 -5.798 14.665 1.00 41.42 C ATOM 89 NZ LYS A 5 13.114 -6.791 15.284 1.00 63.34 N ATOM 0 H LYS A 5 7.781 -7.880 13.113 1.00 34.10 H new ATOM 0 HA LYS A 5 9.590 -6.327 11.349 1.00 12.02 H new ATOM 0 HB2 LYS A 5 9.846 -9.152 12.456 1.00 4.23 H new ATOM 0 HB3 LYS A 5 11.060 -8.277 11.544 1.00 4.23 H new ATOM 0 HG2 LYS A 5 10.028 -7.445 14.280 1.00 43.14 H new ATOM 0 HG3 LYS A 5 11.500 -8.356 14.005 1.00 43.14 H new ATOM 0 HD2 LYS A 5 12.400 -6.468 12.632 1.00 71.01 H new ATOM 0 HD3 LYS A 5 10.935 -5.556 12.938 1.00 71.01 H new ATOM 0 HE2 LYS A 5 12.734 -4.869 14.480 1.00 41.42 H new ATOM 0 HE3 LYS A 5 11.389 -5.566 15.362 1.00 41.42 H new ATOM 0 HZ1 LYS A 5 13.684 -6.325 16.018 1.00 63.34 H new ATOM 0 HZ2 LYS A 5 12.559 -7.559 15.712 1.00 63.34 H new ATOM 0 HZ3 LYS A 5 13.743 -7.184 14.554 1.00 63.34 H new ATOM 103 N PRO A 6 9.308 -8.057 9.279 1.00 40.00 N ATOM 104 CA PRO A 6 8.824 -8.763 8.077 1.00 3.14 C ATOM 105 C PRO A 6 8.505 -10.241 8.357 1.00 32.20 C ATOM 106 O PRO A 6 7.814 -10.899 7.584 1.00 51.14 O ATOM 107 CB PRO A 6 9.991 -8.630 7.081 1.00 63.30 C ATOM 108 CG PRO A 6 11.180 -8.288 7.918 1.00 63.24 C ATOM 109 CD PRO A 6 10.651 -7.480 9.071 1.00 2.41 C ATOM 0 HA PRO A 6 7.890 -8.342 7.705 1.00 3.14 H new ATOM 0 HB2 PRO A 6 10.149 -9.559 6.533 1.00 63.30 H new ATOM 0 HB3 PRO A 6 9.792 -7.853 6.342 1.00 63.30 H new ATOM 0 HG2 PRO A 6 11.683 -9.189 8.270 1.00 63.24 H new ATOM 0 HG3 PRO A 6 11.911 -7.719 7.344 1.00 63.24 H new ATOM 0 HD2 PRO A 6 11.277 -7.581 9.958 1.00 2.41 H new ATOM 0 HD3 PRO A 6 10.603 -6.417 8.833 1.00 2.41 H new ATOM 117 N GLU A 7 9.019 -10.748 9.476 1.00 35.51 N ATOM 118 CA GLU A 7 8.799 -12.136 9.895 1.00 35.13 C ATOM 119 C GLU A 7 7.549 -12.277 10.792 1.00 75.10 C ATOM 120 O GLU A 7 7.044 -13.382 10.998 1.00 13.04 O ATOM 121 CB GLU A 7 10.047 -12.645 10.628 1.00 25.12 C ATOM 122 CG GLU A 7 10.442 -11.789 11.826 1.00 12.31 C ATOM 123 CD GLU A 7 11.818 -12.136 12.368 1.00 43.31 C ATOM 124 OE1 GLU A 7 11.941 -13.147 13.084 1.00 71.30 O ATOM 125 OE2 GLU A 7 12.786 -11.399 12.077 1.00 32.41 O ATOM 0 H GLU A 7 9.600 -10.210 10.119 1.00 35.51 H new ATOM 0 HA GLU A 7 8.621 -12.739 9.005 1.00 35.13 H new ATOM 0 HB2 GLU A 7 9.869 -13.666 10.965 1.00 25.12 H new ATOM 0 HB3 GLU A 7 10.881 -12.681 9.927 1.00 25.12 H new ATOM 0 HG2 GLU A 7 10.424 -10.738 11.538 1.00 12.31 H new ATOM 0 HG3 GLU A 7 9.702 -11.915 12.617 1.00 12.31 H new ATOM 132 N ASP A 8 7.061 -11.161 11.337 1.00 53.04 N ATOM 133 CA ASP A 8 5.824 -11.169 12.133 1.00 62.32 C ATOM 134 C ASP A 8 4.589 -11.002 11.236 1.00 5.12 C ATOM 135 O ASP A 8 3.508 -11.507 11.545 1.00 41.44 O ATOM 136 CB ASP A 8 5.849 -10.053 13.184 1.00 23.21 C ATOM 137 CG ASP A 8 6.981 -10.218 14.180 1.00 70.45 C ATOM 138 OD1 ASP A 8 8.085 -9.710 13.910 1.00 1.32 O ATOM 139 OD2 ASP A 8 6.772 -10.855 15.237 1.00 41.03 O ATOM 0 H ASP A 8 7.497 -10.244 11.245 1.00 53.04 H new ATOM 0 HA ASP A 8 5.763 -12.134 12.637 1.00 62.32 H new ATOM 0 HB2 ASP A 8 5.947 -9.090 12.684 1.00 23.21 H new ATOM 0 HB3 ASP A 8 4.899 -10.040 13.718 1.00 23.21 H new ATOM 144 N VAL A 9 4.766 -10.291 10.124 1.00 63.30 N ATOM 145 CA VAL A 9 3.675 -10.029 9.180 1.00 1.54 C ATOM 146 C VAL A 9 3.192 -11.322 8.492 1.00 64.42 C ATOM 147 O VAL A 9 3.984 -12.037 7.875 1.00 74.25 O ATOM 148 CB VAL A 9 4.116 -9.011 8.095 1.00 1.13 C ATOM 149 CG1 VAL A 9 2.974 -8.712 7.124 1.00 31.23 C ATOM 150 CG2 VAL A 9 4.634 -7.723 8.738 1.00 43.52 C ATOM 0 H VAL A 9 5.660 -9.883 9.851 1.00 63.30 H new ATOM 0 HA VAL A 9 2.850 -9.613 9.758 1.00 1.54 H new ATOM 0 HB VAL A 9 4.930 -9.459 7.526 1.00 1.13 H new ATOM 0 HG11 VAL A 9 3.312 -7.996 6.375 1.00 31.23 H new ATOM 0 HG12 VAL A 9 2.664 -9.634 6.631 1.00 31.23 H new ATOM 0 HG13 VAL A 9 2.130 -8.293 7.672 1.00 31.23 H new ATOM 0 HG21 VAL A 9 4.938 -7.024 7.959 1.00 43.52 H new ATOM 0 HG22 VAL A 9 3.844 -7.274 9.341 1.00 43.52 H new ATOM 0 HG23 VAL A 9 5.490 -7.952 9.373 1.00 43.52 H new ATOM 160 N PRO A 10 1.884 -11.646 8.604 1.00 12.41 N ATOM 161 CA PRO A 10 1.289 -12.817 7.929 1.00 72.12 C ATOM 162 C PRO A 10 1.581 -12.860 6.416 1.00 12.14 C ATOM 163 O PRO A 10 1.166 -11.974 5.662 1.00 11.42 O ATOM 164 CB PRO A 10 -0.217 -12.644 8.184 1.00 63.32 C ATOM 165 CG PRO A 10 -0.294 -11.853 9.445 1.00 53.03 C ATOM 166 CD PRO A 10 0.889 -10.918 9.417 1.00 10.32 C ATOM 0 HA PRO A 10 1.701 -13.751 8.311 1.00 72.12 H new ATOM 0 HB2 PRO A 10 -0.702 -12.123 7.359 1.00 63.32 H new ATOM 0 HB3 PRO A 10 -0.715 -13.608 8.289 1.00 63.32 H new ATOM 0 HG2 PRO A 10 -1.230 -11.297 9.501 1.00 53.03 H new ATOM 0 HG3 PRO A 10 -0.257 -12.505 10.318 1.00 53.03 H new ATOM 0 HD2 PRO A 10 0.631 -9.958 8.971 1.00 10.32 H new ATOM 0 HD3 PRO A 10 1.263 -10.713 10.420 1.00 10.32 H new ATOM 174 N ASN A 11 2.293 -13.900 5.985 1.00 12.11 N ATOM 175 CA ASN A 11 2.679 -14.065 4.578 1.00 74.41 C ATOM 176 C ASN A 11 1.471 -14.356 3.671 1.00 13.04 C ATOM 177 O ASN A 11 1.224 -15.506 3.298 1.00 71.20 O ATOM 178 CB ASN A 11 3.703 -15.195 4.438 1.00 52.43 C ATOM 179 CG ASN A 11 4.978 -14.931 5.205 1.00 12.42 C ATOM 180 OD1 ASN A 11 5.372 -13.790 5.408 1.00 75.43 O ATOM 181 ND2 ASN A 11 5.639 -15.984 5.635 1.00 33.15 N ATOM 0 H ASN A 11 2.619 -14.650 6.595 1.00 12.11 H new ATOM 0 HA ASN A 11 3.119 -13.121 4.257 1.00 74.41 H new ATOM 0 HB2 ASN A 11 3.259 -16.126 4.790 1.00 52.43 H new ATOM 0 HB3 ASN A 11 3.941 -15.334 3.384 1.00 52.43 H new ATOM 0 HD21 ASN A 11 6.508 -15.863 6.155 1.00 33.15 H new ATOM 0 HD22 ASN A 11 5.282 -16.921 5.448 1.00 33.15 H new ATOM 188 N VAL A 12 0.720 -13.316 3.321 1.00 22.02 N ATOM 189 CA VAL A 12 -0.431 -13.474 2.426 1.00 40.22 C ATOM 190 C VAL A 12 0.003 -13.897 1.010 1.00 52.43 C ATOM 191 O VAL A 12 -0.454 -14.915 0.507 1.00 65.55 O ATOM 192 CB VAL A 12 -1.305 -12.191 2.363 1.00 75.40 C ATOM 193 CG1 VAL A 12 -2.079 -12.004 3.666 1.00 71.54 C ATOM 194 CG2 VAL A 12 -0.455 -10.957 2.071 1.00 33.23 C ATOM 0 H VAL A 12 0.882 -12.360 3.638 1.00 22.02 H new ATOM 0 HA VAL A 12 -1.041 -14.272 2.849 1.00 40.22 H new ATOM 0 HB VAL A 12 -2.017 -12.313 1.547 1.00 75.40 H new ATOM 0 HG11 VAL A 12 -2.685 -11.100 3.603 1.00 71.54 H new ATOM 0 HG12 VAL A 12 -2.727 -12.865 3.831 1.00 71.54 H new ATOM 0 HG13 VAL A 12 -1.378 -11.913 4.496 1.00 71.54 H new ATOM 0 HG21 VAL A 12 -1.095 -10.075 2.033 1.00 33.23 H new ATOM 0 HG22 VAL A 12 0.288 -10.832 2.859 1.00 33.23 H new ATOM 0 HG23 VAL A 12 0.049 -11.081 1.113 1.00 33.23 H new ATOM 204 N GLN A 13 0.921 -13.148 0.395 1.00 61.42 N ATOM 205 CA GLN A 13 1.399 -13.461 -0.969 1.00 61.45 C ATOM 206 C GLN A 13 2.273 -14.731 -1.018 1.00 4.41 C ATOM 207 O GLN A 13 2.776 -15.103 -2.078 1.00 44.04 O ATOM 208 CB GLN A 13 2.173 -12.262 -1.553 1.00 52.42 C ATOM 209 CG GLN A 13 1.299 -11.246 -2.290 1.00 53.31 C ATOM 210 CD GLN A 13 0.063 -10.844 -1.505 1.00 1.43 C ATOM 211 OE1 GLN A 13 0.087 -9.900 -0.730 1.00 53.32 O ATOM 212 NE2 GLN A 13 -1.029 -11.562 -1.701 1.00 24.52 N ATOM 0 H GLN A 13 1.351 -12.322 0.811 1.00 61.42 H new ATOM 0 HA GLN A 13 0.515 -13.658 -1.576 1.00 61.45 H new ATOM 0 HB2 GLN A 13 2.696 -11.754 -0.743 1.00 52.42 H new ATOM 0 HB3 GLN A 13 2.933 -12.635 -2.239 1.00 52.42 H new ATOM 0 HG2 GLN A 13 1.890 -10.356 -2.506 1.00 53.31 H new ATOM 0 HG3 GLN A 13 0.993 -11.666 -3.248 1.00 53.31 H new ATOM 0 HE21 GLN A 13 -1.014 -12.344 -2.356 1.00 24.52 H new ATOM 0 HE22 GLN A 13 -1.886 -11.334 -1.198 1.00 24.52 H new ATOM 221 N LEU A 14 2.453 -15.387 0.125 1.00 14.11 N ATOM 222 CA LEU A 14 3.215 -16.640 0.186 1.00 51.51 C ATOM 223 C LEU A 14 2.281 -17.834 0.449 1.00 22.04 C ATOM 224 O LEU A 14 2.438 -18.902 -0.147 1.00 42.35 O ATOM 225 CB LEU A 14 4.304 -16.526 1.275 1.00 64.41 C ATOM 226 CG LEU A 14 5.326 -17.686 1.372 1.00 5.10 C ATOM 227 CD1 LEU A 14 6.596 -17.218 2.080 1.00 30.15 C ATOM 228 CD2 LEU A 14 4.740 -18.886 2.116 1.00 31.24 C ATOM 0 H LEU A 14 2.084 -15.076 1.023 1.00 14.11 H new ATOM 0 HA LEU A 14 3.700 -16.814 -0.775 1.00 51.51 H new ATOM 0 HB2 LEU A 14 4.856 -15.601 1.106 1.00 64.41 H new ATOM 0 HB3 LEU A 14 3.808 -16.430 2.241 1.00 64.41 H new ATOM 0 HG LEU A 14 5.568 -17.996 0.355 1.00 5.10 H new ATOM 0 HD11 LEU A 14 7.304 -18.044 2.140 1.00 30.15 H new ATOM 0 HD12 LEU A 14 7.043 -16.397 1.520 1.00 30.15 H new ATOM 0 HD13 LEU A 14 6.348 -16.879 3.086 1.00 30.15 H new ATOM 0 HD21 LEU A 14 5.483 -19.682 2.166 1.00 31.24 H new ATOM 0 HD22 LEU A 14 4.460 -18.587 3.126 1.00 31.24 H new ATOM 0 HD23 LEU A 14 3.858 -19.247 1.587 1.00 31.24 H new ATOM 240 N ALA A 15 1.306 -17.648 1.339 1.00 23.52 N ATOM 241 CA ALA A 15 0.370 -18.721 1.711 1.00 35.20 C ATOM 242 C ALA A 15 -1.026 -18.512 1.101 1.00 41.15 C ATOM 243 O ALA A 15 -1.487 -19.312 0.284 1.00 41.21 O ATOM 244 CB ALA A 15 0.275 -18.819 3.230 1.00 14.04 C ATOM 0 H ALA A 15 1.140 -16.764 1.819 1.00 23.52 H new ATOM 0 HA ALA A 15 0.760 -19.655 1.307 1.00 35.20 H new ATOM 0 HB1 ALA A 15 -0.419 -19.615 3.501 1.00 14.04 H new ATOM 0 HB2 ALA A 15 1.259 -19.040 3.643 1.00 14.04 H new ATOM 0 HB3 ALA A 15 -0.083 -17.872 3.634 1.00 14.04 H new ATOM 250 N ASP A 16 -1.690 -17.431 1.506 1.00 2.03 N ATOM 251 CA ASP A 16 -3.050 -17.119 1.043 1.00 55.22 C ATOM 252 C ASP A 16 -3.067 -16.788 -0.466 1.00 50.42 C ATOM 253 O ASP A 16 -3.570 -17.566 -1.284 1.00 34.22 O ATOM 254 CB ASP A 16 -3.596 -15.941 1.872 1.00 20.42 C ATOM 255 CG ASP A 16 -5.027 -15.568 1.523 1.00 62.14 C ATOM 256 OD1 ASP A 16 -5.243 -15.005 0.440 1.00 24.41 O ATOM 257 OD2 ASP A 16 -5.937 -15.814 2.347 1.00 25.51 O ATOM 0 H ASP A 16 -1.308 -16.748 2.160 1.00 2.03 H new ATOM 0 HA ASP A 16 -3.687 -17.992 1.184 1.00 55.22 H new ATOM 0 HB2 ASP A 16 -3.543 -16.196 2.930 1.00 20.42 H new ATOM 0 HB3 ASP A 16 -2.955 -15.072 1.721 1.00 20.42 H new ATOM 262 N SER A 17 -2.533 -15.616 -0.813 1.00 33.12 N ATOM 263 CA SER A 17 -2.360 -15.176 -2.208 1.00 60.42 C ATOM 264 C SER A 17 -3.671 -14.762 -2.896 1.00 54.24 C ATOM 265 O SER A 17 -3.640 -14.011 -3.868 1.00 35.22 O ATOM 266 CB SER A 17 -1.641 -16.243 -3.050 1.00 42.15 C ATOM 267 OG SER A 17 -0.301 -16.427 -2.617 1.00 45.43 O ATOM 0 H SER A 17 -2.203 -14.934 -0.130 1.00 33.12 H new ATOM 0 HA SER A 17 -1.739 -14.282 -2.149 1.00 60.42 H new ATOM 0 HB2 SER A 17 -2.180 -17.188 -2.981 1.00 42.15 H new ATOM 0 HB3 SER A 17 -1.649 -15.947 -4.099 1.00 42.15 H new ATOM 0 HG SER A 17 0.130 -17.112 -3.170 1.00 45.43 H new ATOM 273 N THR A 18 -4.817 -15.240 -2.414 1.00 5.44 N ATOM 274 CA THR A 18 -6.112 -14.833 -2.993 1.00 30.04 C ATOM 275 C THR A 18 -6.566 -13.485 -2.417 1.00 43.35 C ATOM 276 O THR A 18 -7.496 -12.851 -2.919 1.00 70.43 O ATOM 277 CB THR A 18 -7.220 -15.896 -2.780 1.00 42.25 C ATOM 278 OG1 THR A 18 -8.457 -15.453 -3.368 1.00 12.24 O ATOM 279 CG2 THR A 18 -7.441 -16.198 -1.302 1.00 2.34 C ATOM 0 H THR A 18 -4.884 -15.898 -1.638 1.00 5.44 H new ATOM 0 HA THR A 18 -5.954 -14.734 -4.067 1.00 30.04 H new ATOM 0 HB THR A 18 -6.887 -16.812 -3.268 1.00 42.25 H new ATOM 0 HG1 THR A 18 -8.416 -14.487 -3.527 1.00 12.24 H new ATOM 0 HG21 THR A 18 -8.225 -16.948 -1.197 1.00 2.34 H new ATOM 0 HG22 THR A 18 -6.517 -16.577 -0.866 1.00 2.34 H new ATOM 0 HG23 THR A 18 -7.739 -15.286 -0.785 1.00 2.34 H new ATOM 287 N ARG A 19 -5.896 -13.061 -1.351 1.00 20.21 N ATOM 288 CA ARG A 19 -6.070 -11.724 -0.790 1.00 40.32 C ATOM 289 C ARG A 19 -4.697 -11.044 -0.670 1.00 22.32 C ATOM 290 O ARG A 19 -3.687 -11.705 -0.411 1.00 24.20 O ATOM 291 CB ARG A 19 -6.767 -11.790 0.584 1.00 55.32 C ATOM 292 CG ARG A 19 -5.833 -12.038 1.768 1.00 1.53 C ATOM 293 CD ARG A 19 -6.609 -12.280 3.059 1.00 34.23 C ATOM 294 NE ARG A 19 -5.790 -12.069 4.251 1.00 70.21 N ATOM 295 CZ ARG A 19 -5.253 -13.021 4.968 1.00 3.14 C ATOM 296 NH1 ARG A 19 -5.318 -14.261 4.593 1.00 64.04 N ATOM 297 NH2 ARG A 19 -4.627 -12.716 6.055 1.00 3.10 N ATOM 0 H ARG A 19 -5.216 -13.634 -0.851 1.00 20.21 H new ATOM 0 HA ARG A 19 -6.706 -11.139 -1.454 1.00 40.32 H new ATOM 0 HB2 ARG A 19 -7.300 -10.854 0.750 1.00 55.32 H new ATOM 0 HB3 ARG A 19 -7.515 -12.582 0.558 1.00 55.32 H new ATOM 0 HG2 ARG A 19 -5.200 -12.900 1.557 1.00 1.53 H new ATOM 0 HG3 ARG A 19 -5.172 -11.181 1.896 1.00 1.53 H new ATOM 0 HD2 ARG A 19 -7.471 -11.614 3.092 1.00 34.23 H new ATOM 0 HD3 ARG A 19 -6.994 -13.300 3.062 1.00 34.23 H new ATOM 0 HE ARG A 19 -5.625 -11.106 4.546 1.00 70.21 H new ATOM 0 HH11 ARG A 19 -5.794 -14.507 3.725 1.00 64.04 H new ATOM 0 HH12 ARG A 19 -4.893 -14.990 5.166 1.00 64.04 H new ATOM 0 HH21 ARG A 19 -4.556 -11.741 6.346 1.00 3.10 H new ATOM 0 HH22 ARG A 19 -4.204 -13.450 6.623 1.00 3.10 H new ATOM 311 N LEU A 20 -4.651 -9.736 -0.876 1.00 24.24 N ATOM 312 CA LEU A 20 -3.380 -9.004 -0.855 1.00 74.24 C ATOM 313 C LEU A 20 -3.370 -7.926 0.242 1.00 70.21 C ATOM 314 O LEU A 20 -2.509 -7.049 0.256 1.00 32.34 O ATOM 315 CB LEU A 20 -3.093 -8.386 -2.237 1.00 61.44 C ATOM 316 CG LEU A 20 -2.884 -9.399 -3.390 1.00 43.31 C ATOM 317 CD1 LEU A 20 -4.214 -9.950 -3.908 1.00 22.24 C ATOM 318 CD2 LEU A 20 -2.075 -8.776 -4.524 1.00 3.21 C ATOM 0 H LEU A 20 -5.470 -9.157 -1.059 1.00 24.24 H new ATOM 0 HA LEU A 20 -2.587 -9.714 -0.622 1.00 74.24 H new ATOM 0 HB2 LEU A 20 -3.921 -7.728 -2.500 1.00 61.44 H new ATOM 0 HB3 LEU A 20 -2.203 -7.762 -2.159 1.00 61.44 H new ATOM 0 HG LEU A 20 -2.317 -10.238 -2.987 1.00 43.31 H new ATOM 0 HD11 LEU A 20 -4.025 -10.657 -4.716 1.00 22.24 H new ATOM 0 HD12 LEU A 20 -4.738 -10.457 -3.098 1.00 22.24 H new ATOM 0 HD13 LEU A 20 -4.828 -9.129 -4.280 1.00 22.24 H new ATOM 0 HD21 LEU A 20 -1.942 -9.508 -5.321 1.00 3.21 H new ATOM 0 HD22 LEU A 20 -2.605 -7.907 -4.914 1.00 3.21 H new ATOM 0 HD23 LEU A 20 -1.099 -8.468 -4.148 1.00 3.21 H new ATOM 330 N VAL A 21 -4.324 -8.007 1.170 1.00 71.24 N ATOM 331 CA VAL A 21 -4.420 -7.048 2.279 1.00 54.42 C ATOM 332 C VAL A 21 -4.121 -7.704 3.638 1.00 65.30 C ATOM 333 O VAL A 21 -4.771 -8.678 4.029 1.00 24.10 O ATOM 334 CB VAL A 21 -5.828 -6.403 2.339 1.00 4.34 C ATOM 335 CG1 VAL A 21 -5.924 -5.400 3.486 1.00 41.31 C ATOM 336 CG2 VAL A 21 -6.176 -5.744 1.007 1.00 74.01 C ATOM 0 H VAL A 21 -5.045 -8.728 1.178 1.00 71.24 H new ATOM 0 HA VAL A 21 -3.670 -6.281 2.086 1.00 54.42 H new ATOM 0 HB VAL A 21 -6.554 -7.194 2.527 1.00 4.34 H new ATOM 0 HG11 VAL A 21 -6.922 -4.963 3.504 1.00 41.31 H new ATOM 0 HG12 VAL A 21 -5.733 -5.909 4.431 1.00 41.31 H new ATOM 0 HG13 VAL A 21 -5.185 -4.611 3.343 1.00 41.31 H new ATOM 0 HG21 VAL A 21 -7.168 -5.297 1.070 1.00 74.01 H new ATOM 0 HG22 VAL A 21 -5.443 -4.969 0.782 1.00 74.01 H new ATOM 0 HG23 VAL A 21 -6.166 -6.494 0.216 1.00 74.01 H new ATOM 346 N THR A 22 -3.142 -7.159 4.355 1.00 1.53 N ATOM 347 CA THR A 22 -2.799 -7.629 5.706 1.00 60.03 C ATOM 348 C THR A 22 -2.944 -6.496 6.731 1.00 65.11 C ATOM 349 O THR A 22 -2.093 -5.610 6.817 1.00 12.23 O ATOM 350 CB THR A 22 -1.351 -8.186 5.776 1.00 43.20 C ATOM 351 OG1 THR A 22 -1.187 -9.274 4.856 1.00 64.25 O ATOM 352 CG2 THR A 22 -1.010 -8.663 7.186 1.00 32.03 C ATOM 0 H THR A 22 -2.565 -6.385 4.025 1.00 1.53 H new ATOM 0 HA THR A 22 -3.495 -8.434 5.943 1.00 60.03 H new ATOM 0 HB THR A 22 -0.674 -7.375 5.506 1.00 43.20 H new ATOM 0 HG1 THR A 22 -0.269 -9.613 4.911 1.00 64.25 H new ATOM 0 HG21 THR A 22 0.010 -9.047 7.203 1.00 32.03 H new ATOM 0 HG22 THR A 22 -1.095 -7.829 7.883 1.00 32.03 H new ATOM 0 HG23 THR A 22 -1.701 -9.453 7.480 1.00 32.03 H new ATOM 360 N ASP A 23 -4.029 -6.520 7.502 1.00 61.12 N ATOM 361 CA ASP A 23 -4.276 -5.499 8.522 1.00 54.13 C ATOM 362 C ASP A 23 -3.839 -5.982 9.916 1.00 31.51 C ATOM 363 O ASP A 23 -4.514 -6.796 10.546 1.00 23.34 O ATOM 364 CB ASP A 23 -5.760 -5.108 8.519 1.00 24.35 C ATOM 365 CG ASP A 23 -6.121 -4.150 9.643 1.00 31.03 C ATOM 366 OD1 ASP A 23 -5.675 -2.983 9.607 1.00 1.25 O ATOM 367 OD2 ASP A 23 -6.841 -4.565 10.575 1.00 2.54 O ATOM 0 H ASP A 23 -4.753 -7.236 7.441 1.00 61.12 H new ATOM 0 HA ASP A 23 -3.678 -4.620 8.281 1.00 54.13 H new ATOM 0 HB2 ASP A 23 -6.007 -4.648 7.562 1.00 24.35 H new ATOM 0 HB3 ASP A 23 -6.368 -6.008 8.606 1.00 24.35 H new ATOM 372 N GLU A 24 -2.693 -5.483 10.383 1.00 52.52 N ATOM 373 CA GLU A 24 -2.180 -5.821 11.719 1.00 15.53 C ATOM 374 C GLU A 24 -2.238 -4.615 12.670 1.00 55.14 C ATOM 375 O GLU A 24 -2.343 -4.780 13.887 1.00 35.44 O ATOM 376 CB GLU A 24 -0.746 -6.368 11.619 1.00 62.21 C ATOM 377 CG GLU A 24 -0.666 -7.801 11.084 1.00 14.10 C ATOM 378 CD GLU A 24 -1.108 -8.848 12.107 1.00 22.55 C ATOM 379 OE1 GLU A 24 -2.273 -8.804 12.560 1.00 11.44 O ATOM 380 OE2 GLU A 24 -0.286 -9.715 12.478 1.00 4.24 O ATOM 0 H GLU A 24 -2.099 -4.842 9.857 1.00 52.52 H new ATOM 0 HA GLU A 24 -2.822 -6.596 12.137 1.00 15.53 H new ATOM 0 HB2 GLU A 24 -0.163 -5.715 10.970 1.00 62.21 H new ATOM 0 HB3 GLU A 24 -0.284 -6.332 12.606 1.00 62.21 H new ATOM 0 HG2 GLU A 24 -1.289 -7.886 10.194 1.00 14.10 H new ATOM 0 HG3 GLU A 24 0.358 -8.011 10.777 1.00 14.10 H new ATOM 387 N ALA A 25 -2.148 -3.407 12.112 1.00 40.44 N ATOM 388 CA ALA A 25 -2.350 -2.178 12.889 1.00 52.52 C ATOM 389 C ALA A 25 -3.786 -2.069 13.433 1.00 32.11 C ATOM 390 O ALA A 25 -4.023 -1.406 14.445 1.00 40.34 O ATOM 391 CB ALA A 25 -2.018 -0.960 12.036 1.00 73.41 C ATOM 0 H ALA A 25 -1.937 -3.251 11.126 1.00 40.44 H new ATOM 0 HA ALA A 25 -1.678 -2.216 13.746 1.00 52.52 H new ATOM 0 HB1 ALA A 25 -2.171 -0.053 12.621 1.00 73.41 H new ATOM 0 HB2 ALA A 25 -0.978 -1.013 11.715 1.00 73.41 H new ATOM 0 HB3 ALA A 25 -2.667 -0.941 11.161 1.00 73.41 H new ATOM 397 N GLY A 26 -4.734 -2.723 12.763 1.00 61.02 N ATOM 398 CA GLY A 26 -6.131 -2.656 13.179 1.00 62.41 C ATOM 399 C GLY A 26 -6.810 -1.369 12.725 1.00 42.42 C ATOM 400 O GLY A 26 -7.536 -0.728 13.492 1.00 34.53 O ATOM 0 H GLY A 26 -4.562 -3.299 11.939 1.00 61.02 H new ATOM 0 HA2 GLY A 26 -6.670 -3.511 12.772 1.00 62.41 H new ATOM 0 HA3 GLY A 26 -6.188 -2.731 14.265 1.00 62.41 H new ATOM 404 N LEU A 27 -6.574 -0.998 11.468 1.00 14.53 N ATOM 405 CA LEU A 27 -7.103 0.250 10.897 1.00 54.52 C ATOM 406 C LEU A 27 -8.089 -0.026 9.749 1.00 52.31 C ATOM 407 O LEU A 27 -8.912 0.822 9.408 1.00 53.05 O ATOM 408 CB LEU A 27 -5.942 1.120 10.389 1.00 33.33 C ATOM 409 CG LEU A 27 -4.899 1.512 11.451 1.00 12.22 C ATOM 410 CD1 LEU A 27 -3.727 2.257 10.815 1.00 42.13 C ATOM 411 CD2 LEU A 27 -5.542 2.358 12.549 1.00 4.23 C ATOM 0 H LEU A 27 -6.014 -1.547 10.816 1.00 14.53 H new ATOM 0 HA LEU A 27 -7.644 0.777 11.683 1.00 54.52 H new ATOM 0 HB2 LEU A 27 -5.435 0.586 9.585 1.00 33.33 H new ATOM 0 HB3 LEU A 27 -6.355 2.031 9.956 1.00 33.33 H new ATOM 0 HG LEU A 27 -4.514 0.597 11.902 1.00 12.22 H new ATOM 0 HD11 LEU A 27 -3.004 2.523 11.586 1.00 42.13 H new ATOM 0 HD12 LEU A 27 -3.248 1.617 10.074 1.00 42.13 H new ATOM 0 HD13 LEU A 27 -4.091 3.163 10.331 1.00 42.13 H new ATOM 0 HD21 LEU A 27 -4.789 2.625 13.290 1.00 4.23 H new ATOM 0 HD22 LEU A 27 -5.959 3.265 12.112 1.00 4.23 H new ATOM 0 HD23 LEU A 27 -6.337 1.788 13.029 1.00 4.23 H new ATOM 423 N LEU A 28 -7.993 -1.212 9.153 1.00 24.33 N ATOM 424 CA LEU A 28 -8.860 -1.592 8.032 1.00 12.43 C ATOM 425 C LEU A 28 -10.061 -2.423 8.505 1.00 30.24 C ATOM 426 O LEU A 28 -9.905 -3.563 8.943 1.00 24.11 O ATOM 427 CB LEU A 28 -8.058 -2.386 6.991 1.00 3.22 C ATOM 428 CG LEU A 28 -6.952 -1.600 6.266 1.00 44.01 C ATOM 429 CD1 LEU A 28 -6.109 -2.528 5.399 1.00 34.43 C ATOM 430 CD2 LEU A 28 -7.558 -0.482 5.421 1.00 11.22 C ATOM 0 H LEU A 28 -7.323 -1.931 9.426 1.00 24.33 H new ATOM 0 HA LEU A 28 -9.239 -0.675 7.580 1.00 12.43 H new ATOM 0 HB2 LEU A 28 -7.604 -3.245 7.486 1.00 3.22 H new ATOM 0 HB3 LEU A 28 -8.750 -2.776 6.245 1.00 3.22 H new ATOM 0 HG LEU A 28 -6.302 -1.152 7.018 1.00 44.01 H new ATOM 0 HD11 LEU A 28 -5.333 -1.951 4.896 1.00 34.43 H new ATOM 0 HD12 LEU A 28 -5.645 -3.290 6.026 1.00 34.43 H new ATOM 0 HD13 LEU A 28 -6.745 -3.008 4.655 1.00 34.43 H new ATOM 0 HD21 LEU A 28 -6.762 0.064 4.915 1.00 11.22 H new ATOM 0 HD22 LEU A 28 -8.232 -0.911 4.679 1.00 11.22 H new ATOM 0 HD23 LEU A 28 -8.114 0.200 6.065 1.00 11.22 H new ATOM 442 N SER A 29 -11.258 -1.847 8.425 1.00 40.11 N ATOM 443 CA SER A 29 -12.490 -2.574 8.767 1.00 23.11 C ATOM 444 C SER A 29 -12.768 -3.698 7.755 1.00 44.12 C ATOM 445 O SER A 29 -12.407 -3.587 6.582 1.00 45.04 O ATOM 446 CB SER A 29 -13.685 -1.614 8.813 1.00 2.42 C ATOM 447 OG SER A 29 -14.895 -2.307 9.084 1.00 14.15 O ATOM 0 H SER A 29 -11.407 -0.883 8.128 1.00 40.11 H new ATOM 0 HA SER A 29 -12.350 -3.020 9.752 1.00 23.11 H new ATOM 0 HB2 SER A 29 -13.517 -0.858 9.580 1.00 2.42 H new ATOM 0 HB3 SER A 29 -13.769 -1.089 7.861 1.00 2.42 H new ATOM 0 HG SER A 29 -15.639 -1.669 9.109 1.00 14.15 H new ATOM 453 N ASN A 30 -13.434 -4.762 8.208 1.00 23.34 N ATOM 454 CA ASN A 30 -13.702 -5.941 7.367 1.00 24.34 C ATOM 455 C ASN A 30 -14.340 -5.563 6.016 1.00 3.41 C ATOM 456 O ASN A 30 -13.958 -6.093 4.966 1.00 23.43 O ATOM 457 CB ASN A 30 -14.591 -6.946 8.120 1.00 30.23 C ATOM 458 CG ASN A 30 -15.897 -6.341 8.610 1.00 20.15 C ATOM 459 OD1 ASN A 30 -15.976 -5.154 8.906 1.00 21.11 O ATOM 460 ND2 ASN A 30 -16.930 -7.153 8.698 1.00 51.32 N ATOM 0 H ASN A 30 -13.801 -4.836 9.157 1.00 23.34 H new ATOM 0 HA ASN A 30 -12.741 -6.407 7.149 1.00 24.34 H new ATOM 0 HB2 ASN A 30 -14.812 -7.788 7.464 1.00 30.23 H new ATOM 0 HB3 ASN A 30 -14.039 -7.342 8.973 1.00 30.23 H new ATOM 0 HD21 ASN A 30 -17.831 -6.799 9.021 1.00 51.32 H new ATOM 0 HD22 ASN A 30 -16.829 -8.136 8.444 1.00 51.32 H new ATOM 467 N ALA A 31 -15.298 -4.638 6.046 1.00 61.51 N ATOM 468 CA ALA A 31 -15.955 -4.163 4.821 1.00 12.54 C ATOM 469 C ALA A 31 -14.966 -3.435 3.896 1.00 62.40 C ATOM 470 O ALA A 31 -14.997 -3.600 2.673 1.00 61.42 O ATOM 471 CB ALA A 31 -17.128 -3.252 5.171 1.00 23.51 C ATOM 0 H ALA A 31 -15.639 -4.201 6.902 1.00 61.51 H new ATOM 0 HA ALA A 31 -16.330 -5.034 4.283 1.00 12.54 H new ATOM 0 HB1 ALA A 31 -17.607 -2.907 4.255 1.00 23.51 H new ATOM 0 HB2 ALA A 31 -17.851 -3.804 5.772 1.00 23.51 H new ATOM 0 HB3 ALA A 31 -16.766 -2.394 5.737 1.00 23.51 H new ATOM 477 N GLN A 32 -14.078 -2.636 4.487 1.00 14.31 N ATOM 478 CA GLN A 32 -13.060 -1.909 3.721 1.00 34.42 C ATOM 479 C GLN A 32 -12.045 -2.883 3.100 1.00 11.21 C ATOM 480 O GLN A 32 -11.622 -2.711 1.953 1.00 24.14 O ATOM 481 CB GLN A 32 -12.340 -0.892 4.619 1.00 63.35 C ATOM 482 CG GLN A 32 -13.281 0.101 5.295 1.00 73.34 C ATOM 483 CD GLN A 32 -12.549 1.116 6.162 1.00 23.05 C ATOM 484 OE1 GLN A 32 -12.294 0.882 7.338 1.00 62.31 O ATOM 485 NE2 GLN A 32 -12.217 2.259 5.595 1.00 71.11 N ATOM 0 H GLN A 32 -14.041 -2.474 5.493 1.00 14.31 H new ATOM 0 HA GLN A 32 -13.559 -1.373 2.914 1.00 34.42 H new ATOM 0 HB2 GLN A 32 -11.781 -1.429 5.385 1.00 63.35 H new ATOM 0 HB3 GLN A 32 -11.614 -0.342 4.021 1.00 63.35 H new ATOM 0 HG2 GLN A 32 -13.853 0.628 4.532 1.00 73.34 H new ATOM 0 HG3 GLN A 32 -13.997 -0.445 5.910 1.00 73.34 H new ATOM 0 HE21 GLN A 32 -12.442 2.426 4.614 1.00 71.11 H new ATOM 0 HE22 GLN A 32 -11.735 2.976 6.137 1.00 71.11 H new ATOM 494 N GLU A 33 -11.669 -3.912 3.863 1.00 24.22 N ATOM 495 CA GLU A 33 -10.744 -4.943 3.378 1.00 11.44 C ATOM 496 C GLU A 33 -11.340 -5.723 2.199 1.00 23.40 C ATOM 497 O GLU A 33 -10.647 -6.009 1.227 1.00 20.21 O ATOM 498 CB GLU A 33 -10.374 -5.918 4.504 1.00 54.41 C ATOM 499 CG GLU A 33 -9.591 -5.278 5.643 1.00 35.13 C ATOM 500 CD GLU A 33 -9.095 -6.298 6.656 1.00 41.24 C ATOM 501 OE1 GLU A 33 -8.040 -6.919 6.410 1.00 3.35 O ATOM 502 OE2 GLU A 33 -9.768 -6.504 7.689 1.00 24.43 O ATOM 0 H GLU A 33 -11.990 -4.055 4.820 1.00 24.22 H new ATOM 0 HA GLU A 33 -9.844 -4.432 3.036 1.00 11.44 H new ATOM 0 HB2 GLU A 33 -11.287 -6.357 4.906 1.00 54.41 H new ATOM 0 HB3 GLU A 33 -9.785 -6.734 4.085 1.00 54.41 H new ATOM 0 HG2 GLU A 33 -8.740 -4.734 5.233 1.00 35.13 H new ATOM 0 HG3 GLU A 33 -10.223 -4.547 6.148 1.00 35.13 H new ATOM 509 N GLU A 34 -12.625 -6.071 2.292 1.00 71.14 N ATOM 510 CA GLU A 34 -13.311 -6.796 1.211 1.00 31.32 C ATOM 511 C GLU A 34 -13.188 -6.043 -0.127 1.00 74.42 C ATOM 512 O GLU A 34 -12.736 -6.601 -1.132 1.00 44.13 O ATOM 513 CB GLU A 34 -14.793 -7.003 1.568 1.00 62.32 C ATOM 514 CG GLU A 34 -15.600 -7.743 0.499 1.00 30.31 C ATOM 515 CD GLU A 34 -15.160 -9.189 0.302 1.00 74.32 C ATOM 516 OE1 GLU A 34 -14.232 -9.434 -0.497 1.00 15.40 O ATOM 517 OE2 GLU A 34 -15.755 -10.091 0.930 1.00 32.44 O ATOM 0 H GLU A 34 -13.213 -5.865 3.100 1.00 71.14 H new ATOM 0 HA GLU A 34 -12.832 -7.769 1.098 1.00 31.32 H new ATOM 0 HB2 GLU A 34 -14.855 -7.559 2.503 1.00 62.32 H new ATOM 0 HB3 GLU A 34 -15.252 -6.030 1.744 1.00 62.32 H new ATOM 0 HG2 GLU A 34 -16.655 -7.726 0.774 1.00 30.31 H new ATOM 0 HG3 GLU A 34 -15.509 -7.211 -0.448 1.00 30.31 H new ATOM 524 N VAL A 35 -13.577 -4.770 -0.126 1.00 12.23 N ATOM 525 CA VAL A 35 -13.482 -3.925 -1.324 1.00 73.14 C ATOM 526 C VAL A 35 -12.024 -3.765 -1.792 1.00 14.34 C ATOM 527 O VAL A 35 -11.726 -3.879 -2.985 1.00 60.25 O ATOM 528 CB VAL A 35 -14.087 -2.521 -1.070 1.00 65.12 C ATOM 529 CG1 VAL A 35 -14.028 -1.661 -2.334 1.00 15.13 C ATOM 530 CG2 VAL A 35 -15.523 -2.636 -0.558 1.00 64.23 C ATOM 0 H VAL A 35 -13.962 -4.296 0.691 1.00 12.23 H new ATOM 0 HA VAL A 35 -14.051 -4.428 -2.106 1.00 73.14 H new ATOM 0 HB VAL A 35 -13.489 -2.030 -0.302 1.00 65.12 H new ATOM 0 HG11 VAL A 35 -14.459 -0.681 -2.128 1.00 15.13 H new ATOM 0 HG12 VAL A 35 -12.990 -1.543 -2.645 1.00 15.13 H new ATOM 0 HG13 VAL A 35 -14.593 -2.146 -3.130 1.00 15.13 H new ATOM 0 HG21 VAL A 35 -15.929 -1.639 -0.386 1.00 64.23 H new ATOM 0 HG22 VAL A 35 -16.133 -3.153 -1.298 1.00 64.23 H new ATOM 0 HG23 VAL A 35 -15.532 -3.198 0.376 1.00 64.23 H new ATOM 540 N MET A 36 -11.118 -3.501 -0.848 1.00 23.22 N ATOM 541 CA MET A 36 -9.698 -3.307 -1.172 1.00 32.35 C ATOM 542 C MET A 36 -9.090 -4.564 -1.815 1.00 10.45 C ATOM 543 O MET A 36 -8.422 -4.480 -2.847 1.00 23.22 O ATOM 544 CB MET A 36 -8.906 -2.913 0.083 1.00 45.15 C ATOM 545 CG MET A 36 -7.443 -2.574 -0.192 1.00 31.23 C ATOM 546 SD MET A 36 -6.576 -1.986 1.277 1.00 40.15 S ATOM 547 CE MET A 36 -7.465 -0.469 1.621 1.00 42.34 C ATOM 0 H MET A 36 -11.339 -3.416 0.144 1.00 23.22 H new ATOM 0 HA MET A 36 -9.634 -2.496 -1.897 1.00 32.35 H new ATOM 0 HB2 MET A 36 -9.387 -2.053 0.549 1.00 45.15 H new ATOM 0 HB3 MET A 36 -8.951 -3.732 0.801 1.00 45.15 H new ATOM 0 HG2 MET A 36 -6.936 -3.458 -0.578 1.00 31.23 H new ATOM 0 HG3 MET A 36 -7.391 -1.811 -0.969 1.00 31.23 H new ATOM 0 HE1 MET A 36 -6.774 0.276 2.016 1.00 42.34 H new ATOM 0 HE2 MET A 36 -7.916 -0.095 0.702 1.00 42.34 H new ATOM 0 HE3 MET A 36 -8.247 -0.664 2.355 1.00 42.34 H new ATOM 557 N ASN A 37 -9.331 -5.733 -1.208 1.00 2.32 N ATOM 558 CA ASN A 37 -8.874 -7.005 -1.786 1.00 45.11 C ATOM 559 C ASN A 37 -9.489 -7.231 -3.172 1.00 54.45 C ATOM 560 O ASN A 37 -8.831 -7.744 -4.073 1.00 63.52 O ATOM 561 CB ASN A 37 -9.205 -8.199 -0.875 1.00 4.43 C ATOM 562 CG ASN A 37 -8.270 -8.307 0.317 1.00 25.21 C ATOM 563 OD1 ASN A 37 -7.148 -8.786 0.195 1.00 13.34 O ATOM 564 ND2 ASN A 37 -8.728 -7.896 1.481 1.00 10.54 N ATOM 0 H ASN A 37 -9.835 -5.826 -0.326 1.00 2.32 H new ATOM 0 HA ASN A 37 -7.790 -6.937 -1.881 1.00 45.11 H new ATOM 0 HB2 ASN A 37 -10.231 -8.105 -0.519 1.00 4.43 H new ATOM 0 HB3 ASN A 37 -9.153 -9.119 -1.457 1.00 4.43 H new ATOM 0 HD21 ASN A 37 -8.145 -7.972 2.314 1.00 10.54 H new ATOM 0 HD22 ASN A 37 -9.666 -7.502 1.550 1.00 10.54 H new ATOM 571 N GLY A 38 -10.753 -6.842 -3.335 1.00 0.21 N ATOM 572 CA GLY A 38 -11.411 -6.954 -4.634 1.00 71.31 C ATOM 573 C GLY A 38 -10.711 -6.147 -5.726 1.00 73.14 C ATOM 574 O GLY A 38 -10.609 -6.596 -6.871 1.00 52.21 O ATOM 0 H GLY A 38 -11.335 -6.452 -2.594 1.00 0.21 H new ATOM 0 HA2 GLY A 38 -11.445 -8.003 -4.929 1.00 71.31 H new ATOM 0 HA3 GLY A 38 -12.443 -6.615 -4.543 1.00 71.31 H new ATOM 578 N ARG A 39 -10.235 -4.949 -5.375 1.00 13.23 N ATOM 579 CA ARG A 39 -9.432 -4.138 -6.298 1.00 53.22 C ATOM 580 C ARG A 39 -8.106 -4.843 -6.636 1.00 25.52 C ATOM 581 O ARG A 39 -7.801 -5.094 -7.801 1.00 61.14 O ATOM 582 CB ARG A 39 -9.128 -2.755 -5.687 1.00 62.12 C ATOM 583 CG ARG A 39 -10.343 -1.837 -5.531 1.00 32.45 C ATOM 584 CD ARG A 39 -9.947 -0.486 -4.926 1.00 54.10 C ATOM 585 NE ARG A 39 -11.043 0.487 -4.937 1.00 31.11 N ATOM 586 CZ ARG A 39 -11.011 1.636 -4.306 1.00 1.31 C ATOM 587 NH1 ARG A 39 -9.988 1.967 -3.584 1.00 4.14 N ATOM 588 NH2 ARG A 39 -12.001 2.461 -4.410 1.00 65.13 N ATOM 0 H ARG A 39 -10.390 -4.520 -4.463 1.00 13.23 H new ATOM 0 HA ARG A 39 -10.012 -4.009 -7.212 1.00 53.22 H new ATOM 0 HB2 ARG A 39 -8.672 -2.899 -4.708 1.00 62.12 H new ATOM 0 HB3 ARG A 39 -8.389 -2.253 -6.312 1.00 62.12 H new ATOM 0 HG2 ARG A 39 -10.810 -1.679 -6.503 1.00 32.45 H new ATOM 0 HG3 ARG A 39 -11.086 -2.319 -4.895 1.00 32.45 H new ATOM 0 HD2 ARG A 39 -9.612 -0.637 -3.900 1.00 54.10 H new ATOM 0 HD3 ARG A 39 -9.101 -0.079 -5.480 1.00 54.10 H new ATOM 0 HE ARG A 39 -11.883 0.256 -5.468 1.00 31.11 H new ATOM 0 HH11 ARG A 39 -9.195 1.331 -3.501 1.00 4.14 H new ATOM 0 HH12 ARG A 39 -9.975 2.864 -3.098 1.00 4.14 H new ATOM 0 HH21 ARG A 39 -12.809 2.219 -4.984 1.00 65.13 H new ATOM 0 HH22 ARG A 39 -11.974 3.354 -3.918 1.00 65.13 H new ATOM 602 N LEU A 40 -7.342 -5.186 -5.597 1.00 11.03 N ATOM 603 CA LEU A 40 -6.007 -5.787 -5.760 1.00 54.32 C ATOM 604 C LEU A 40 -6.057 -7.115 -6.534 1.00 31.21 C ATOM 605 O LEU A 40 -5.304 -7.324 -7.490 1.00 52.14 O ATOM 606 CB LEU A 40 -5.374 -6.011 -4.377 1.00 12.25 C ATOM 607 CG LEU A 40 -5.272 -4.757 -3.494 1.00 62.43 C ATOM 608 CD1 LEU A 40 -4.642 -5.089 -2.145 1.00 2.52 C ATOM 609 CD2 LEU A 40 -4.484 -3.662 -4.205 1.00 55.11 C ATOM 0 H LEU A 40 -7.624 -5.058 -4.625 1.00 11.03 H new ATOM 0 HA LEU A 40 -5.400 -5.095 -6.344 1.00 54.32 H new ATOM 0 HB2 LEU A 40 -5.957 -6.764 -3.846 1.00 12.25 H new ATOM 0 HB3 LEU A 40 -4.374 -6.421 -4.515 1.00 12.25 H new ATOM 0 HG LEU A 40 -6.281 -4.388 -3.311 1.00 62.43 H new ATOM 0 HD11 LEU A 40 -4.581 -4.185 -1.539 1.00 2.52 H new ATOM 0 HD12 LEU A 40 -5.254 -5.830 -1.630 1.00 2.52 H new ATOM 0 HD13 LEU A 40 -3.640 -5.490 -2.300 1.00 2.52 H new ATOM 0 HD21 LEU A 40 -4.423 -2.783 -3.564 1.00 55.11 H new ATOM 0 HD22 LEU A 40 -3.479 -4.021 -4.425 1.00 55.11 H new ATOM 0 HD23 LEU A 40 -4.986 -3.398 -5.136 1.00 55.11 H new ATOM 621 N ARG A 41 -6.948 -8.007 -6.112 1.00 0.32 N ATOM 622 CA ARG A 41 -7.114 -9.314 -6.754 1.00 23.22 C ATOM 623 C ARG A 41 -7.461 -9.159 -8.243 1.00 35.23 C ATOM 624 O ARG A 41 -6.953 -9.896 -9.095 1.00 65.14 O ATOM 625 CB ARG A 41 -8.203 -10.115 -6.023 1.00 12.31 C ATOM 626 CG ARG A 41 -8.361 -11.555 -6.516 1.00 44.33 C ATOM 627 CD ARG A 41 -9.151 -12.405 -5.526 1.00 54.22 C ATOM 628 NE ARG A 41 -10.435 -11.802 -5.175 1.00 64.14 N ATOM 629 CZ ARG A 41 -10.820 -11.536 -3.953 1.00 41.21 C ATOM 630 NH1 ARG A 41 -10.046 -11.767 -2.944 1.00 64.44 N ATOM 631 NH2 ARG A 41 -11.987 -11.027 -3.746 1.00 5.14 N ATOM 0 H ARG A 41 -7.573 -7.850 -5.321 1.00 0.32 H new ATOM 0 HA ARG A 41 -6.170 -9.856 -6.691 1.00 23.22 H new ATOM 0 HB2 ARG A 41 -7.973 -10.131 -4.958 1.00 12.31 H new ATOM 0 HB3 ARG A 41 -9.156 -9.598 -6.136 1.00 12.31 H new ATOM 0 HG2 ARG A 41 -8.867 -11.556 -7.482 1.00 44.33 H new ATOM 0 HG3 ARG A 41 -7.377 -11.997 -6.671 1.00 44.33 H new ATOM 0 HD2 ARG A 41 -9.321 -13.393 -5.954 1.00 54.22 H new ATOM 0 HD3 ARG A 41 -8.560 -12.548 -4.621 1.00 54.22 H new ATOM 0 HE ARG A 41 -11.075 -11.573 -5.935 1.00 64.14 H new ATOM 0 HH11 ARG A 41 -9.118 -12.163 -3.093 1.00 64.44 H new ATOM 0 HH12 ARG A 41 -10.363 -11.553 -1.998 1.00 64.44 H new ATOM 0 HH21 ARG A 41 -12.606 -10.833 -4.533 1.00 5.14 H new ATOM 0 HH22 ARG A 41 -12.291 -10.818 -2.795 1.00 5.14 H new ATOM 645 N ALA A 42 -8.318 -8.183 -8.549 1.00 32.14 N ATOM 646 CA ALA A 42 -8.688 -7.875 -9.932 1.00 41.14 C ATOM 647 C ALA A 42 -7.490 -7.335 -10.726 1.00 34.53 C ATOM 648 O ALA A 42 -7.272 -7.722 -11.874 1.00 74.03 O ATOM 649 CB ALA A 42 -9.843 -6.877 -9.960 1.00 51.43 C ATOM 0 H ALA A 42 -8.771 -7.590 -7.854 1.00 32.14 H new ATOM 0 HA ALA A 42 -9.010 -8.801 -10.408 1.00 41.14 H new ATOM 0 HB1 ALA A 42 -10.108 -6.656 -10.994 1.00 51.43 H new ATOM 0 HB2 ALA A 42 -10.705 -7.304 -9.447 1.00 51.43 H new ATOM 0 HB3 ALA A 42 -9.541 -5.957 -9.459 1.00 51.43 H new ATOM 655 N ILE A 43 -6.708 -6.452 -10.103 1.00 50.30 N ATOM 656 CA ILE A 43 -5.516 -5.883 -10.747 1.00 22.15 C ATOM 657 C ILE A 43 -4.521 -6.978 -11.166 1.00 72.52 C ATOM 658 O ILE A 43 -4.053 -7.001 -12.304 1.00 5.24 O ATOM 659 CB ILE A 43 -4.790 -4.874 -9.816 1.00 73.12 C ATOM 660 CG1 ILE A 43 -5.705 -3.679 -9.493 1.00 32.54 C ATOM 661 CG2 ILE A 43 -3.483 -4.393 -10.451 1.00 15.11 C ATOM 662 CD1 ILE A 43 -5.107 -2.700 -8.501 1.00 21.11 C ATOM 0 H ILE A 43 -6.875 -6.114 -9.155 1.00 50.30 H new ATOM 0 HA ILE A 43 -5.869 -5.361 -11.636 1.00 22.15 H new ATOM 0 HB ILE A 43 -4.549 -5.385 -8.884 1.00 73.12 H new ATOM 0 HG12 ILE A 43 -5.935 -3.150 -10.418 1.00 32.54 H new ATOM 0 HG13 ILE A 43 -6.649 -4.053 -9.096 1.00 32.54 H new ATOM 0 HG21 ILE A 43 -2.991 -3.687 -9.782 1.00 15.11 H new ATOM 0 HG22 ILE A 43 -2.827 -5.246 -10.624 1.00 15.11 H new ATOM 0 HG23 ILE A 43 -3.699 -3.903 -11.400 1.00 15.11 H new ATOM 0 HD11 ILE A 43 -5.810 -1.886 -8.324 1.00 21.11 H new ATOM 0 HD12 ILE A 43 -4.902 -3.213 -7.561 1.00 21.11 H new ATOM 0 HD13 ILE A 43 -4.178 -2.296 -8.903 1.00 21.11 H new ATOM 674 N ARG A 44 -4.199 -7.887 -10.250 1.00 63.23 N ATOM 675 CA ARG A 44 -3.253 -8.967 -10.551 1.00 22.14 C ATOM 676 C ARG A 44 -3.849 -9.979 -11.546 1.00 62.13 C ATOM 677 O ARG A 44 -3.119 -10.640 -12.279 1.00 51.21 O ATOM 678 CB ARG A 44 -2.812 -9.686 -9.271 1.00 41.22 C ATOM 679 CG ARG A 44 -1.652 -10.657 -9.492 1.00 50.03 C ATOM 680 CD ARG A 44 -1.337 -11.458 -8.239 1.00 2.31 C ATOM 681 NE ARG A 44 -2.477 -12.265 -7.819 1.00 74.04 N ATOM 682 CZ ARG A 44 -2.530 -12.937 -6.710 1.00 14.03 C ATOM 683 NH1 ARG A 44 -1.519 -12.957 -5.904 1.00 23.42 N ATOM 684 NH2 ARG A 44 -3.595 -13.604 -6.420 1.00 42.52 N ATOM 0 H ARG A 44 -4.573 -7.902 -9.301 1.00 63.23 H new ATOM 0 HA ARG A 44 -2.379 -8.509 -11.013 1.00 22.14 H new ATOM 0 HB2 ARG A 44 -2.519 -8.944 -8.528 1.00 41.22 H new ATOM 0 HB3 ARG A 44 -3.660 -10.232 -8.859 1.00 41.22 H new ATOM 0 HG2 ARG A 44 -1.899 -11.338 -10.306 1.00 50.03 H new ATOM 0 HG3 ARG A 44 -0.766 -10.101 -9.800 1.00 50.03 H new ATOM 0 HD2 ARG A 44 -0.481 -12.106 -8.426 1.00 2.31 H new ATOM 0 HD3 ARG A 44 -1.054 -10.780 -7.434 1.00 2.31 H new ATOM 0 HE ARG A 44 -3.287 -12.304 -8.438 1.00 74.04 H new ATOM 0 HH11 ARG A 44 -0.670 -12.442 -6.138 1.00 23.42 H new ATOM 0 HH12 ARG A 44 -1.570 -13.488 -5.035 1.00 23.42 H new ATOM 0 HH21 ARG A 44 -4.389 -13.601 -7.061 1.00 42.52 H new ATOM 0 HH22 ARG A 44 -3.644 -14.134 -5.550 1.00 42.52 H new ATOM 698 N SER A 45 -5.173 -10.100 -11.566 1.00 41.14 N ATOM 699 CA SER A 45 -5.849 -11.006 -12.509 1.00 61.24 C ATOM 700 C SER A 45 -6.010 -10.351 -13.883 1.00 2.03 C ATOM 701 O SER A 45 -6.170 -11.034 -14.892 1.00 54.52 O ATOM 702 CB SER A 45 -7.228 -11.417 -11.973 1.00 43.15 C ATOM 703 OG SER A 45 -7.910 -12.288 -12.874 1.00 22.21 O ATOM 0 H SER A 45 -5.802 -9.589 -10.947 1.00 41.14 H new ATOM 0 HA SER A 45 -5.226 -11.894 -12.614 1.00 61.24 H new ATOM 0 HB2 SER A 45 -7.110 -11.912 -11.009 1.00 43.15 H new ATOM 0 HB3 SER A 45 -7.832 -10.526 -11.802 1.00 43.15 H new ATOM 0 HG SER A 45 -8.782 -12.529 -12.498 1.00 22.21 H new ATOM 709 N SER A 46 -5.981 -9.022 -13.905 1.00 72.32 N ATOM 710 CA SER A 46 -6.143 -8.251 -15.144 1.00 11.35 C ATOM 711 C SER A 46 -4.800 -7.719 -15.658 1.00 32.43 C ATOM 712 O SER A 46 -4.321 -8.121 -16.714 1.00 11.13 O ATOM 713 CB SER A 46 -7.103 -7.075 -14.910 1.00 11.41 C ATOM 714 OG SER A 46 -8.368 -7.524 -14.446 1.00 61.22 O ATOM 0 H SER A 46 -5.846 -8.448 -13.073 1.00 72.32 H new ATOM 0 HA SER A 46 -6.555 -8.921 -15.898 1.00 11.35 H new ATOM 0 HB2 SER A 46 -6.670 -6.389 -14.183 1.00 11.41 H new ATOM 0 HB3 SER A 46 -7.231 -6.517 -15.838 1.00 11.41 H new ATOM 0 HG SER A 46 -8.319 -7.702 -13.484 1.00 61.22 H new ATOM 720 N HIS A 47 -4.194 -6.809 -14.895 1.00 71.10 N ATOM 721 CA HIS A 47 -2.916 -6.188 -15.274 1.00 2.34 C ATOM 722 C HIS A 47 -1.710 -7.054 -14.866 1.00 41.12 C ATOM 723 O HIS A 47 -0.572 -6.760 -15.240 1.00 64.42 O ATOM 724 CB HIS A 47 -2.799 -4.805 -14.622 1.00 41.14 C ATOM 725 CG HIS A 47 -3.884 -3.854 -15.030 1.00 50.41 C ATOM 726 ND1 HIS A 47 -3.716 -2.995 -16.081 1.00 43.02 N ATOM 727 CD2 HIS A 47 -5.123 -3.673 -14.508 1.00 33.53 C ATOM 728 CE1 HIS A 47 -4.839 -2.316 -16.183 1.00 34.05 C ATOM 729 NE2 HIS A 47 -5.725 -2.688 -15.251 1.00 31.41 N ATOM 0 H HIS A 47 -4.567 -6.481 -14.004 1.00 71.10 H new ATOM 0 HA HIS A 47 -2.905 -6.093 -16.360 1.00 2.34 H new ATOM 0 HB2 HIS A 47 -2.818 -4.921 -13.538 1.00 41.14 H new ATOM 0 HB3 HIS A 47 -1.832 -4.372 -14.879 1.00 41.14 H new ATOM 0 HD2 HIS A 47 -5.553 -4.202 -13.670 1.00 33.53 H new ATOM 0 HE1 HIS A 47 -5.023 -1.554 -16.926 1.00 34.05 H new ATOM 0 HE2 HIS A 47 -6.664 -2.313 -15.119 1.00 31.41 H new ATOM 737 N ALA A 48 -1.972 -8.108 -14.088 1.00 43.10 N ATOM 738 CA ALA A 48 -0.924 -9.014 -13.587 1.00 23.13 C ATOM 739 C ALA A 48 -0.006 -8.333 -12.560 1.00 44.14 C ATOM 740 O ALA A 48 1.062 -8.850 -12.232 1.00 71.34 O ATOM 741 CB ALA A 48 -0.105 -9.589 -14.740 1.00 54.22 C ATOM 0 H ALA A 48 -2.913 -8.360 -13.786 1.00 43.10 H new ATOM 0 HA ALA A 48 -1.431 -9.832 -13.075 1.00 23.13 H new ATOM 0 HB1 ALA A 48 0.662 -10.255 -14.345 1.00 54.22 H new ATOM 0 HB2 ALA A 48 -0.760 -10.147 -15.409 1.00 54.22 H new ATOM 0 HB3 ALA A 48 0.368 -8.776 -15.291 1.00 54.22 H new ATOM 747 N VAL A 49 -0.433 -7.187 -12.038 1.00 72.34 N ATOM 748 CA VAL A 49 0.366 -6.436 -11.065 1.00 53.25 C ATOM 749 C VAL A 49 0.125 -6.923 -9.625 1.00 44.02 C ATOM 750 O VAL A 49 -0.996 -6.868 -9.115 1.00 2.43 O ATOM 751 CB VAL A 49 0.074 -4.918 -11.154 1.00 61.35 C ATOM 752 CG1 VAL A 49 0.867 -4.140 -10.104 1.00 2.52 C ATOM 753 CG2 VAL A 49 0.376 -4.399 -12.561 1.00 1.22 C ATOM 0 H VAL A 49 -1.327 -6.755 -12.270 1.00 72.34 H new ATOM 0 HA VAL A 49 1.411 -6.614 -11.317 1.00 53.25 H new ATOM 0 HB VAL A 49 -0.985 -4.763 -10.949 1.00 61.35 H new ATOM 0 HG11 VAL A 49 0.641 -3.077 -10.191 1.00 2.52 H new ATOM 0 HG12 VAL A 49 0.592 -4.489 -9.108 1.00 2.52 H new ATOM 0 HG13 VAL A 49 1.934 -4.298 -10.263 1.00 2.52 H new ATOM 0 HG21 VAL A 49 0.166 -3.330 -12.608 1.00 1.22 H new ATOM 0 HG22 VAL A 49 1.426 -4.573 -12.795 1.00 1.22 H new ATOM 0 HG23 VAL A 49 -0.249 -4.924 -13.284 1.00 1.22 H new ATOM 763 N GLU A 50 1.188 -7.401 -8.983 1.00 4.02 N ATOM 764 CA GLU A 50 1.127 -7.848 -7.590 1.00 74.34 C ATOM 765 C GLU A 50 1.142 -6.638 -6.644 1.00 72.24 C ATOM 766 O GLU A 50 2.200 -6.103 -6.321 1.00 22.05 O ATOM 767 CB GLU A 50 2.320 -8.771 -7.287 1.00 24.14 C ATOM 768 CG GLU A 50 2.445 -9.940 -8.259 1.00 35.42 C ATOM 769 CD GLU A 50 3.707 -10.764 -8.041 1.00 71.20 C ATOM 770 OE1 GLU A 50 4.783 -10.365 -8.535 1.00 13.43 O ATOM 771 OE2 GLU A 50 3.624 -11.821 -7.380 1.00 64.32 O ATOM 0 H GLU A 50 2.111 -7.490 -9.408 1.00 4.02 H new ATOM 0 HA GLU A 50 0.200 -8.401 -7.435 1.00 74.34 H new ATOM 0 HB2 GLU A 50 3.239 -8.185 -7.315 1.00 24.14 H new ATOM 0 HB3 GLU A 50 2.220 -9.160 -6.274 1.00 24.14 H new ATOM 0 HG2 GLU A 50 1.573 -10.586 -8.155 1.00 35.42 H new ATOM 0 HG3 GLU A 50 2.439 -9.558 -9.280 1.00 35.42 H new ATOM 778 N PHE A 51 -0.040 -6.207 -6.218 1.00 21.51 N ATOM 779 CA PHE A 51 -0.177 -5.011 -5.381 1.00 1.31 C ATOM 780 C PHE A 51 -0.731 -5.378 -3.994 1.00 13.11 C ATOM 781 O PHE A 51 -1.912 -5.690 -3.850 1.00 34.01 O ATOM 782 CB PHE A 51 -1.095 -4.004 -6.095 1.00 41.44 C ATOM 783 CG PHE A 51 -1.201 -2.640 -5.443 1.00 12.12 C ATOM 784 CD1 PHE A 51 -0.324 -2.238 -4.440 1.00 43.21 C ATOM 785 CD2 PHE A 51 -2.188 -1.755 -5.850 1.00 71.44 C ATOM 786 CE1 PHE A 51 -0.438 -0.987 -3.862 1.00 13.14 C ATOM 787 CE2 PHE A 51 -2.303 -0.507 -5.273 1.00 33.12 C ATOM 788 CZ PHE A 51 -1.428 -0.121 -4.280 1.00 62.51 C ATOM 0 H PHE A 51 -0.923 -6.667 -6.437 1.00 21.51 H new ATOM 0 HA PHE A 51 0.803 -4.558 -5.230 1.00 1.31 H new ATOM 0 HB2 PHE A 51 -0.736 -3.872 -7.116 1.00 41.44 H new ATOM 0 HB3 PHE A 51 -2.094 -4.434 -6.162 1.00 41.44 H new ATOM 0 HD1 PHE A 51 0.454 -2.910 -4.110 1.00 43.21 H new ATOM 0 HD2 PHE A 51 -2.876 -2.047 -6.629 1.00 71.44 H new ATOM 0 HE1 PHE A 51 0.248 -0.688 -3.083 1.00 13.14 H new ATOM 0 HE2 PHE A 51 -3.080 0.169 -5.600 1.00 33.12 H new ATOM 0 HZ PHE A 51 -1.517 0.857 -3.830 1.00 62.51 H new ATOM 798 N ALA A 52 0.134 -5.350 -2.984 1.00 11.51 N ATOM 799 CA ALA A 52 -0.246 -5.733 -1.617 1.00 40.52 C ATOM 800 C ALA A 52 -0.294 -4.523 -0.671 1.00 55.10 C ATOM 801 O ALA A 52 0.486 -3.580 -0.809 1.00 23.22 O ATOM 802 CB ALA A 52 0.727 -6.778 -1.083 1.00 15.44 C ATOM 0 H ALA A 52 1.109 -5.065 -3.082 1.00 11.51 H new ATOM 0 HA ALA A 52 -1.251 -6.154 -1.658 1.00 40.52 H new ATOM 0 HB1 ALA A 52 0.440 -7.058 -0.069 1.00 15.44 H new ATOM 0 HB2 ALA A 52 0.702 -7.659 -1.724 1.00 15.44 H new ATOM 0 HB3 ALA A 52 1.736 -6.365 -1.074 1.00 15.44 H new ATOM 808 N VAL A 53 -1.212 -4.563 0.297 1.00 12.13 N ATOM 809 CA VAL A 53 -1.365 -3.486 1.285 1.00 33.13 C ATOM 810 C VAL A 53 -1.293 -4.033 2.725 1.00 41.42 C ATOM 811 O VAL A 53 -2.154 -4.802 3.154 1.00 33.34 O ATOM 812 CB VAL A 53 -2.710 -2.737 1.095 1.00 1.41 C ATOM 813 CG1 VAL A 53 -2.847 -1.598 2.105 1.00 23.41 C ATOM 814 CG2 VAL A 53 -2.840 -2.216 -0.336 1.00 65.52 C ATOM 0 H VAL A 53 -1.867 -5.335 0.420 1.00 12.13 H new ATOM 0 HA VAL A 53 -0.541 -2.790 1.125 1.00 33.13 H new ATOM 0 HB VAL A 53 -3.521 -3.443 1.274 1.00 1.41 H new ATOM 0 HG11 VAL A 53 -3.798 -1.088 1.952 1.00 23.41 H new ATOM 0 HG12 VAL A 53 -2.811 -2.002 3.117 1.00 23.41 H new ATOM 0 HG13 VAL A 53 -2.030 -0.890 1.968 1.00 23.41 H new ATOM 0 HG21 VAL A 53 -3.790 -1.694 -0.448 1.00 65.52 H new ATOM 0 HG22 VAL A 53 -2.021 -1.529 -0.549 1.00 65.52 H new ATOM 0 HG23 VAL A 53 -2.802 -3.053 -1.033 1.00 65.52 H new ATOM 824 N VAL A 54 -0.259 -3.633 3.463 1.00 5.32 N ATOM 825 CA VAL A 54 -0.055 -4.090 4.844 1.00 54.41 C ATOM 826 C VAL A 54 -0.077 -2.914 5.836 1.00 62.23 C ATOM 827 O VAL A 54 0.569 -1.890 5.615 1.00 25.22 O ATOM 828 CB VAL A 54 1.294 -4.843 4.990 1.00 5.51 C ATOM 829 CG1 VAL A 54 1.476 -5.375 6.411 1.00 13.41 C ATOM 830 CG2 VAL A 54 1.395 -5.974 3.967 1.00 30.12 C ATOM 0 H VAL A 54 0.457 -2.989 3.128 1.00 5.32 H new ATOM 0 HA VAL A 54 -0.877 -4.767 5.075 1.00 54.41 H new ATOM 0 HB VAL A 54 2.098 -4.134 4.794 1.00 5.51 H new ATOM 0 HG11 VAL A 54 2.429 -5.898 6.484 1.00 13.41 H new ATOM 0 HG12 VAL A 54 1.463 -4.543 7.115 1.00 13.41 H new ATOM 0 HG13 VAL A 54 0.665 -6.064 6.648 1.00 13.41 H new ATOM 0 HG21 VAL A 54 2.348 -6.489 4.087 1.00 30.12 H new ATOM 0 HG22 VAL A 54 0.579 -6.680 4.123 1.00 30.12 H new ATOM 0 HG23 VAL A 54 1.330 -5.561 2.960 1.00 30.12 H new ATOM 840 N THR A 55 -0.823 -3.062 6.929 1.00 34.34 N ATOM 841 CA THR A 55 -0.874 -2.032 7.977 1.00 70.41 C ATOM 842 C THR A 55 -0.179 -2.511 9.257 1.00 11.04 C ATOM 843 O THR A 55 -0.510 -3.567 9.801 1.00 44.34 O ATOM 844 CB THR A 55 -2.325 -1.644 8.342 1.00 23.31 C ATOM 845 OG1 THR A 55 -2.970 -2.731 9.020 1.00 0.33 O ATOM 846 CG2 THR A 55 -3.126 -1.271 7.100 1.00 22.22 C ATOM 0 H THR A 55 -1.401 -3.881 7.116 1.00 34.34 H new ATOM 0 HA THR A 55 -0.360 -1.162 7.568 1.00 70.41 H new ATOM 0 HB THR A 55 -2.284 -0.775 8.999 1.00 23.31 H new ATOM 0 HG1 THR A 55 -3.931 -2.550 9.088 1.00 0.33 H new ATOM 0 HG21 THR A 55 -4.142 -1.003 7.389 1.00 22.22 H new ATOM 0 HG22 THR A 55 -2.654 -0.423 6.604 1.00 22.22 H new ATOM 0 HG23 THR A 55 -3.155 -2.120 6.417 1.00 22.22 H new ATOM 854 N LEU A 56 0.779 -1.728 9.738 1.00 61.32 N ATOM 855 CA LEU A 56 1.502 -2.051 10.971 1.00 43.01 C ATOM 856 C LEU A 56 1.558 -0.830 11.910 1.00 22.31 C ATOM 857 O LEU A 56 1.693 0.306 11.452 1.00 11.23 O ATOM 858 CB LEU A 56 2.930 -2.514 10.646 1.00 33.21 C ATOM 859 CG LEU A 56 3.055 -3.689 9.659 1.00 22.13 C ATOM 860 CD1 LEU A 56 4.517 -3.923 9.284 1.00 33.13 C ATOM 861 CD2 LEU A 56 2.449 -4.959 10.248 1.00 32.34 C ATOM 0 H LEU A 56 1.077 -0.860 9.293 1.00 61.32 H new ATOM 0 HA LEU A 56 0.967 -2.856 11.474 1.00 43.01 H new ATOM 0 HB2 LEU A 56 3.481 -1.666 10.240 1.00 33.21 H new ATOM 0 HB3 LEU A 56 3.419 -2.796 11.578 1.00 33.21 H new ATOM 0 HG LEU A 56 2.502 -3.432 8.756 1.00 22.13 H new ATOM 0 HD11 LEU A 56 4.584 -4.757 8.586 1.00 33.13 H new ATOM 0 HD12 LEU A 56 4.921 -3.025 8.816 1.00 33.13 H new ATOM 0 HD13 LEU A 56 5.090 -4.154 10.182 1.00 33.13 H new ATOM 0 HD21 LEU A 56 2.549 -5.775 9.533 1.00 32.34 H new ATOM 0 HD22 LEU A 56 2.971 -5.218 11.169 1.00 32.34 H new ATOM 0 HD23 LEU A 56 1.394 -4.793 10.463 1.00 32.34 H new ATOM 873 N PRO A 57 1.439 -1.040 13.236 1.00 64.03 N ATOM 874 CA PRO A 57 1.554 0.049 14.220 1.00 21.52 C ATOM 875 C PRO A 57 2.961 0.669 14.234 1.00 14.32 C ATOM 876 O PRO A 57 3.146 1.819 13.831 1.00 51.03 O ATOM 877 CB PRO A 57 1.235 -0.631 15.566 1.00 55.04 C ATOM 878 CG PRO A 57 0.582 -1.926 15.206 1.00 53.41 C ATOM 879 CD PRO A 57 1.169 -2.329 13.881 1.00 74.12 C ATOM 0 HA PRO A 57 0.883 0.877 13.992 1.00 21.52 H new ATOM 0 HB2 PRO A 57 2.141 -0.796 16.148 1.00 55.04 H new ATOM 0 HB3 PRO A 57 0.574 -0.012 16.173 1.00 55.04 H new ATOM 0 HG2 PRO A 57 0.774 -2.684 15.965 1.00 53.41 H new ATOM 0 HG3 PRO A 57 -0.500 -1.812 15.136 1.00 53.41 H new ATOM 0 HD2 PRO A 57 2.078 -2.917 14.004 1.00 74.12 H new ATOM 0 HD3 PRO A 57 0.474 -2.934 13.299 1.00 74.12 H new ATOM 887 N SER A 58 3.956 -0.101 14.675 1.00 10.41 N ATOM 888 CA SER A 58 5.350 0.369 14.691 1.00 71.41 C ATOM 889 C SER A 58 6.301 -0.688 14.119 1.00 44.43 C ATOM 890 O SER A 58 5.987 -1.879 14.091 1.00 35.22 O ATOM 891 CB SER A 58 5.799 0.736 16.113 1.00 61.43 C ATOM 892 OG SER A 58 7.165 1.137 16.130 1.00 21.51 O ATOM 0 H SER A 58 3.828 -1.050 15.026 1.00 10.41 H new ATOM 0 HA SER A 58 5.390 1.260 14.064 1.00 71.41 H new ATOM 0 HB2 SER A 58 5.175 1.542 16.498 1.00 61.43 H new ATOM 0 HB3 SER A 58 5.659 -0.119 16.774 1.00 61.43 H new ATOM 0 HG SER A 58 7.427 1.367 17.046 1.00 21.51 H new ATOM 898 N ILE A 59 7.465 -0.236 13.662 1.00 55.45 N ATOM 899 CA ILE A 59 8.499 -1.127 13.115 1.00 23.31 C ATOM 900 C ILE A 59 9.808 -1.013 13.916 1.00 52.51 C ATOM 901 O ILE A 59 10.845 -1.550 13.519 1.00 33.53 O ATOM 902 CB ILE A 59 8.775 -0.813 11.620 1.00 62.22 C ATOM 903 CG1 ILE A 59 9.197 0.658 11.440 1.00 65.53 C ATOM 904 CG2 ILE A 59 7.544 -1.132 10.770 1.00 11.13 C ATOM 905 CD1 ILE A 59 9.467 1.054 9.997 1.00 42.33 C ATOM 0 H ILE A 59 7.723 0.751 13.657 1.00 55.45 H new ATOM 0 HA ILE A 59 8.123 -2.147 13.197 1.00 23.31 H new ATOM 0 HB ILE A 59 9.597 -1.444 11.283 1.00 62.22 H new ATOM 0 HG12 ILE A 59 8.414 1.301 11.842 1.00 65.53 H new ATOM 0 HG13 ILE A 59 10.095 0.842 12.030 1.00 65.53 H new ATOM 0 HG21 ILE A 59 7.755 -0.906 9.725 1.00 11.13 H new ATOM 0 HG22 ILE A 59 7.297 -2.189 10.870 1.00 11.13 H new ATOM 0 HG23 ILE A 59 6.702 -0.529 11.109 1.00 11.13 H new ATOM 0 HD11 ILE A 59 9.758 2.104 9.956 1.00 42.33 H new ATOM 0 HD12 ILE A 59 10.272 0.438 9.595 1.00 42.33 H new ATOM 0 HD13 ILE A 59 8.565 0.904 9.404 1.00 42.33 H new ATOM 917 N GLY A 60 9.743 -0.320 15.055 1.00 74.43 N ATOM 918 CA GLY A 60 10.922 -0.127 15.895 1.00 71.31 C ATOM 919 C GLY A 60 11.865 0.951 15.366 1.00 53.13 C ATOM 920 O GLY A 60 11.481 2.117 15.245 1.00 4.11 O ATOM 0 H GLY A 60 8.892 0.113 15.413 1.00 74.43 H new ATOM 0 HA2 GLY A 60 10.603 0.140 16.902 1.00 71.31 H new ATOM 0 HA3 GLY A 60 11.464 -1.070 15.972 1.00 71.31 H new ATOM 924 N ASP A 61 13.102 0.566 15.065 1.00 72.34 N ATOM 925 CA ASP A 61 14.100 1.489 14.512 1.00 33.11 C ATOM 926 C ASP A 61 14.452 1.141 13.056 1.00 3.03 C ATOM 927 O ASP A 61 15.322 1.772 12.451 1.00 42.41 O ATOM 928 CB ASP A 61 15.362 1.469 15.377 1.00 41.21 C ATOM 929 CG ASP A 61 15.109 2.034 16.761 1.00 72.35 C ATOM 930 OD1 ASP A 61 15.193 3.271 16.925 1.00 12.31 O ATOM 931 OD2 ASP A 61 14.823 1.252 17.691 1.00 45.24 O ATOM 0 H ASP A 61 13.443 -0.386 15.195 1.00 72.34 H new ATOM 0 HA ASP A 61 13.669 2.490 14.517 1.00 33.11 H new ATOM 0 HB2 ASP A 61 15.726 0.445 15.464 1.00 41.21 H new ATOM 0 HB3 ASP A 61 16.147 2.046 14.887 1.00 41.21 H new ATOM 936 N ALA A 62 13.770 0.144 12.501 1.00 21.42 N ATOM 937 CA ALA A 62 14.008 -0.288 11.120 1.00 32.31 C ATOM 938 C ALA A 62 13.616 0.802 10.104 1.00 5.42 C ATOM 939 O ALA A 62 12.593 1.470 10.262 1.00 55.41 O ATOM 940 CB ALA A 62 13.239 -1.577 10.835 1.00 65.24 C ATOM 0 H ALA A 62 13.044 -0.384 12.985 1.00 21.42 H new ATOM 0 HA ALA A 62 15.077 -0.472 11.009 1.00 32.31 H new ATOM 0 HB1 ALA A 62 13.422 -1.890 9.807 1.00 65.24 H new ATOM 0 HB2 ALA A 62 13.573 -2.359 11.517 1.00 65.24 H new ATOM 0 HB3 ALA A 62 12.172 -1.403 10.977 1.00 65.24 H new ATOM 946 N PRO A 63 14.427 1.000 9.043 1.00 63.41 N ATOM 947 CA PRO A 63 14.115 1.975 7.983 1.00 42.22 C ATOM 948 C PRO A 63 12.939 1.510 7.106 1.00 52.03 C ATOM 949 O PRO A 63 12.972 0.418 6.540 1.00 51.32 O ATOM 950 CB PRO A 63 15.414 2.047 7.170 1.00 40.51 C ATOM 951 CG PRO A 63 16.071 0.724 7.391 1.00 33.44 C ATOM 952 CD PRO A 63 15.702 0.298 8.790 1.00 55.21 C ATOM 0 HA PRO A 63 13.805 2.940 8.384 1.00 42.22 H new ATOM 0 HB2 PRO A 63 15.211 2.217 6.113 1.00 40.51 H new ATOM 0 HB3 PRO A 63 16.049 2.866 7.508 1.00 40.51 H new ATOM 0 HG2 PRO A 63 15.729 -0.007 6.659 1.00 33.44 H new ATOM 0 HG3 PRO A 63 17.153 0.803 7.281 1.00 33.44 H new ATOM 0 HD2 PRO A 63 15.585 -0.783 8.862 1.00 55.21 H new ATOM 0 HD3 PRO A 63 16.467 0.585 9.511 1.00 55.21 H new ATOM 960 N LEU A 64 11.915 2.352 6.986 1.00 21.33 N ATOM 961 CA LEU A 64 10.665 1.984 6.302 1.00 61.12 C ATOM 962 C LEU A 64 10.902 1.511 4.852 1.00 30.23 C ATOM 963 O LEU A 64 10.301 0.530 4.406 1.00 23.13 O ATOM 964 CB LEU A 64 9.692 3.177 6.327 1.00 21.33 C ATOM 965 CG LEU A 64 8.310 2.932 5.698 1.00 22.32 C ATOM 966 CD1 LEU A 64 7.618 1.742 6.358 1.00 51.31 C ATOM 967 CD2 LEU A 64 7.444 4.189 5.797 1.00 14.01 C ATOM 0 H LEU A 64 11.922 3.303 7.355 1.00 21.33 H new ATOM 0 HA LEU A 64 10.230 1.141 6.840 1.00 61.12 H new ATOM 0 HB2 LEU A 64 9.549 3.482 7.364 1.00 21.33 H new ATOM 0 HB3 LEU A 64 10.161 4.014 5.810 1.00 21.33 H new ATOM 0 HG LEU A 64 8.451 2.697 4.643 1.00 22.32 H new ATOM 0 HD11 LEU A 64 6.642 1.587 5.897 1.00 51.31 H new ATOM 0 HD12 LEU A 64 8.227 0.848 6.226 1.00 51.31 H new ATOM 0 HD13 LEU A 64 7.490 1.940 7.422 1.00 51.31 H new ATOM 0 HD21 LEU A 64 6.470 3.996 5.347 1.00 14.01 H new ATOM 0 HD22 LEU A 64 7.312 4.459 6.845 1.00 14.01 H new ATOM 0 HD23 LEU A 64 7.932 5.009 5.270 1.00 14.01 H new ATOM 979 N GLU A 65 11.785 2.197 4.133 1.00 72.25 N ATOM 980 CA GLU A 65 12.067 1.876 2.723 1.00 12.34 C ATOM 981 C GLU A 65 12.759 0.507 2.566 1.00 73.24 C ATOM 982 O GLU A 65 12.530 -0.214 1.594 1.00 3.43 O ATOM 983 CB GLU A 65 12.941 2.973 2.102 1.00 11.34 C ATOM 984 CG GLU A 65 12.366 4.378 2.252 1.00 4.32 C ATOM 985 CD GLU A 65 13.256 5.447 1.638 1.00 31.43 C ATOM 986 OE1 GLU A 65 14.464 5.484 1.966 1.00 62.24 O ATOM 987 OE2 GLU A 65 12.753 6.268 0.844 1.00 65.11 O ATOM 0 H GLU A 65 12.323 2.983 4.498 1.00 72.25 H new ATOM 0 HA GLU A 65 11.111 1.824 2.202 1.00 12.34 H new ATOM 0 HB2 GLU A 65 13.928 2.943 2.564 1.00 11.34 H new ATOM 0 HB3 GLU A 65 13.079 2.758 1.042 1.00 11.34 H new ATOM 0 HG2 GLU A 65 11.383 4.416 1.782 1.00 4.32 H new ATOM 0 HG3 GLU A 65 12.222 4.596 3.310 1.00 4.32 H new ATOM 994 N ASP A 66 13.613 0.162 3.523 1.00 72.04 N ATOM 995 CA ASP A 66 14.338 -1.113 3.494 1.00 14.32 C ATOM 996 C ASP A 66 13.513 -2.242 4.139 1.00 53.22 C ATOM 997 O ASP A 66 13.654 -3.417 3.786 1.00 23.42 O ATOM 998 CB ASP A 66 15.679 -0.952 4.211 1.00 3.51 C ATOM 999 CG ASP A 66 16.550 0.106 3.555 1.00 5.24 C ATOM 1000 OD1 ASP A 66 16.356 1.309 3.837 1.00 54.01 O ATOM 1001 OD2 ASP A 66 17.431 -0.259 2.744 1.00 70.21 O ATOM 0 H ASP A 66 13.824 0.746 4.332 1.00 72.04 H new ATOM 0 HA ASP A 66 14.513 -1.389 2.454 1.00 14.32 H new ATOM 0 HB2 ASP A 66 15.504 -0.683 5.253 1.00 3.51 H new ATOM 0 HB3 ASP A 66 16.206 -1.906 4.213 1.00 3.51 H new ATOM 1006 N PHE A 67 12.650 -1.867 5.082 1.00 72.30 N ATOM 1007 CA PHE A 67 11.753 -2.813 5.756 1.00 31.24 C ATOM 1008 C PHE A 67 10.871 -3.549 4.736 1.00 22.11 C ATOM 1009 O PHE A 67 10.777 -4.781 4.742 1.00 64.11 O ATOM 1010 CB PHE A 67 10.876 -2.054 6.766 1.00 51.05 C ATOM 1011 CG PHE A 67 9.951 -2.930 7.579 1.00 33.24 C ATOM 1012 CD1 PHE A 67 8.674 -3.233 7.126 1.00 53.41 C ATOM 1013 CD2 PHE A 67 10.360 -3.441 8.804 1.00 42.14 C ATOM 1014 CE1 PHE A 67 7.827 -4.026 7.876 1.00 54.31 C ATOM 1015 CE2 PHE A 67 9.515 -4.233 9.554 1.00 44.33 C ATOM 1016 CZ PHE A 67 8.248 -4.526 9.090 1.00 3.20 C ATOM 0 H PHE A 67 12.551 -0.903 5.402 1.00 72.30 H new ATOM 0 HA PHE A 67 12.354 -3.555 6.282 1.00 31.24 H new ATOM 0 HB2 PHE A 67 11.524 -1.502 7.447 1.00 51.05 H new ATOM 0 HB3 PHE A 67 10.278 -1.318 6.228 1.00 51.05 H new ATOM 0 HD1 PHE A 67 8.339 -2.844 6.176 1.00 53.41 H new ATOM 0 HD2 PHE A 67 11.350 -3.216 9.173 1.00 42.14 H new ATOM 0 HE1 PHE A 67 6.836 -4.254 7.512 1.00 54.31 H new ATOM 0 HE2 PHE A 67 9.845 -4.624 10.505 1.00 44.33 H new ATOM 0 HZ PHE A 67 7.587 -5.146 9.677 1.00 3.20 H new ATOM 1026 N THR A 68 10.234 -2.777 3.858 1.00 5.12 N ATOM 1027 CA THR A 68 9.387 -3.326 2.794 1.00 33.14 C ATOM 1028 C THR A 68 10.160 -4.286 1.880 1.00 65.14 C ATOM 1029 O THR A 68 9.624 -5.304 1.443 1.00 53.32 O ATOM 1030 CB THR A 68 8.772 -2.197 1.936 1.00 11.01 C ATOM 1031 OG1 THR A 68 9.783 -1.237 1.594 1.00 31.34 O ATOM 1032 CG2 THR A 68 7.644 -1.499 2.683 1.00 1.03 C ATOM 0 H THR A 68 10.288 -1.758 3.861 1.00 5.12 H new ATOM 0 HA THR A 68 8.592 -3.884 3.289 1.00 33.14 H new ATOM 0 HB THR A 68 8.366 -2.643 1.028 1.00 11.01 H new ATOM 0 HG1 THR A 68 9.934 -1.252 0.626 1.00 31.34 H new ATOM 0 HG21 THR A 68 7.228 -0.709 2.058 1.00 1.03 H new ATOM 0 HG22 THR A 68 6.864 -2.222 2.922 1.00 1.03 H new ATOM 0 HG23 THR A 68 8.032 -1.066 3.605 1.00 1.03 H new ATOM 1040 N LEU A 69 11.421 -3.962 1.603 1.00 63.02 N ATOM 1041 CA LEU A 69 12.278 -4.812 0.765 1.00 35.14 C ATOM 1042 C LEU A 69 12.496 -6.203 1.399 1.00 14.11 C ATOM 1043 O LEU A 69 12.532 -7.218 0.696 1.00 12.42 O ATOM 1044 CB LEU A 69 13.627 -4.121 0.517 1.00 43.44 C ATOM 1045 CG LEU A 69 14.610 -4.887 -0.389 1.00 13.52 C ATOM 1046 CD1 LEU A 69 13.979 -5.197 -1.747 1.00 44.42 C ATOM 1047 CD2 LEU A 69 15.906 -4.097 -0.570 1.00 35.24 C ATOM 0 H LEU A 69 11.877 -3.116 1.945 1.00 63.02 H new ATOM 0 HA LEU A 69 11.770 -4.960 -0.188 1.00 35.14 H new ATOM 0 HB2 LEU A 69 13.438 -3.143 0.073 1.00 43.44 H new ATOM 0 HB3 LEU A 69 14.108 -3.947 1.479 1.00 43.44 H new ATOM 0 HG LEU A 69 14.846 -5.833 0.099 1.00 13.52 H new ATOM 0 HD11 LEU A 69 14.695 -5.738 -2.366 1.00 44.42 H new ATOM 0 HD12 LEU A 69 13.088 -5.809 -1.603 1.00 44.42 H new ATOM 0 HD13 LEU A 69 13.703 -4.265 -2.241 1.00 44.42 H new ATOM 0 HD21 LEU A 69 16.586 -4.656 -1.213 1.00 35.24 H new ATOM 0 HD22 LEU A 69 15.684 -3.133 -1.028 1.00 35.24 H new ATOM 0 HD23 LEU A 69 16.374 -3.938 0.402 1.00 35.24 H new ATOM 1059 N LYS A 70 12.644 -6.242 2.724 1.00 12.32 N ATOM 1060 CA LYS A 70 12.786 -7.514 3.452 1.00 33.41 C ATOM 1061 C LYS A 70 11.494 -8.346 3.393 1.00 63.24 C ATOM 1062 O LYS A 70 11.535 -9.572 3.264 1.00 30.24 O ATOM 1063 CB LYS A 70 13.178 -7.262 4.919 1.00 50.42 C ATOM 1064 CG LYS A 70 14.589 -6.708 5.102 1.00 13.11 C ATOM 1065 CD LYS A 70 14.916 -6.447 6.574 1.00 14.51 C ATOM 1066 CE LYS A 70 14.824 -7.714 7.424 1.00 14.34 C ATOM 1067 NZ LYS A 70 15.804 -8.750 7.004 1.00 43.41 N ATOM 0 H LYS A 70 12.669 -5.413 3.318 1.00 12.32 H new ATOM 0 HA LYS A 70 13.579 -8.080 2.963 1.00 33.41 H new ATOM 0 HB2 LYS A 70 12.466 -6.564 5.359 1.00 50.42 H new ATOM 0 HB3 LYS A 70 13.092 -8.197 5.472 1.00 50.42 H new ATOM 0 HG2 LYS A 70 15.311 -7.412 4.690 1.00 13.11 H new ATOM 0 HG3 LYS A 70 14.690 -5.781 4.538 1.00 13.11 H new ATOM 0 HD2 LYS A 70 15.921 -6.032 6.652 1.00 14.51 H new ATOM 0 HD3 LYS A 70 14.230 -5.697 6.969 1.00 14.51 H new ATOM 0 HE2 LYS A 70 14.994 -7.460 8.470 1.00 14.34 H new ATOM 0 HE3 LYS A 70 13.816 -8.122 7.355 1.00 14.34 H new ATOM 0 HZ1 LYS A 70 15.762 -9.555 7.661 1.00 43.41 H new ATOM 0 HZ2 LYS A 70 15.575 -9.075 6.043 1.00 43.41 H new ATOM 0 HZ3 LYS A 70 16.762 -8.346 7.013 1.00 43.41 H new ATOM 1081 N LEU A 71 10.351 -7.675 3.486 1.00 42.31 N ATOM 1082 CA LEU A 71 9.049 -8.353 3.425 1.00 63.24 C ATOM 1083 C LEU A 71 8.738 -8.844 1.996 1.00 11.25 C ATOM 1084 O LEU A 71 8.264 -9.965 1.795 1.00 53.32 O ATOM 1085 CB LEU A 71 7.945 -7.403 3.915 1.00 50.32 C ATOM 1086 CG LEU A 71 6.540 -8.018 4.023 1.00 52.10 C ATOM 1087 CD1 LEU A 71 6.528 -9.176 5.018 1.00 53.42 C ATOM 1088 CD2 LEU A 71 5.518 -6.953 4.421 1.00 31.44 C ATOM 0 H LEU A 71 10.293 -6.663 3.604 1.00 42.31 H new ATOM 0 HA LEU A 71 9.088 -9.227 4.075 1.00 63.24 H new ATOM 0 HB2 LEU A 71 8.230 -7.018 4.894 1.00 50.32 H new ATOM 0 HB3 LEU A 71 7.898 -6.550 3.238 1.00 50.32 H new ATOM 0 HG LEU A 71 6.264 -8.411 3.045 1.00 52.10 H new ATOM 0 HD11 LEU A 71 5.523 -9.595 5.077 1.00 53.42 H new ATOM 0 HD12 LEU A 71 7.224 -9.947 4.687 1.00 53.42 H new ATOM 0 HD13 LEU A 71 6.829 -8.814 6.001 1.00 53.42 H new ATOM 0 HD21 LEU A 71 4.529 -7.406 4.493 1.00 31.44 H new ATOM 0 HD22 LEU A 71 5.793 -6.528 5.386 1.00 31.44 H new ATOM 0 HD23 LEU A 71 5.502 -6.165 3.668 1.00 31.44 H new ATOM 1100 N ALA A 72 9.027 -7.999 1.006 1.00 74.41 N ATOM 1101 CA ALA A 72 8.770 -8.321 -0.402 1.00 73.00 C ATOM 1102 C ALA A 72 9.540 -9.567 -0.865 1.00 22.15 C ATOM 1103 O ALA A 72 8.985 -10.435 -1.548 1.00 50.14 O ATOM 1104 CB ALA A 72 9.119 -7.126 -1.283 1.00 33.11 C ATOM 0 H ALA A 72 9.442 -7.079 1.153 1.00 74.41 H new ATOM 0 HA ALA A 72 7.708 -8.546 -0.497 1.00 73.00 H new ATOM 0 HB1 ALA A 72 8.925 -7.374 -2.326 1.00 33.11 H new ATOM 0 HB2 ALA A 72 8.509 -6.270 -0.994 1.00 33.11 H new ATOM 0 HB3 ALA A 72 10.173 -6.878 -1.159 1.00 33.11 H new ATOM 1110 N ARG A 73 10.819 -9.657 -0.497 1.00 74.24 N ATOM 1111 CA ARG A 73 11.656 -10.799 -0.896 1.00 54.22 C ATOM 1112 C ARG A 73 11.218 -12.099 -0.214 1.00 11.31 C ATOM 1113 O ARG A 73 11.449 -13.189 -0.732 1.00 44.42 O ATOM 1114 CB ARG A 73 13.139 -10.517 -0.608 1.00 52.25 C ATOM 1115 CG ARG A 73 13.469 -10.253 0.856 1.00 53.11 C ATOM 1116 CD ARG A 73 14.935 -9.867 1.025 1.00 1.44 C ATOM 1117 NE ARG A 73 15.293 -8.721 0.191 1.00 4.51 N ATOM 1118 CZ ARG A 73 16.462 -8.555 -0.375 1.00 23.15 C ATOM 1119 NH1 ARG A 73 17.399 -9.436 -0.235 1.00 33.14 N ATOM 1120 NH2 ARG A 73 16.688 -7.512 -1.098 1.00 60.10 N ATOM 0 H ARG A 73 11.299 -8.960 0.073 1.00 74.24 H new ATOM 0 HA ARG A 73 11.525 -10.931 -1.970 1.00 54.22 H new ATOM 0 HB2 ARG A 73 13.729 -11.367 -0.951 1.00 52.25 H new ATOM 0 HB3 ARG A 73 13.451 -9.655 -1.197 1.00 52.25 H new ATOM 0 HG2 ARG A 73 12.833 -9.454 1.238 1.00 53.11 H new ATOM 0 HG3 ARG A 73 13.253 -11.143 1.447 1.00 53.11 H new ATOM 0 HD2 ARG A 73 15.131 -9.631 2.071 1.00 1.44 H new ATOM 0 HD3 ARG A 73 15.567 -10.717 0.766 1.00 1.44 H new ATOM 0 HE ARG A 73 14.585 -8.003 0.040 1.00 4.51 H new ATOM 0 HH11 ARG A 73 17.232 -10.274 0.322 1.00 33.14 H new ATOM 0 HH12 ARG A 73 18.305 -9.293 -0.682 1.00 33.14 H new ATOM 0 HH21 ARG A 73 15.956 -6.814 -1.230 1.00 60.10 H new ATOM 0 HH22 ARG A 73 17.599 -7.384 -1.538 1.00 60.10 H new ATOM 1134 N GLN A 74 10.577 -11.980 0.945 1.00 10.30 N ATOM 1135 CA GLN A 74 10.067 -13.152 1.658 1.00 52.22 C ATOM 1136 C GLN A 74 8.866 -13.763 0.917 1.00 34.54 C ATOM 1137 O GLN A 74 8.762 -14.983 0.774 1.00 45.04 O ATOM 1138 CB GLN A 74 9.663 -12.771 3.089 1.00 53.33 C ATOM 1139 CG GLN A 74 9.359 -13.970 3.984 1.00 41.42 C ATOM 1140 CD GLN A 74 8.872 -13.575 5.369 1.00 63.10 C ATOM 1141 OE1 GLN A 74 8.124 -14.305 6.009 1.00 72.13 O ATOM 1142 NE2 GLN A 74 9.291 -12.419 5.847 1.00 43.43 N ATOM 0 H GLN A 74 10.398 -11.090 1.410 1.00 10.30 H new ATOM 0 HA GLN A 74 10.862 -13.897 1.700 1.00 52.22 H new ATOM 0 HB2 GLN A 74 10.466 -12.187 3.540 1.00 53.33 H new ATOM 0 HB3 GLN A 74 8.784 -12.127 3.049 1.00 53.33 H new ATOM 0 HG2 GLN A 74 8.603 -14.591 3.504 1.00 41.42 H new ATOM 0 HG3 GLN A 74 10.257 -14.579 4.082 1.00 41.42 H new ATOM 0 HE21 GLN A 74 9.913 -11.833 5.291 1.00 43.43 H new ATOM 0 HE22 GLN A 74 8.993 -12.112 6.773 1.00 43.43 H new ATOM 1151 N TRP A 75 7.970 -12.899 0.436 1.00 63.44 N ATOM 1152 CA TRP A 75 6.757 -13.336 -0.274 1.00 53.15 C ATOM 1153 C TRP A 75 7.031 -13.653 -1.757 1.00 3.42 C ATOM 1154 O TRP A 75 6.212 -14.287 -2.425 1.00 74.04 O ATOM 1155 CB TRP A 75 5.671 -12.251 -0.186 1.00 31.31 C ATOM 1156 CG TRP A 75 5.219 -11.929 1.210 1.00 14.43 C ATOM 1157 CD1 TRP A 75 5.612 -12.532 2.371 1.00 22.42 C ATOM 1158 CD2 TRP A 75 4.275 -10.919 1.586 1.00 34.52 C ATOM 1159 NE1 TRP A 75 4.972 -11.956 3.441 1.00 34.31 N ATOM 1160 CE2 TRP A 75 4.146 -10.964 2.985 1.00 31.01 C ATOM 1161 CE3 TRP A 75 3.530 -9.975 0.873 1.00 32.53 C ATOM 1162 CZ2 TRP A 75 3.300 -10.109 3.684 1.00 43.20 C ATOM 1163 CZ3 TRP A 75 2.688 -9.127 1.567 1.00 64.33 C ATOM 1164 CH2 TRP A 75 2.582 -9.198 2.961 1.00 35.42 C ATOM 0 H TRP A 75 8.059 -11.887 0.524 1.00 63.44 H new ATOM 0 HA TRP A 75 6.418 -14.251 0.211 1.00 53.15 H new ATOM 0 HB2 TRP A 75 6.048 -11.340 -0.651 1.00 31.31 H new ATOM 0 HB3 TRP A 75 4.807 -12.572 -0.768 1.00 31.31 H new ATOM 0 HD1 TRP A 75 6.322 -13.343 2.438 1.00 22.42 H new ATOM 0 HE1 TRP A 75 5.093 -12.224 4.418 1.00 34.31 H new ATOM 0 HE3 TRP A 75 3.611 -9.910 -0.202 1.00 32.53 H new ATOM 0 HZ2 TRP A 75 3.214 -10.163 4.759 1.00 43.20 H new ATOM 0 HZ3 TRP A 75 2.103 -8.398 1.026 1.00 64.33 H new ATOM 0 HH2 TRP A 75 1.919 -8.519 3.476 1.00 35.42 H new ATOM 1175 N GLY A 76 8.172 -13.204 -2.273 1.00 15.42 N ATOM 1176 CA GLY A 76 8.474 -13.379 -3.695 1.00 62.44 C ATOM 1177 C GLY A 76 7.995 -12.209 -4.548 1.00 55.04 C ATOM 1178 O GLY A 76 8.017 -12.271 -5.779 1.00 53.10 O ATOM 0 H GLY A 76 8.895 -12.723 -1.739 1.00 15.42 H new ATOM 0 HA2 GLY A 76 9.550 -13.499 -3.821 1.00 62.44 H new ATOM 0 HA3 GLY A 76 8.007 -14.297 -4.051 1.00 62.44 H new ATOM 1182 N VAL A 77 7.563 -11.138 -3.887 1.00 22.13 N ATOM 1183 CA VAL A 77 7.093 -9.930 -4.572 1.00 64.23 C ATOM 1184 C VAL A 77 8.269 -8.988 -4.883 1.00 61.31 C ATOM 1185 O VAL A 77 8.132 -8.041 -5.658 1.00 31.23 O ATOM 1186 CB VAL A 77 6.033 -9.184 -3.712 1.00 32.52 C ATOM 1187 CG1 VAL A 77 5.429 -8.001 -4.470 1.00 22.24 C ATOM 1188 CG2 VAL A 77 4.937 -10.146 -3.251 1.00 43.52 C ATOM 0 H VAL A 77 7.528 -11.080 -2.869 1.00 22.13 H new ATOM 0 HA VAL A 77 6.630 -10.237 -5.510 1.00 64.23 H new ATOM 0 HB VAL A 77 6.540 -8.789 -2.832 1.00 32.52 H new ATOM 0 HG11 VAL A 77 4.693 -7.503 -3.840 1.00 22.24 H new ATOM 0 HG12 VAL A 77 6.218 -7.296 -4.733 1.00 22.24 H new ATOM 0 HG13 VAL A 77 4.945 -8.360 -5.379 1.00 22.24 H new ATOM 0 HG21 VAL A 77 4.206 -9.604 -2.651 1.00 43.52 H new ATOM 0 HG22 VAL A 77 4.443 -10.579 -4.121 1.00 43.52 H new ATOM 0 HG23 VAL A 77 5.380 -10.942 -2.652 1.00 43.52 H new ATOM 1256 N ASN A 82 11.794 -7.535 -8.681 1.00 14.34 N ATOM 1257 CA ASN A 82 10.723 -8.355 -9.269 1.00 32.13 C ATOM 1258 C ASN A 82 9.941 -7.566 -10.333 1.00 62.40 C ATOM 1259 O ASN A 82 9.880 -6.342 -10.281 1.00 2.40 O ATOM 1260 CB ASN A 82 9.781 -8.829 -8.153 1.00 64.42 C ATOM 1261 CG ASN A 82 8.645 -9.701 -8.652 1.00 35.11 C ATOM 1262 OD1 ASN A 82 8.772 -10.402 -9.648 1.00 14.14 O ATOM 1263 ND2 ASN A 82 7.527 -9.660 -7.962 1.00 23.22 N ATOM 0 HA ASN A 82 11.170 -9.218 -9.762 1.00 32.13 H new ATOM 0 HB2 ASN A 82 10.357 -9.385 -7.413 1.00 64.42 H new ATOM 0 HB3 ASN A 82 9.365 -7.959 -7.645 1.00 64.42 H new ATOM 0 HD21 ASN A 82 6.728 -10.224 -8.251 1.00 23.22 H new ATOM 0 HD22 ASN A 82 7.458 -9.064 -7.137 1.00 23.22 H new ATOM 1270 N ASN A 83 9.343 -8.259 -11.302 1.00 4.31 N ATOM 1271 CA ASN A 83 8.621 -7.573 -12.382 1.00 35.43 C ATOM 1272 C ASN A 83 7.406 -6.750 -11.863 1.00 51.04 C ATOM 1273 O ASN A 83 7.564 -5.588 -11.492 1.00 74.42 O ATOM 1274 CB ASN A 83 8.231 -8.561 -13.503 1.00 35.32 C ATOM 1275 CG ASN A 83 7.276 -9.667 -13.074 1.00 61.12 C ATOM 1276 OD1 ASN A 83 6.567 -10.239 -13.895 1.00 43.45 O ATOM 1277 ND2 ASN A 83 7.213 -9.950 -11.789 1.00 0.31 N ATOM 0 H ASN A 83 9.341 -9.277 -11.365 1.00 4.31 H new ATOM 0 HA ASN A 83 9.305 -6.843 -12.815 1.00 35.43 H new ATOM 0 HB2 ASN A 83 7.774 -8.001 -14.319 1.00 35.32 H new ATOM 0 HB3 ASN A 83 9.139 -9.017 -13.899 1.00 35.32 H new ATOM 0 HD21 ASN A 83 6.562 -10.661 -11.455 1.00 0.31 H new ATOM 0 HD22 ASN A 83 7.815 -9.458 -11.128 1.00 0.31 H new ATOM 1284 N ASN A 84 6.216 -7.339 -11.783 1.00 52.34 N ATOM 1285 CA ASN A 84 5.003 -6.580 -11.445 1.00 23.01 C ATOM 1286 C ASN A 84 4.771 -6.506 -9.925 1.00 64.14 C ATOM 1287 O ASN A 84 3.633 -6.440 -9.467 1.00 43.24 O ATOM 1288 CB ASN A 84 3.789 -7.215 -12.137 1.00 20.35 C ATOM 1289 CG ASN A 84 3.907 -7.203 -13.654 1.00 51.20 C ATOM 1290 OD1 ASN A 84 4.999 -7.282 -14.208 1.00 34.34 O ATOM 1291 ND2 ASN A 84 2.788 -7.102 -14.344 1.00 41.22 N ATOM 0 H ASN A 84 6.060 -8.334 -11.946 1.00 52.34 H new ATOM 0 HA ASN A 84 5.138 -5.558 -11.800 1.00 23.01 H new ATOM 0 HB2 ASN A 84 3.676 -8.243 -11.793 1.00 20.35 H new ATOM 0 HB3 ASN A 84 2.886 -6.680 -11.842 1.00 20.35 H new ATOM 0 HD21 ASN A 84 2.817 -7.088 -15.363 1.00 41.22 H new ATOM 0 HD22 ASN A 84 1.893 -7.038 -13.858 1.00 41.22 H new ATOM 1298 N GLY A 85 5.854 -6.471 -9.155 1.00 34.32 N ATOM 1299 CA GLY A 85 5.746 -6.459 -7.699 1.00 32.41 C ATOM 1300 C GLY A 85 5.633 -5.056 -7.103 1.00 62.11 C ATOM 1301 O GLY A 85 6.454 -4.180 -7.394 1.00 62.30 O ATOM 0 H GLY A 85 6.810 -6.451 -9.511 1.00 34.32 H new ATOM 0 HA2 GLY A 85 4.873 -7.041 -7.403 1.00 32.41 H new ATOM 0 HA3 GLY A 85 6.619 -6.955 -7.275 1.00 32.41 H new ATOM 1305 N LEU A 86 4.611 -4.848 -6.270 1.00 61.43 N ATOM 1306 CA LEU A 86 4.406 -3.577 -5.564 1.00 55.41 C ATOM 1307 C LEU A 86 3.876 -3.816 -4.137 1.00 64.24 C ATOM 1308 O LEU A 86 2.804 -4.393 -3.942 1.00 51.21 O ATOM 1309 CB LEU A 86 3.433 -2.680 -6.344 1.00 45.24 C ATOM 1310 CG LEU A 86 3.030 -1.362 -5.651 1.00 44.30 C ATOM 1311 CD1 LEU A 86 4.258 -0.534 -5.279 1.00 64.12 C ATOM 1312 CD2 LEU A 86 2.087 -0.556 -6.545 1.00 72.45 C ATOM 0 H LEU A 86 3.903 -5.553 -6.065 1.00 61.43 H new ATOM 0 HA LEU A 86 5.370 -3.074 -5.492 1.00 55.41 H new ATOM 0 HB2 LEU A 86 3.884 -2.439 -7.307 1.00 45.24 H new ATOM 0 HB3 LEU A 86 2.528 -3.251 -6.550 1.00 45.24 H new ATOM 0 HG LEU A 86 2.506 -1.613 -4.729 1.00 44.30 H new ATOM 0 HD11 LEU A 86 3.941 0.388 -4.792 1.00 64.12 H new ATOM 0 HD12 LEU A 86 4.889 -1.105 -4.598 1.00 64.12 H new ATOM 0 HD13 LEU A 86 4.821 -0.294 -6.181 1.00 64.12 H new ATOM 0 HD21 LEU A 86 1.812 0.371 -6.042 1.00 72.45 H new ATOM 0 HD22 LEU A 86 2.587 -0.324 -7.485 1.00 72.45 H new ATOM 0 HD23 LEU A 86 1.189 -1.140 -6.746 1.00 72.45 H new ATOM 1324 N LEU A 87 4.633 -3.362 -3.143 1.00 52.13 N ATOM 1325 CA LEU A 87 4.257 -3.530 -1.735 1.00 3.13 C ATOM 1326 C LEU A 87 3.982 -2.174 -1.060 1.00 30.10 C ATOM 1327 O LEU A 87 4.846 -1.296 -1.029 1.00 73.41 O ATOM 1328 CB LEU A 87 5.374 -4.272 -0.987 1.00 54.22 C ATOM 1329 CG LEU A 87 5.099 -4.559 0.501 1.00 70.14 C ATOM 1330 CD1 LEU A 87 3.859 -5.433 0.669 1.00 21.41 C ATOM 1331 CD2 LEU A 87 6.314 -5.218 1.149 1.00 20.41 C ATOM 0 H LEU A 87 5.516 -2.872 -3.283 1.00 52.13 H new ATOM 0 HA LEU A 87 3.338 -4.115 -1.696 1.00 3.13 H new ATOM 0 HB2 LEU A 87 5.559 -5.219 -1.493 1.00 54.22 H new ATOM 0 HB3 LEU A 87 6.290 -3.686 -1.063 1.00 54.22 H new ATOM 0 HG LEU A 87 4.911 -3.609 1.002 1.00 70.14 H new ATOM 0 HD11 LEU A 87 3.687 -5.621 1.729 1.00 21.41 H new ATOM 0 HD12 LEU A 87 2.994 -4.922 0.246 1.00 21.41 H new ATOM 0 HD13 LEU A 87 4.009 -6.381 0.152 1.00 21.41 H new ATOM 0 HD21 LEU A 87 6.104 -5.414 2.200 1.00 20.41 H new ATOM 0 HD22 LEU A 87 6.533 -6.157 0.641 1.00 20.41 H new ATOM 0 HD23 LEU A 87 7.174 -4.553 1.069 1.00 20.41 H new ATOM 1343 N LEU A 88 2.775 -2.016 -0.521 1.00 23.24 N ATOM 1344 CA LEU A 88 2.379 -0.794 0.192 1.00 31.23 C ATOM 1345 C LEU A 88 2.201 -1.066 1.695 1.00 74.00 C ATOM 1346 O LEU A 88 1.305 -1.802 2.096 1.00 45.23 O ATOM 1347 CB LEU A 88 1.070 -0.242 -0.400 1.00 11.12 C ATOM 1348 CG LEU A 88 0.436 0.938 0.363 1.00 21.44 C ATOM 1349 CD1 LEU A 88 1.400 2.118 0.442 1.00 14.41 C ATOM 1350 CD2 LEU A 88 -0.883 1.352 -0.286 1.00 53.50 C ATOM 0 H LEU A 88 2.044 -2.726 -0.563 1.00 23.24 H new ATOM 0 HA LEU A 88 3.171 -0.055 0.070 1.00 31.23 H new ATOM 0 HB2 LEU A 88 1.261 0.073 -1.426 1.00 11.12 H new ATOM 0 HB3 LEU A 88 0.343 -1.053 -0.446 1.00 11.12 H new ATOM 0 HG LEU A 88 0.226 0.611 1.381 1.00 21.44 H new ATOM 0 HD11 LEU A 88 0.929 2.937 0.985 1.00 14.41 H new ATOM 0 HD12 LEU A 88 2.308 1.812 0.963 1.00 14.41 H new ATOM 0 HD13 LEU A 88 1.654 2.449 -0.565 1.00 14.41 H new ATOM 0 HD21 LEU A 88 -1.315 2.186 0.267 1.00 53.50 H new ATOM 0 HD22 LEU A 88 -0.702 1.655 -1.317 1.00 53.50 H new ATOM 0 HD23 LEU A 88 -1.575 0.510 -0.272 1.00 53.50 H new ATOM 1362 N VAL A 89 3.056 -0.469 2.523 1.00 72.00 N ATOM 1363 CA VAL A 89 2.974 -0.645 3.983 1.00 32.04 C ATOM 1364 C VAL A 89 2.728 0.694 4.703 1.00 14.52 C ATOM 1365 O VAL A 89 3.403 1.689 4.435 1.00 10.21 O ATOM 1366 CB VAL A 89 4.260 -1.305 4.551 1.00 61.02 C ATOM 1367 CG1 VAL A 89 4.188 -1.427 6.075 1.00 51.30 C ATOM 1368 CG2 VAL A 89 4.495 -2.675 3.912 1.00 33.32 C ATOM 0 H VAL A 89 3.814 0.140 2.215 1.00 72.00 H new ATOM 0 HA VAL A 89 2.127 -1.305 4.168 1.00 32.04 H new ATOM 0 HB VAL A 89 5.104 -0.661 4.303 1.00 61.02 H new ATOM 0 HG11 VAL A 89 5.101 -1.892 6.446 1.00 51.30 H new ATOM 0 HG12 VAL A 89 4.081 -0.435 6.515 1.00 51.30 H new ATOM 0 HG13 VAL A 89 3.330 -2.040 6.351 1.00 51.30 H new ATOM 0 HG21 VAL A 89 5.401 -3.118 4.325 1.00 33.32 H new ATOM 0 HG22 VAL A 89 3.645 -3.325 4.121 1.00 33.32 H new ATOM 0 HG23 VAL A 89 4.607 -2.559 2.834 1.00 33.32 H new ATOM 1378 N LEU A 90 1.754 0.704 5.612 1.00 44.24 N ATOM 1379 CA LEU A 90 1.432 1.889 6.419 1.00 23.11 C ATOM 1380 C LEU A 90 1.910 1.725 7.869 1.00 24.33 C ATOM 1381 O LEU A 90 1.641 0.709 8.512 1.00 34.51 O ATOM 1382 CB LEU A 90 -0.086 2.141 6.407 1.00 74.44 C ATOM 1383 CG LEU A 90 -0.592 3.170 7.439 1.00 53.01 C ATOM 1384 CD1 LEU A 90 -0.085 4.576 7.129 1.00 1.51 C ATOM 1385 CD2 LEU A 90 -2.117 3.150 7.532 1.00 0.13 C ATOM 0 H LEU A 90 1.165 -0.104 5.812 1.00 44.24 H new ATOM 0 HA LEU A 90 1.950 2.741 5.979 1.00 23.11 H new ATOM 0 HB2 LEU A 90 -0.374 2.478 5.411 1.00 74.44 H new ATOM 0 HB3 LEU A 90 -0.596 1.194 6.583 1.00 74.44 H new ATOM 0 HG LEU A 90 -0.188 2.882 8.409 1.00 53.01 H new ATOM 0 HD11 LEU A 90 -0.463 5.272 7.878 1.00 1.51 H new ATOM 0 HD12 LEU A 90 1.005 4.582 7.145 1.00 1.51 H new ATOM 0 HD13 LEU A 90 -0.435 4.880 6.142 1.00 1.51 H new ATOM 0 HD21 LEU A 90 -2.446 3.885 8.267 1.00 0.13 H new ATOM 0 HD22 LEU A 90 -2.544 3.393 6.559 1.00 0.13 H new ATOM 0 HD23 LEU A 90 -2.450 2.158 7.837 1.00 0.13 H new ATOM 1397 N VAL A 91 2.612 2.735 8.378 1.00 71.55 N ATOM 1398 CA VAL A 91 3.059 2.747 9.777 1.00 41.05 C ATOM 1399 C VAL A 91 2.229 3.734 10.615 1.00 63.14 C ATOM 1400 O VAL A 91 2.356 4.950 10.464 1.00 62.43 O ATOM 1401 CB VAL A 91 4.559 3.116 9.884 1.00 10.41 C ATOM 1402 CG1 VAL A 91 5.001 3.183 11.344 1.00 34.25 C ATOM 1403 CG2 VAL A 91 5.416 2.119 9.104 1.00 22.50 C ATOM 0 H VAL A 91 2.886 3.560 7.844 1.00 71.55 H new ATOM 0 HA VAL A 91 2.915 1.740 10.168 1.00 41.05 H new ATOM 0 HB VAL A 91 4.697 4.104 9.444 1.00 10.41 H new ATOM 0 HG11 VAL A 91 6.058 3.444 11.392 1.00 34.25 H new ATOM 0 HG12 VAL A 91 4.416 3.940 11.867 1.00 34.25 H new ATOM 0 HG13 VAL A 91 4.845 2.213 11.816 1.00 34.25 H new ATOM 0 HG21 VAL A 91 6.467 2.396 9.192 1.00 22.50 H new ATOM 0 HG22 VAL A 91 5.269 1.118 9.509 1.00 22.50 H new ATOM 0 HG23 VAL A 91 5.124 2.132 8.054 1.00 22.50 H new ATOM 1413 N LEU A 92 1.393 3.200 11.505 1.00 33.44 N ATOM 1414 CA LEU A 92 0.498 4.017 12.344 1.00 65.13 C ATOM 1415 C LEU A 92 1.279 4.988 13.252 1.00 33.44 C ATOM 1416 O LEU A 92 0.885 6.143 13.425 1.00 21.52 O ATOM 1417 CB LEU A 92 -0.393 3.098 13.194 1.00 24.14 C ATOM 1418 CG LEU A 92 -1.339 3.802 14.185 1.00 51.31 C ATOM 1419 CD1 LEU A 92 -2.342 4.682 13.447 1.00 1.03 C ATOM 1420 CD2 LEU A 92 -2.065 2.776 15.058 1.00 14.42 C ATOM 0 H LEU A 92 1.312 2.196 11.669 1.00 33.44 H new ATOM 0 HA LEU A 92 -0.120 4.622 11.681 1.00 65.13 H new ATOM 0 HB2 LEU A 92 -0.994 2.485 12.522 1.00 24.14 H new ATOM 0 HB3 LEU A 92 0.250 2.420 13.755 1.00 24.14 H new ATOM 0 HG LEU A 92 -0.738 4.441 14.832 1.00 51.31 H new ATOM 0 HD11 LEU A 92 -2.999 5.168 14.168 1.00 1.03 H new ATOM 0 HD12 LEU A 92 -1.808 5.440 12.874 1.00 1.03 H new ATOM 0 HD13 LEU A 92 -2.937 4.068 12.771 1.00 1.03 H new ATOM 0 HD21 LEU A 92 -2.728 3.293 15.751 1.00 14.42 H new ATOM 0 HD22 LEU A 92 -2.650 2.109 14.425 1.00 14.42 H new ATOM 0 HD23 LEU A 92 -1.334 2.195 15.620 1.00 14.42 H new ATOM 1432 N ASP A 93 2.382 4.510 13.825 1.00 15.10 N ATOM 1433 CA ASP A 93 3.239 5.325 14.700 1.00 63.42 C ATOM 1434 C ASP A 93 3.781 6.568 13.969 1.00 73.31 C ATOM 1435 O ASP A 93 3.724 7.687 14.483 1.00 33.52 O ATOM 1436 CB ASP A 93 4.401 4.461 15.212 1.00 71.11 C ATOM 1437 CG ASP A 93 5.377 5.227 16.084 1.00 50.35 C ATOM 1438 OD1 ASP A 93 5.010 5.585 17.222 1.00 32.14 O ATOM 1439 OD2 ASP A 93 6.525 5.456 15.646 1.00 33.14 O ATOM 0 H ASP A 93 2.710 3.552 13.700 1.00 15.10 H new ATOM 0 HA ASP A 93 2.639 5.678 15.539 1.00 63.42 H new ATOM 0 HB2 ASP A 93 3.999 3.622 15.779 1.00 71.11 H new ATOM 0 HB3 ASP A 93 4.937 4.042 14.360 1.00 71.11 H new ATOM 1444 N GLN A 94 4.293 6.356 12.762 1.00 34.40 N ATOM 1445 CA GLN A 94 4.881 7.435 11.954 1.00 44.34 C ATOM 1446 C GLN A 94 3.829 8.163 11.093 1.00 73.01 C ATOM 1447 O GLN A 94 4.092 9.249 10.571 1.00 2.44 O ATOM 1448 CB GLN A 94 5.983 6.856 11.055 1.00 32.44 C ATOM 1449 CG GLN A 94 7.227 6.394 11.812 1.00 51.54 C ATOM 1450 CD GLN A 94 8.167 5.568 10.948 1.00 24.50 C ATOM 1451 OE1 GLN A 94 9.014 6.097 10.241 1.00 23.03 O ATOM 1452 NE2 GLN A 94 8.040 4.259 11.014 1.00 14.10 N ATOM 0 H GLN A 94 4.316 5.441 12.312 1.00 34.40 H new ATOM 0 HA GLN A 94 5.301 8.171 12.639 1.00 44.34 H new ATOM 0 HB2 GLN A 94 5.576 6.013 10.497 1.00 32.44 H new ATOM 0 HB3 GLN A 94 6.275 7.610 10.324 1.00 32.44 H new ATOM 0 HG2 GLN A 94 7.761 7.265 12.192 1.00 51.54 H new ATOM 0 HG3 GLN A 94 6.923 5.804 12.677 1.00 51.54 H new ATOM 0 HE21 GLN A 94 7.325 3.846 11.612 1.00 14.10 H new ATOM 0 HE22 GLN A 94 8.657 3.659 10.467 1.00 14.10 H new ATOM 1461 N ARG A 95 2.647 7.553 10.940 1.00 74.11 N ATOM 1462 CA ARG A 95 1.563 8.118 10.113 1.00 34.14 C ATOM 1463 C ARG A 95 1.997 8.321 8.648 1.00 43.43 C ATOM 1464 O ARG A 95 1.579 9.275 7.990 1.00 33.54 O ATOM 1465 CB ARG A 95 1.056 9.440 10.714 1.00 13.43 C ATOM 1466 CG ARG A 95 0.239 9.257 11.988 1.00 55.24 C ATOM 1467 CD ARG A 95 -0.194 10.597 12.575 1.00 5.10 C ATOM 1468 NE ARG A 95 -1.210 10.443 13.616 1.00 10.41 N ATOM 1469 CZ ARG A 95 -1.151 11.002 14.794 1.00 43.40 C ATOM 1470 NH1 ARG A 95 -0.122 11.706 15.144 1.00 5.43 N ATOM 1471 NH2 ARG A 95 -2.129 10.854 15.624 1.00 31.40 N ATOM 0 H ARG A 95 2.412 6.663 11.379 1.00 74.11 H new ATOM 0 HA ARG A 95 0.747 7.395 10.112 1.00 34.14 H new ATOM 0 HB2 ARG A 95 1.910 10.083 10.929 1.00 13.43 H new ATOM 0 HB3 ARG A 95 0.447 9.957 9.972 1.00 13.43 H new ATOM 0 HG2 ARG A 95 -0.642 8.652 11.772 1.00 55.24 H new ATOM 0 HG3 ARG A 95 0.829 8.710 12.724 1.00 55.24 H new ATOM 0 HD2 ARG A 95 0.675 11.107 12.991 1.00 5.10 H new ATOM 0 HD3 ARG A 95 -0.585 11.231 11.779 1.00 5.10 H new ATOM 0 HE ARG A 95 -2.020 9.859 13.407 1.00 10.41 H new ATOM 0 HH11 ARG A 95 0.656 11.829 14.496 1.00 5.43 H new ATOM 0 HH12 ARG A 95 -0.089 12.137 16.068 1.00 5.43 H new ATOM 0 HH21 ARG A 95 -2.944 10.302 15.358 1.00 31.40 H new ATOM 0 HH22 ARG A 95 -2.086 11.289 16.545 1.00 31.40 H new ATOM 1485 N ARG A 96 2.812 7.402 8.136 1.00 53.31 N ATOM 1486 CA ARG A 96 3.284 7.475 6.747 1.00 21.02 C ATOM 1487 C ARG A 96 3.421 6.079 6.125 1.00 23.12 C ATOM 1488 O ARG A 96 3.553 5.079 6.834 1.00 53.44 O ATOM 1489 CB ARG A 96 4.614 8.243 6.665 1.00 31.42 C ATOM 1490 CG ARG A 96 5.724 7.693 7.560 1.00 43.31 C ATOM 1491 CD ARG A 96 6.943 8.617 7.554 1.00 11.50 C ATOM 1492 NE ARG A 96 8.044 8.127 8.385 1.00 15.44 N ATOM 1493 CZ ARG A 96 9.060 8.869 8.755 1.00 15.41 C ATOM 1494 NH1 ARG A 96 9.103 10.126 8.456 1.00 12.12 N ATOM 1495 NH2 ARG A 96 10.023 8.356 9.445 1.00 64.14 N ATOM 0 H ARG A 96 3.161 6.598 8.657 1.00 53.31 H new ATOM 0 HA ARG A 96 2.536 8.019 6.171 1.00 21.02 H new ATOM 0 HB2 ARG A 96 4.961 8.233 5.632 1.00 31.42 H new ATOM 0 HB3 ARG A 96 4.434 9.285 6.931 1.00 31.42 H new ATOM 0 HG2 ARG A 96 5.353 7.582 8.579 1.00 43.31 H new ATOM 0 HG3 ARG A 96 6.014 6.700 7.216 1.00 43.31 H new ATOM 0 HD2 ARG A 96 7.295 8.736 6.529 1.00 11.50 H new ATOM 0 HD3 ARG A 96 6.644 9.605 7.905 1.00 11.50 H new ATOM 0 HE ARG A 96 8.020 7.155 8.693 1.00 15.44 H new ATOM 0 HH11 ARG A 96 8.341 10.551 7.927 1.00 12.12 H new ATOM 0 HH12 ARG A 96 9.898 10.693 8.749 1.00 12.12 H new ATOM 0 HH21 ARG A 96 9.996 7.370 9.704 1.00 64.14 H new ATOM 0 HH22 ARG A 96 10.811 8.937 9.731 1.00 64.14 H new ATOM 1509 N VAL A 97 3.389 6.024 4.795 1.00 42.24 N ATOM 1510 CA VAL A 97 3.400 4.750 4.062 1.00 23.30 C ATOM 1511 C VAL A 97 4.643 4.610 3.164 1.00 34.14 C ATOM 1512 O VAL A 97 5.413 5.556 2.986 1.00 62.34 O ATOM 1513 CB VAL A 97 2.133 4.595 3.179 1.00 42.24 C ATOM 1514 CG1 VAL A 97 0.864 4.834 3.983 1.00 62.34 C ATOM 1515 CG2 VAL A 97 2.187 5.529 1.974 1.00 62.01 C ATOM 0 H VAL A 97 3.355 6.849 4.196 1.00 42.24 H new ATOM 0 HA VAL A 97 3.419 3.966 4.819 1.00 23.30 H new ATOM 0 HB VAL A 97 2.112 3.568 2.815 1.00 42.24 H new ATOM 0 HG11 VAL A 97 -0.005 4.718 3.335 1.00 62.34 H new ATOM 0 HG12 VAL A 97 0.808 4.112 4.798 1.00 62.34 H new ATOM 0 HG13 VAL A 97 0.878 5.844 4.393 1.00 62.34 H new ATOM 0 HG21 VAL A 97 1.287 5.400 1.373 1.00 62.01 H new ATOM 0 HG22 VAL A 97 2.249 6.562 2.317 1.00 62.01 H new ATOM 0 HG23 VAL A 97 3.064 5.294 1.370 1.00 62.01 H new ATOM 1525 N ARG A 98 4.822 3.419 2.599 1.00 34.32 N ATOM 1526 CA ARG A 98 5.923 3.146 1.663 1.00 0.14 C ATOM 1527 C ARG A 98 5.440 2.327 0.454 1.00 54.41 C ATOM 1528 O ARG A 98 4.797 1.289 0.611 1.00 24.12 O ATOM 1529 CB ARG A 98 7.056 2.400 2.389 1.00 40.44 C ATOM 1530 CG ARG A 98 8.119 1.790 1.469 1.00 12.00 C ATOM 1531 CD ARG A 98 8.934 2.837 0.712 1.00 33.52 C ATOM 1532 NE ARG A 98 9.871 2.208 -0.219 1.00 20.01 N ATOM 1533 CZ ARG A 98 10.479 2.828 -1.195 1.00 73.13 C ATOM 1534 NH1 ARG A 98 10.372 4.109 -1.345 1.00 22.04 N ATOM 1535 NH2 ARG A 98 11.233 2.159 -2.003 1.00 11.32 N ATOM 0 H ARG A 98 4.216 2.617 2.772 1.00 34.32 H new ATOM 0 HA ARG A 98 6.297 4.101 1.293 1.00 0.14 H new ATOM 0 HB2 ARG A 98 7.544 3.091 3.076 1.00 40.44 H new ATOM 0 HB3 ARG A 98 6.619 1.605 2.993 1.00 40.44 H new ATOM 0 HG2 ARG A 98 8.794 1.174 2.063 1.00 12.00 H new ATOM 0 HG3 ARG A 98 7.633 1.129 0.751 1.00 12.00 H new ATOM 0 HD2 ARG A 98 8.262 3.498 0.164 1.00 33.52 H new ATOM 0 HD3 ARG A 98 9.483 3.457 1.421 1.00 33.52 H new ATOM 0 HE ARG A 98 10.063 1.214 -0.097 1.00 20.01 H new ATOM 0 HH11 ARG A 98 9.805 4.653 -0.695 1.00 22.04 H new ATOM 0 HH12 ARG A 98 10.855 4.575 -2.114 1.00 22.04 H new ATOM 0 HH21 ARG A 98 11.350 1.154 -1.877 1.00 11.32 H new ATOM 0 HH22 ARG A 98 11.711 2.636 -2.767 1.00 11.32 H new ATOM 1549 N PHE A 99 5.761 2.807 -0.748 1.00 50.11 N ATOM 1550 CA PHE A 99 5.484 2.077 -1.994 1.00 11.22 C ATOM 1551 C PHE A 99 6.768 1.433 -2.533 1.00 52.51 C ATOM 1552 O PHE A 99 7.654 2.130 -3.025 1.00 23.42 O ATOM 1553 CB PHE A 99 4.905 3.015 -3.064 1.00 52.15 C ATOM 1554 CG PHE A 99 3.454 3.380 -2.866 1.00 35.20 C ATOM 1555 CD1 PHE A 99 2.449 2.576 -3.387 1.00 14.24 C ATOM 1556 CD2 PHE A 99 3.097 4.531 -2.180 1.00 63.43 C ATOM 1557 CE1 PHE A 99 1.119 2.913 -3.228 1.00 44.12 C ATOM 1558 CE2 PHE A 99 1.767 4.870 -2.016 1.00 33.32 C ATOM 1559 CZ PHE A 99 0.777 4.061 -2.542 1.00 45.53 C ATOM 0 H PHE A 99 6.218 3.708 -0.889 1.00 50.11 H new ATOM 0 HA PHE A 99 4.752 1.301 -1.768 1.00 11.22 H new ATOM 0 HB2 PHE A 99 5.496 3.931 -3.083 1.00 52.15 H new ATOM 0 HB3 PHE A 99 5.017 2.543 -4.040 1.00 52.15 H new ATOM 0 HD1 PHE A 99 2.711 1.676 -3.923 1.00 14.24 H new ATOM 0 HD2 PHE A 99 3.866 5.169 -1.770 1.00 63.43 H new ATOM 0 HE1 PHE A 99 0.348 2.279 -3.640 1.00 44.12 H new ATOM 0 HE2 PHE A 99 1.501 5.767 -1.477 1.00 33.32 H new ATOM 0 HZ PHE A 99 -0.262 4.327 -2.416 1.00 45.53 H new ATOM 1569 N GLU A 100 6.869 0.113 -2.432 1.00 64.34 N ATOM 1570 CA GLU A 100 8.055 -0.608 -2.911 1.00 12.21 C ATOM 1571 C GLU A 100 7.776 -1.286 -4.260 1.00 2.21 C ATOM 1572 O GLU A 100 6.986 -2.229 -4.334 1.00 52.53 O ATOM 1573 CB GLU A 100 8.475 -1.664 -1.875 1.00 32.03 C ATOM 1574 CG GLU A 100 9.888 -2.207 -2.073 1.00 52.04 C ATOM 1575 CD GLU A 100 10.950 -1.136 -1.883 1.00 43.33 C ATOM 1576 OE1 GLU A 100 10.877 -0.400 -0.878 1.00 14.53 O ATOM 1577 OE2 GLU A 100 11.848 -1.007 -2.737 1.00 32.25 O ATOM 0 H GLU A 100 6.149 -0.484 -2.025 1.00 64.34 H new ATOM 0 HA GLU A 100 8.863 0.111 -3.048 1.00 12.21 H new ATOM 0 HB2 GLU A 100 8.401 -1.229 -0.878 1.00 32.03 H new ATOM 0 HB3 GLU A 100 7.770 -2.494 -1.913 1.00 32.03 H new ATOM 0 HG2 GLU A 100 10.065 -3.020 -1.368 1.00 52.04 H new ATOM 0 HG3 GLU A 100 9.976 -2.629 -3.074 1.00 52.04 H new ATOM 1584 N THR A 101 8.421 -0.802 -5.318 1.00 53.50 N ATOM 1585 CA THR A 101 8.274 -1.392 -6.658 1.00 64.13 C ATOM 1586 C THR A 101 9.488 -2.235 -7.045 1.00 63.23 C ATOM 1587 O THR A 101 10.609 -1.981 -6.603 1.00 3.51 O ATOM 1588 CB THR A 101 8.081 -0.319 -7.761 1.00 24.12 C ATOM 1589 OG1 THR A 101 9.025 0.748 -7.593 1.00 12.12 O ATOM 1590 CG2 THR A 101 6.663 0.240 -7.762 1.00 25.23 C ATOM 0 H THR A 101 9.053 -0.002 -5.280 1.00 53.50 H new ATOM 0 HA THR A 101 7.384 -2.018 -6.596 1.00 64.13 H new ATOM 0 HB THR A 101 8.253 -0.805 -8.722 1.00 24.12 H new ATOM 0 HG1 THR A 101 9.458 0.940 -8.451 1.00 12.12 H new ATOM 0 HG21 THR A 101 6.568 0.989 -8.549 1.00 25.23 H new ATOM 0 HG22 THR A 101 5.954 -0.568 -7.942 1.00 25.23 H new ATOM 0 HG23 THR A 101 6.452 0.700 -6.796 1.00 25.23 H new ATOM 1598 N GLY A 102 9.250 -3.250 -7.867 1.00 40.41 N ATOM 1599 CA GLY A 102 10.345 -3.983 -8.481 1.00 12.23 C ATOM 1600 C GLY A 102 10.837 -3.317 -9.760 1.00 23.21 C ATOM 1601 O GLY A 102 10.830 -2.095 -9.878 1.00 64.35 O ATOM 0 H GLY A 102 8.319 -3.580 -8.120 1.00 40.41 H new ATOM 0 HA2 GLY A 102 11.170 -4.061 -7.773 1.00 12.23 H new ATOM 0 HA3 GLY A 102 10.020 -4.999 -8.704 1.00 12.23 H new ATOM 1605 N TYR A 103 11.243 -4.122 -10.727 1.00 63.11 N ATOM 1606 CA TYR A 103 11.727 -3.618 -12.016 1.00 24.31 C ATOM 1607 C TYR A 103 10.579 -3.450 -13.031 1.00 22.45 C ATOM 1608 O TYR A 103 10.656 -2.623 -13.941 1.00 21.11 O ATOM 1609 CB TYR A 103 12.797 -4.582 -12.566 1.00 30.53 C ATOM 1610 CG TYR A 103 12.844 -4.667 -14.081 1.00 62.22 C ATOM 1611 CD1 TYR A 103 13.569 -3.750 -14.834 1.00 73.04 C ATOM 1612 CD2 TYR A 103 12.143 -5.663 -14.752 1.00 3.34 C ATOM 1613 CE1 TYR A 103 13.593 -3.826 -16.213 1.00 10.34 C ATOM 1614 CE2 TYR A 103 12.166 -5.746 -16.129 1.00 71.11 C ATOM 1615 CZ TYR A 103 12.891 -4.826 -16.855 1.00 70.14 C ATOM 1616 OH TYR A 103 12.907 -4.904 -18.228 1.00 0.45 O ATOM 0 H TYR A 103 11.249 -5.139 -10.649 1.00 63.11 H new ATOM 0 HA TYR A 103 12.164 -2.632 -11.860 1.00 24.31 H new ATOM 0 HB2 TYR A 103 13.775 -4.267 -12.201 1.00 30.53 H new ATOM 0 HB3 TYR A 103 12.613 -5.578 -12.164 1.00 30.53 H new ATOM 0 HD1 TYR A 103 14.121 -2.968 -14.334 1.00 73.04 H new ATOM 0 HD2 TYR A 103 11.571 -6.383 -14.186 1.00 3.34 H new ATOM 0 HE1 TYR A 103 14.158 -3.106 -16.786 1.00 10.34 H new ATOM 0 HE2 TYR A 103 11.619 -6.528 -16.635 1.00 71.11 H new ATOM 0 HH TYR A 103 12.363 -5.666 -18.519 1.00 0.45 H new ATOM 1626 N GLY A 104 9.509 -4.218 -12.859 1.00 0.20 N ATOM 1627 CA GLY A 104 8.463 -4.292 -13.878 1.00 52.43 C ATOM 1628 C GLY A 104 7.566 -3.060 -13.926 1.00 11.30 C ATOM 1629 O GLY A 104 7.019 -2.720 -14.976 1.00 61.24 O ATOM 0 H GLY A 104 9.342 -4.793 -12.034 1.00 0.20 H new ATOM 0 HA2 GLY A 104 8.928 -4.430 -14.854 1.00 52.43 H new ATOM 0 HA3 GLY A 104 7.847 -5.172 -13.691 1.00 52.43 H new ATOM 1633 N LEU A 105 7.414 -2.393 -12.786 1.00 74.43 N ATOM 1634 CA LEU A 105 6.488 -1.260 -12.667 1.00 32.14 C ATOM 1635 C LEU A 105 7.196 0.100 -12.775 1.00 31.41 C ATOM 1636 O LEU A 105 6.545 1.138 -12.724 1.00 43.11 O ATOM 1637 CB LEU A 105 5.733 -1.352 -11.335 1.00 74.15 C ATOM 1638 CG LEU A 105 4.858 -2.602 -11.172 1.00 41.21 C ATOM 1639 CD1 LEU A 105 4.195 -2.620 -9.799 1.00 72.42 C ATOM 1640 CD2 LEU A 105 3.811 -2.678 -12.285 1.00 61.03 C ATOM 0 H LEU A 105 7.919 -2.614 -11.928 1.00 74.43 H new ATOM 0 HA LEU A 105 5.790 -1.322 -13.502 1.00 32.14 H new ATOM 0 HB2 LEU A 105 6.457 -1.325 -10.521 1.00 74.15 H new ATOM 0 HB3 LEU A 105 5.103 -0.469 -11.230 1.00 74.15 H new ATOM 0 HG LEU A 105 5.498 -3.481 -11.250 1.00 41.21 H new ATOM 0 HD11 LEU A 105 3.579 -3.514 -9.704 1.00 72.42 H new ATOM 0 HD12 LEU A 105 4.962 -2.624 -9.025 1.00 72.42 H new ATOM 0 HD13 LEU A 105 3.569 -1.735 -9.686 1.00 72.42 H new ATOM 0 HD21 LEU A 105 3.201 -3.572 -12.151 1.00 61.03 H new ATOM 0 HD22 LEU A 105 3.174 -1.795 -12.246 1.00 61.03 H new ATOM 0 HD23 LEU A 105 4.311 -2.722 -13.253 1.00 61.03 H new ATOM 1652 N GLU A 106 8.515 0.096 -12.943 1.00 44.01 N ATOM 1653 CA GLU A 106 9.293 1.346 -13.014 1.00 50.31 C ATOM 1654 C GLU A 106 8.867 2.226 -14.206 1.00 3.42 C ATOM 1655 O GLU A 106 8.999 3.450 -14.169 1.00 64.21 O ATOM 1656 CB GLU A 106 10.796 1.028 -13.096 1.00 44.32 C ATOM 1657 CG GLU A 106 11.317 0.200 -11.922 1.00 40.10 C ATOM 1658 CD GLU A 106 11.355 0.962 -10.598 1.00 22.02 C ATOM 1659 OE1 GLU A 106 10.288 1.385 -10.106 1.00 74.35 O ATOM 1660 OE2 GLU A 106 12.458 1.123 -10.031 1.00 43.14 O ATOM 0 H GLU A 106 9.074 -0.752 -13.033 1.00 44.01 H new ATOM 0 HA GLU A 106 9.091 1.912 -12.104 1.00 50.31 H new ATOM 0 HB2 GLU A 106 10.994 0.491 -14.023 1.00 44.32 H new ATOM 0 HB3 GLU A 106 11.354 1.963 -13.144 1.00 44.32 H new ATOM 0 HG2 GLU A 106 10.688 -0.682 -11.805 1.00 40.10 H new ATOM 0 HG3 GLU A 106 12.321 -0.153 -12.156 1.00 40.10 H new ATOM 1667 N GLY A 107 8.349 1.591 -15.259 1.00 31.34 N ATOM 1668 CA GLY A 107 7.873 2.323 -16.433 1.00 45.32 C ATOM 1669 C GLY A 107 6.423 2.797 -16.315 1.00 35.10 C ATOM 1670 O GLY A 107 5.869 3.367 -17.259 1.00 51.24 O ATOM 0 H GLY A 107 8.249 0.578 -15.323 1.00 31.34 H new ATOM 0 HA2 GLY A 107 8.516 3.187 -16.597 1.00 45.32 H new ATOM 0 HA3 GLY A 107 7.967 1.684 -17.311 1.00 45.32 H new ATOM 1674 N TYR A 108 5.804 2.560 -15.157 1.00 2.42 N ATOM 1675 CA TYR A 108 4.413 2.984 -14.909 1.00 74.01 C ATOM 1676 C TYR A 108 4.297 3.818 -13.624 1.00 52.43 C ATOM 1677 O TYR A 108 3.545 4.793 -13.564 1.00 41.15 O ATOM 1678 CB TYR A 108 3.488 1.761 -14.789 1.00 11.33 C ATOM 1679 CG TYR A 108 3.459 0.884 -16.023 1.00 40.33 C ATOM 1680 CD1 TYR A 108 2.696 1.236 -17.130 1.00 64.30 C ATOM 1681 CD2 TYR A 108 4.199 -0.290 -16.084 1.00 52.42 C ATOM 1682 CE1 TYR A 108 2.669 0.444 -18.260 1.00 55.13 C ATOM 1683 CE2 TYR A 108 4.181 -1.086 -17.213 1.00 64.44 C ATOM 1684 CZ TYR A 108 3.414 -0.716 -18.299 1.00 61.45 C ATOM 1685 OH TYR A 108 3.396 -1.501 -19.432 1.00 10.11 O ATOM 0 H TYR A 108 6.239 2.077 -14.371 1.00 2.42 H new ATOM 0 HA TYR A 108 4.111 3.598 -15.758 1.00 74.01 H new ATOM 0 HB2 TYR A 108 3.806 1.160 -13.937 1.00 11.33 H new ATOM 0 HB3 TYR A 108 2.476 2.104 -14.576 1.00 11.33 H new ATOM 0 HD1 TYR A 108 2.114 2.145 -17.106 1.00 64.30 H new ATOM 0 HD2 TYR A 108 4.798 -0.585 -15.235 1.00 52.42 H new ATOM 0 HE1 TYR A 108 2.067 0.731 -19.110 1.00 55.13 H new ATOM 0 HE2 TYR A 108 4.765 -1.994 -17.246 1.00 64.44 H new ATOM 0 HH TYR A 108 3.974 -2.281 -19.299 1.00 10.11 H new ATOM 1695 N LEU A 109 5.052 3.421 -12.604 1.00 2.02 N ATOM 1696 CA LEU A 109 4.924 3.985 -11.258 1.00 52.14 C ATOM 1697 C LEU A 109 6.290 4.421 -10.693 1.00 4.53 C ATOM 1698 O LEU A 109 6.902 3.705 -9.896 1.00 42.34 O ATOM 1699 CB LEU A 109 4.282 2.936 -10.334 1.00 72.01 C ATOM 1700 CG LEU A 109 2.893 2.441 -10.773 1.00 1.03 C ATOM 1701 CD1 LEU A 109 2.572 1.086 -10.147 1.00 54.43 C ATOM 1702 CD2 LEU A 109 1.820 3.472 -10.422 1.00 2.03 C ATOM 0 H LEU A 109 5.770 2.701 -12.684 1.00 2.02 H new ATOM 0 HA LEU A 109 4.294 4.873 -11.313 1.00 52.14 H new ATOM 0 HB2 LEU A 109 4.951 2.078 -10.264 1.00 72.01 H new ATOM 0 HB3 LEU A 109 4.200 3.358 -9.333 1.00 72.01 H new ATOM 0 HG LEU A 109 2.904 2.314 -11.856 1.00 1.03 H new ATOM 0 HD11 LEU A 109 1.585 0.759 -10.474 1.00 54.43 H new ATOM 0 HD12 LEU A 109 3.318 0.355 -10.459 1.00 54.43 H new ATOM 0 HD13 LEU A 109 2.584 1.175 -9.061 1.00 54.43 H new ATOM 0 HD21 LEU A 109 0.844 3.104 -10.740 1.00 2.03 H new ATOM 0 HD22 LEU A 109 1.812 3.637 -9.345 1.00 2.03 H new ATOM 0 HD23 LEU A 109 2.037 4.411 -10.931 1.00 2.03 H new ATOM 1714 N PRO A 110 6.802 5.592 -11.119 1.00 51.53 N ATOM 1715 CA PRO A 110 8.059 6.144 -10.588 1.00 34.35 C ATOM 1716 C PRO A 110 7.894 6.695 -9.158 1.00 4.14 C ATOM 1717 O PRO A 110 6.805 7.142 -8.782 1.00 34.34 O ATOM 1718 CB PRO A 110 8.393 7.265 -11.580 1.00 44.52 C ATOM 1719 CG PRO A 110 7.074 7.696 -12.123 1.00 75.01 C ATOM 1720 CD PRO A 110 6.210 6.460 -12.158 1.00 71.34 C ATOM 0 HA PRO A 110 8.843 5.391 -10.504 1.00 34.35 H new ATOM 0 HB2 PRO A 110 8.907 8.090 -11.087 1.00 44.52 H new ATOM 0 HB3 PRO A 110 9.050 6.909 -12.373 1.00 44.52 H new ATOM 0 HG2 PRO A 110 6.627 8.466 -11.494 1.00 75.01 H new ATOM 0 HG3 PRO A 110 7.184 8.123 -13.120 1.00 75.01 H new ATOM 0 HD2 PRO A 110 5.168 6.693 -11.939 1.00 71.34 H new ATOM 0 HD3 PRO A 110 6.231 5.984 -13.138 1.00 71.34 H new ATOM 1728 N ASP A 111 8.975 6.670 -8.371 1.00 31.15 N ATOM 1729 CA ASP A 111 8.931 7.102 -6.962 1.00 33.24 C ATOM 1730 C ASP A 111 8.275 8.488 -6.795 1.00 33.14 C ATOM 1731 O ASP A 111 7.576 8.742 -5.810 1.00 72.25 O ATOM 1732 CB ASP A 111 10.342 7.101 -6.361 1.00 32.10 C ATOM 1733 CG ASP A 111 11.280 8.068 -7.061 1.00 32.12 C ATOM 1734 OD1 ASP A 111 11.871 7.692 -8.097 1.00 62.12 O ATOM 1735 OD2 ASP A 111 11.421 9.216 -6.586 1.00 74.34 O ATOM 0 H ASP A 111 9.894 6.356 -8.682 1.00 31.15 H new ATOM 0 HA ASP A 111 8.310 6.386 -6.423 1.00 33.24 H new ATOM 0 HB2 ASP A 111 10.282 7.361 -5.304 1.00 32.10 H new ATOM 0 HB3 ASP A 111 10.756 6.094 -6.419 1.00 32.10 H new ATOM 1740 N GLY A 112 8.496 9.378 -7.763 1.00 4.33 N ATOM 1741 CA GLY A 112 7.858 10.693 -7.742 1.00 33.25 C ATOM 1742 C GLY A 112 6.334 10.606 -7.801 1.00 61.23 C ATOM 1743 O GLY A 112 5.635 11.225 -6.994 1.00 43.41 O ATOM 0 H GLY A 112 9.106 9.214 -8.564 1.00 4.33 H new ATOM 0 HA2 GLY A 112 8.153 11.222 -6.836 1.00 33.25 H new ATOM 0 HA3 GLY A 112 8.218 11.281 -8.586 1.00 33.25 H new ATOM 1747 N LEU A 113 5.820 9.821 -8.747 1.00 43.11 N ATOM 1748 CA LEU A 113 4.374 9.597 -8.874 1.00 22.24 C ATOM 1749 C LEU A 113 3.802 8.967 -7.596 1.00 1.33 C ATOM 1750 O LEU A 113 2.759 9.386 -7.092 1.00 4.13 O ATOM 1751 CB LEU A 113 4.077 8.689 -10.075 1.00 2.15 C ATOM 1752 CG LEU A 113 2.595 8.322 -10.275 1.00 12.14 C ATOM 1753 CD1 LEU A 113 1.758 9.567 -10.554 1.00 24.22 C ATOM 1754 CD2 LEU A 113 2.438 7.302 -11.399 1.00 61.11 C ATOM 0 H LEU A 113 6.382 9.327 -9.440 1.00 43.11 H new ATOM 0 HA LEU A 113 3.897 10.565 -9.029 1.00 22.24 H new ATOM 0 HB2 LEU A 113 4.437 9.181 -10.979 1.00 2.15 H new ATOM 0 HB3 LEU A 113 4.650 7.768 -9.963 1.00 2.15 H new ATOM 0 HG LEU A 113 2.231 7.871 -9.352 1.00 12.14 H new ATOM 0 HD11 LEU A 113 0.715 9.281 -10.692 1.00 24.22 H new ATOM 0 HD12 LEU A 113 1.838 10.255 -9.712 1.00 24.22 H new ATOM 0 HD13 LEU A 113 2.123 10.055 -11.458 1.00 24.22 H new ATOM 0 HD21 LEU A 113 1.383 7.057 -11.523 1.00 61.11 H new ATOM 0 HD22 LEU A 113 2.825 7.722 -12.328 1.00 61.11 H new ATOM 0 HD23 LEU A 113 2.994 6.398 -11.150 1.00 61.11 H new ATOM 1766 N LEU A 114 4.503 7.962 -7.077 1.00 21.44 N ATOM 1767 CA LEU A 114 4.100 7.290 -5.838 1.00 35.45 C ATOM 1768 C LEU A 114 4.021 8.286 -4.668 1.00 33.42 C ATOM 1769 O LEU A 114 3.115 8.214 -3.837 1.00 45.11 O ATOM 1770 CB LEU A 114 5.088 6.159 -5.514 1.00 5.12 C ATOM 1771 CG LEU A 114 5.195 5.064 -6.591 1.00 65.51 C ATOM 1772 CD1 LEU A 114 6.298 4.066 -6.249 1.00 34.30 C ATOM 1773 CD2 LEU A 114 3.853 4.352 -6.776 1.00 22.42 C ATOM 0 H LEU A 114 5.357 7.592 -7.495 1.00 21.44 H new ATOM 0 HA LEU A 114 3.106 6.866 -5.983 1.00 35.45 H new ATOM 0 HB2 LEU A 114 6.076 6.593 -5.358 1.00 5.12 H new ATOM 0 HB3 LEU A 114 4.791 5.695 -4.573 1.00 5.12 H new ATOM 0 HG LEU A 114 5.458 5.543 -7.534 1.00 65.51 H new ATOM 0 HD11 LEU A 114 6.352 3.303 -7.026 1.00 34.30 H new ATOM 0 HD12 LEU A 114 7.253 4.587 -6.185 1.00 34.30 H new ATOM 0 HD13 LEU A 114 6.077 3.594 -5.292 1.00 34.30 H new ATOM 0 HD21 LEU A 114 3.952 3.582 -7.542 1.00 22.42 H new ATOM 0 HD22 LEU A 114 3.553 3.891 -5.835 1.00 22.42 H new ATOM 0 HD23 LEU A 114 3.097 5.075 -7.083 1.00 22.42 H new ATOM 1785 N SER A 115 4.971 9.223 -4.622 1.00 11.21 N ATOM 1786 CA SER A 115 4.972 10.280 -3.599 1.00 33.13 C ATOM 1787 C SER A 115 3.758 11.206 -3.767 1.00 3.14 C ATOM 1788 O SER A 115 3.140 11.627 -2.786 1.00 72.32 O ATOM 1789 CB SER A 115 6.267 11.105 -3.666 1.00 42.32 C ATOM 1790 OG SER A 115 6.344 12.036 -2.594 1.00 41.13 O ATOM 0 H SER A 115 5.750 9.274 -5.279 1.00 11.21 H new ATOM 0 HA SER A 115 4.913 9.796 -2.624 1.00 33.13 H new ATOM 0 HB2 SER A 115 7.128 10.437 -3.633 1.00 42.32 H new ATOM 0 HB3 SER A 115 6.313 11.637 -4.616 1.00 42.32 H new ATOM 0 HG SER A 115 7.179 12.545 -2.662 1.00 41.13 H new ATOM 1796 N ARG A 116 3.422 11.515 -5.022 1.00 41.13 N ATOM 1797 CA ARG A 116 2.231 12.315 -5.338 1.00 74.22 C ATOM 1798 C ARG A 116 0.964 11.661 -4.767 1.00 32.02 C ATOM 1799 O ARG A 116 0.156 12.314 -4.110 1.00 41.24 O ATOM 1800 CB ARG A 116 2.095 12.480 -6.859 1.00 24.11 C ATOM 1801 CG ARG A 116 0.878 13.294 -7.296 1.00 3.13 C ATOM 1802 CD ARG A 116 0.786 13.392 -8.816 1.00 3.05 C ATOM 1803 NE ARG A 116 1.987 13.993 -9.397 1.00 52.20 N ATOM 1804 CZ ARG A 116 2.396 13.789 -10.620 1.00 64.44 C ATOM 1805 NH1 ARG A 116 1.723 13.039 -11.432 1.00 3.21 N ATOM 1806 NH2 ARG A 116 3.482 14.350 -11.038 1.00 34.25 N ATOM 0 H ARG A 116 3.958 11.223 -5.839 1.00 41.13 H new ATOM 0 HA ARG A 116 2.348 13.297 -4.879 1.00 74.22 H new ATOM 0 HB2 ARG A 116 2.995 12.960 -7.243 1.00 24.11 H new ATOM 0 HB3 ARG A 116 2.040 11.492 -7.317 1.00 24.11 H new ATOM 0 HG2 ARG A 116 -0.029 12.833 -6.905 1.00 3.13 H new ATOM 0 HG3 ARG A 116 0.936 14.295 -6.869 1.00 3.13 H new ATOM 0 HD2 ARG A 116 0.638 12.397 -9.236 1.00 3.05 H new ATOM 0 HD3 ARG A 116 -0.086 13.986 -9.090 1.00 3.05 H new ATOM 0 HE ARG A 116 2.542 14.613 -8.807 1.00 52.20 H new ATOM 0 HH11 ARG A 116 0.859 12.597 -11.120 1.00 3.21 H new ATOM 0 HH12 ARG A 116 2.057 12.890 -12.384 1.00 3.21 H new ATOM 0 HH21 ARG A 116 4.019 14.951 -10.413 1.00 34.25 H new ATOM 0 HH22 ARG A 116 3.803 14.192 -11.993 1.00 34.25 H new ATOM 1820 N ILE A 117 0.807 10.363 -5.018 1.00 30.02 N ATOM 1821 CA ILE A 117 -0.324 9.593 -4.487 1.00 4.41 C ATOM 1822 C ILE A 117 -0.444 9.752 -2.960 1.00 74.30 C ATOM 1823 O ILE A 117 -1.525 10.025 -2.428 1.00 24.44 O ATOM 1824 CB ILE A 117 -0.178 8.091 -4.840 1.00 43.14 C ATOM 1825 CG1 ILE A 117 -0.148 7.902 -6.368 1.00 61.04 C ATOM 1826 CG2 ILE A 117 -1.302 7.266 -4.211 1.00 3.24 C ATOM 1827 CD1 ILE A 117 0.068 6.468 -6.807 1.00 75.24 C ATOM 0 H ILE A 117 1.451 9.816 -5.589 1.00 30.02 H new ATOM 0 HA ILE A 117 -1.229 9.986 -4.950 1.00 4.41 H new ATOM 0 HB ILE A 117 0.766 7.733 -4.428 1.00 43.14 H new ATOM 0 HG12 ILE A 117 -1.088 8.262 -6.787 1.00 61.04 H new ATOM 0 HG13 ILE A 117 0.645 8.522 -6.785 1.00 61.04 H new ATOM 0 HG21 ILE A 117 -1.174 6.216 -4.475 1.00 3.24 H new ATOM 0 HG22 ILE A 117 -1.270 7.374 -3.127 1.00 3.24 H new ATOM 0 HG23 ILE A 117 -2.264 7.619 -4.582 1.00 3.24 H new ATOM 0 HD11 ILE A 117 0.077 6.418 -7.896 1.00 75.24 H new ATOM 0 HD12 ILE A 117 1.021 6.109 -6.420 1.00 75.24 H new ATOM 0 HD13 ILE A 117 -0.738 5.844 -6.422 1.00 75.24 H new ATOM 1839 N ILE A 118 0.682 9.599 -2.267 1.00 14.31 N ATOM 1840 CA ILE A 118 0.725 9.741 -0.808 1.00 54.42 C ATOM 1841 C ILE A 118 0.284 11.145 -0.360 1.00 41.32 C ATOM 1842 O ILE A 118 -0.648 11.298 0.430 1.00 45.20 O ATOM 1843 CB ILE A 118 2.153 9.474 -0.266 1.00 32.35 C ATOM 1844 CG1 ILE A 118 2.642 8.084 -0.699 1.00 12.10 C ATOM 1845 CG2 ILE A 118 2.192 9.607 1.259 1.00 34.21 C ATOM 1846 CD1 ILE A 118 4.080 7.789 -0.312 1.00 1.22 C ATOM 0 H ILE A 118 1.582 9.376 -2.692 1.00 14.31 H new ATOM 0 HA ILE A 118 0.032 9.004 -0.402 1.00 54.42 H new ATOM 0 HB ILE A 118 2.822 10.223 -0.689 1.00 32.35 H new ATOM 0 HG12 ILE A 118 1.994 7.328 -0.256 1.00 12.10 H new ATOM 0 HG13 ILE A 118 2.542 7.995 -1.781 1.00 12.10 H new ATOM 0 HG21 ILE A 118 3.204 9.415 1.615 1.00 34.21 H new ATOM 0 HG22 ILE A 118 1.892 10.615 1.544 1.00 34.21 H new ATOM 0 HG23 ILE A 118 1.508 8.885 1.705 1.00 34.21 H new ATOM 0 HD11 ILE A 118 4.351 6.790 -0.652 1.00 1.22 H new ATOM 0 HD12 ILE A 118 4.740 8.522 -0.777 1.00 1.22 H new ATOM 0 HD13 ILE A 118 4.184 7.844 0.772 1.00 1.22 H new ATOM 1858 N HIS A 119 0.946 12.171 -0.886 1.00 73.42 N ATOM 1859 CA HIS A 119 0.723 13.549 -0.430 1.00 13.23 C ATOM 1860 C HIS A 119 -0.651 14.106 -0.845 1.00 64.24 C ATOM 1861 O HIS A 119 -1.274 14.858 -0.093 1.00 24.00 O ATOM 1862 CB HIS A 119 1.852 14.458 -0.931 1.00 34.54 C ATOM 1863 CG HIS A 119 3.157 14.216 -0.230 1.00 34.25 C ATOM 1864 ND1 HIS A 119 3.676 15.079 0.710 1.00 33.31 N ATOM 1865 CD2 HIS A 119 4.045 13.197 -0.325 1.00 35.33 C ATOM 1866 CE1 HIS A 119 4.821 14.608 1.158 1.00 60.42 C ATOM 1867 NE2 HIS A 119 5.069 13.468 0.549 1.00 4.33 N ATOM 0 H HIS A 119 1.641 12.080 -1.627 1.00 73.42 H new ATOM 0 HA HIS A 119 0.728 13.530 0.660 1.00 13.23 H new ATOM 0 HB2 HIS A 119 1.987 14.303 -2.001 1.00 34.54 H new ATOM 0 HB3 HIS A 119 1.560 15.499 -0.794 1.00 34.54 H new ATOM 0 HD2 HIS A 119 3.963 12.333 -0.968 1.00 35.33 H new ATOM 0 HE1 HIS A 119 5.450 15.078 1.900 1.00 60.42 H new ATOM 0 HE2 HIS A 119 5.889 12.881 0.701 1.00 4.33 H new ATOM 1876 N ASP A 120 -1.128 13.730 -2.023 1.00 13.23 N ATOM 1877 CA ASP A 120 -2.386 14.274 -2.554 1.00 12.10 C ATOM 1878 C ASP A 120 -3.634 13.538 -2.034 1.00 4.42 C ATOM 1879 O ASP A 120 -4.659 14.170 -1.772 1.00 11.44 O ATOM 1880 CB ASP A 120 -2.362 14.251 -4.087 1.00 64.33 C ATOM 1881 CG ASP A 120 -1.467 15.335 -4.666 1.00 2.22 C ATOM 1882 OD1 ASP A 120 -0.281 15.402 -4.287 1.00 51.54 O ATOM 1883 OD2 ASP A 120 -1.956 16.143 -5.487 1.00 52.24 O ATOM 0 H ASP A 120 -0.670 13.053 -2.633 1.00 13.23 H new ATOM 0 HA ASP A 120 -2.458 15.301 -2.196 1.00 12.10 H new ATOM 0 HB2 ASP A 120 -2.015 13.276 -4.428 1.00 64.33 H new ATOM 0 HB3 ASP A 120 -3.376 14.379 -4.466 1.00 64.33 H new ATOM 1888 N ARG A 121 -3.563 12.214 -1.885 1.00 41.42 N ATOM 1889 CA ARG A 121 -4.755 11.426 -1.525 1.00 72.04 C ATOM 1890 C ARG A 121 -4.680 10.820 -0.109 1.00 3.34 C ATOM 1891 O ARG A 121 -5.700 10.694 0.566 1.00 43.34 O ATOM 1892 CB ARG A 121 -4.986 10.321 -2.565 1.00 1.23 C ATOM 1893 CG ARG A 121 -5.053 10.848 -3.999 1.00 32.12 C ATOM 1894 CD ARG A 121 -5.486 9.777 -4.992 1.00 62.52 C ATOM 1895 NE ARG A 121 -6.889 9.398 -4.828 1.00 14.44 N ATOM 1896 CZ ARG A 121 -7.613 8.835 -5.760 1.00 24.54 C ATOM 1897 NH1 ARG A 121 -7.107 8.584 -6.928 1.00 31.14 N ATOM 1898 NH2 ARG A 121 -8.846 8.538 -5.525 1.00 70.13 N ATOM 0 H ARG A 121 -2.710 11.667 -2.004 1.00 41.42 H new ATOM 0 HA ARG A 121 -5.599 12.116 -1.521 1.00 72.04 H new ATOM 0 HB2 ARG A 121 -4.183 9.588 -2.491 1.00 1.23 H new ATOM 0 HB3 ARG A 121 -5.915 9.800 -2.332 1.00 1.23 H new ATOM 0 HG2 ARG A 121 -5.751 11.684 -4.044 1.00 32.12 H new ATOM 0 HG3 ARG A 121 -4.075 11.233 -4.288 1.00 32.12 H new ATOM 0 HD2 ARG A 121 -5.327 10.141 -6.007 1.00 62.52 H new ATOM 0 HD3 ARG A 121 -4.858 8.895 -4.868 1.00 62.52 H new ATOM 0 HE ARG A 121 -7.331 9.585 -3.928 1.00 14.44 H new ATOM 0 HH11 ARG A 121 -6.136 8.826 -7.126 1.00 31.14 H new ATOM 0 HH12 ARG A 121 -7.680 8.145 -7.648 1.00 31.14 H new ATOM 0 HH21 ARG A 121 -9.255 8.742 -4.613 1.00 70.13 H new ATOM 0 HH22 ARG A 121 -9.412 8.099 -6.251 1.00 70.13 H new ATOM 1912 N MET A 122 -3.482 10.452 0.344 1.00 72.13 N ATOM 1913 CA MET A 122 -3.321 9.806 1.660 1.00 41.13 C ATOM 1914 C MET A 122 -3.231 10.821 2.815 1.00 1.15 C ATOM 1915 O MET A 122 -3.988 10.735 3.785 1.00 23.30 O ATOM 1916 CB MET A 122 -2.079 8.906 1.667 1.00 73.54 C ATOM 1917 CG MET A 122 -2.204 7.669 0.796 1.00 11.13 C ATOM 1918 SD MET A 122 -0.762 6.594 0.931 1.00 25.10 S ATOM 1919 CE MET A 122 -1.346 5.131 0.081 1.00 44.43 C ATOM 0 H MET A 122 -2.612 10.586 -0.171 1.00 72.13 H new ATOM 0 HA MET A 122 -4.215 9.205 1.822 1.00 41.13 H new ATOM 0 HB2 MET A 122 -1.220 9.488 1.332 1.00 73.54 H new ATOM 0 HB3 MET A 122 -1.874 8.596 2.692 1.00 73.54 H new ATOM 0 HG2 MET A 122 -3.097 7.114 1.082 1.00 11.13 H new ATOM 0 HG3 MET A 122 -2.335 7.970 -0.243 1.00 11.13 H new ATOM 0 HE1 MET A 122 -0.775 4.264 0.414 1.00 44.43 H new ATOM 0 HE2 MET A 122 -2.402 4.978 0.304 1.00 44.43 H new ATOM 0 HE3 MET A 122 -1.217 5.259 -0.994 1.00 44.43 H new ATOM 1929 N ILE A 123 -2.302 11.776 2.706 1.00 13.25 N ATOM 1930 CA ILE A 123 -2.050 12.757 3.779 1.00 50.11 C ATOM 1931 C ILE A 123 -3.341 13.424 4.313 1.00 11.24 C ATOM 1932 O ILE A 123 -3.550 13.460 5.529 1.00 51.22 O ATOM 1933 CB ILE A 123 -1.039 13.848 3.326 1.00 23.43 C ATOM 1934 CG1 ILE A 123 0.320 13.215 2.978 1.00 62.54 C ATOM 1935 CG2 ILE A 123 -0.872 14.927 4.396 1.00 44.22 C ATOM 1936 CD1 ILE A 123 0.990 12.484 4.127 1.00 42.31 C ATOM 0 H ILE A 123 -1.708 11.895 1.885 1.00 13.25 H new ATOM 0 HA ILE A 123 -1.618 12.186 4.601 1.00 50.11 H new ATOM 0 HB ILE A 123 -1.439 14.324 2.431 1.00 23.43 H new ATOM 0 HG12 ILE A 123 0.180 12.517 2.153 1.00 62.54 H new ATOM 0 HG13 ILE A 123 0.990 13.998 2.623 1.00 62.54 H new ATOM 0 HG21 ILE A 123 -0.159 15.675 4.050 1.00 44.22 H new ATOM 0 HG22 ILE A 123 -1.834 15.403 4.586 1.00 44.22 H new ATOM 0 HG23 ILE A 123 -0.504 14.473 5.316 1.00 44.22 H new ATOM 0 HD11 ILE A 123 1.941 12.071 3.790 1.00 42.31 H new ATOM 0 HD12 ILE A 123 1.167 13.180 4.947 1.00 42.31 H new ATOM 0 HD13 ILE A 123 0.344 11.676 4.470 1.00 42.31 H new ATOM 1948 N PRO A 124 -4.230 13.965 3.436 1.00 65.23 N ATOM 1949 CA PRO A 124 -5.503 14.572 3.878 1.00 43.41 C ATOM 1950 C PRO A 124 -6.325 13.641 4.790 1.00 34.32 C ATOM 1951 O PRO A 124 -6.815 14.059 5.843 1.00 12.23 O ATOM 1952 CB PRO A 124 -6.255 14.856 2.559 1.00 31.34 C ATOM 1953 CG PRO A 124 -5.505 14.109 1.500 1.00 3.11 C ATOM 1954 CD PRO A 124 -4.082 14.049 1.970 1.00 52.04 C ATOM 0 HA PRO A 124 -5.332 15.464 4.480 1.00 43.41 H new ATOM 0 HB2 PRO A 124 -7.290 14.520 2.618 1.00 31.34 H new ATOM 0 HB3 PRO A 124 -6.279 15.924 2.343 1.00 31.34 H new ATOM 0 HG2 PRO A 124 -5.914 13.108 1.364 1.00 3.11 H new ATOM 0 HG3 PRO A 124 -5.578 14.616 0.538 1.00 3.11 H new ATOM 0 HD2 PRO A 124 -3.558 13.183 1.565 1.00 52.04 H new ATOM 0 HD3 PRO A 124 -3.518 14.932 1.669 1.00 52.04 H new ATOM 1962 N HIS A 125 -6.454 12.373 4.395 1.00 74.12 N ATOM 1963 CA HIS A 125 -7.194 11.386 5.193 1.00 62.14 C ATOM 1964 C HIS A 125 -6.451 11.025 6.489 1.00 30.35 C ATOM 1965 O HIS A 125 -7.069 10.894 7.544 1.00 64.22 O ATOM 1966 CB HIS A 125 -7.480 10.122 4.371 1.00 62.32 C ATOM 1967 CG HIS A 125 -8.621 10.276 3.409 1.00 22.43 C ATOM 1968 ND1 HIS A 125 -9.925 10.162 3.826 1.00 72.33 N ATOM 1969 CD2 HIS A 125 -8.606 10.526 2.077 1.00 33.10 C ATOM 1970 CE1 HIS A 125 -10.668 10.342 2.750 1.00 24.12 C ATOM 1971 NE2 HIS A 125 -9.915 10.565 1.666 1.00 73.31 N ATOM 0 H HIS A 125 -6.058 12.003 3.531 1.00 74.12 H new ATOM 0 HA HIS A 125 -8.143 11.844 5.472 1.00 62.14 H new ATOM 0 HB2 HIS A 125 -6.582 9.849 3.816 1.00 62.32 H new ATOM 0 HB3 HIS A 125 -7.698 9.298 5.051 1.00 62.32 H new ATOM 0 HD2 HIS A 125 -7.732 10.667 1.458 1.00 33.10 H new ATOM 0 HE1 HIS A 125 -11.748 10.313 2.745 1.00 24.12 H new ATOM 0 HE2 HIS A 125 -10.250 10.732 0.717 1.00 73.31 H new ATOM 1979 N PHE A 126 -5.129 10.871 6.413 1.00 62.32 N ATOM 1980 CA PHE A 126 -4.317 10.587 7.605 1.00 74.42 C ATOM 1981 C PHE A 126 -4.477 11.689 8.665 1.00 31.22 C ATOM 1982 O PHE A 126 -4.577 11.410 9.861 1.00 13.03 O ATOM 1983 CB PHE A 126 -2.835 10.427 7.232 1.00 73.42 C ATOM 1984 CG PHE A 126 -2.528 9.203 6.400 1.00 72.11 C ATOM 1985 CD1 PHE A 126 -3.428 8.146 6.313 1.00 11.43 C ATOM 1986 CD2 PHE A 126 -1.328 9.108 5.708 1.00 21.33 C ATOM 1987 CE1 PHE A 126 -3.136 7.028 5.555 1.00 12.40 C ATOM 1988 CE2 PHE A 126 -1.033 7.991 4.951 1.00 5.02 C ATOM 1989 CZ PHE A 126 -1.938 6.951 4.875 1.00 10.41 C ATOM 0 H PHE A 126 -4.596 10.937 5.546 1.00 62.32 H new ATOM 0 HA PHE A 126 -4.676 9.649 8.029 1.00 74.42 H new ATOM 0 HB2 PHE A 126 -2.513 11.313 6.685 1.00 73.42 H new ATOM 0 HB3 PHE A 126 -2.245 10.386 8.148 1.00 73.42 H new ATOM 0 HD1 PHE A 126 -4.367 8.200 6.844 1.00 11.43 H new ATOM 0 HD2 PHE A 126 -0.616 9.918 5.762 1.00 21.33 H new ATOM 0 HE1 PHE A 126 -3.845 6.215 5.495 1.00 12.40 H new ATOM 0 HE2 PHE A 126 -0.095 7.931 4.419 1.00 5.02 H new ATOM 0 HZ PHE A 126 -1.708 6.077 4.283 1.00 10.41 H new ATOM 1999 N ARG A 127 -4.505 12.942 8.214 1.00 51.04 N ATOM 2000 CA ARG A 127 -4.737 14.081 9.108 1.00 51.44 C ATOM 2001 C ARG A 127 -6.195 14.102 9.599 1.00 42.15 C ATOM 2002 O ARG A 127 -6.470 14.402 10.762 1.00 4.11 O ATOM 2003 CB ARG A 127 -4.409 15.398 8.388 1.00 41.01 C ATOM 2004 CG ARG A 127 -2.974 15.486 7.879 1.00 30.22 C ATOM 2005 CD ARG A 127 -2.690 16.830 7.213 1.00 64.43 C ATOM 2006 NE ARG A 127 -2.814 17.942 8.152 1.00 50.24 N ATOM 2007 CZ ARG A 127 -2.774 19.204 7.816 1.00 24.25 C ATOM 2008 NH1 ARG A 127 -2.649 19.557 6.577 1.00 72.34 N ATOM 2009 NH2 ARG A 127 -2.863 20.118 8.725 1.00 31.31 N ATOM 0 H ARG A 127 -4.370 13.197 7.236 1.00 51.04 H new ATOM 0 HA ARG A 127 -4.081 13.974 9.972 1.00 51.44 H new ATOM 0 HB2 ARG A 127 -5.090 15.519 7.546 1.00 41.01 H new ATOM 0 HB3 ARG A 127 -4.594 16.228 9.069 1.00 41.01 H new ATOM 0 HG2 ARG A 127 -2.284 15.339 8.710 1.00 30.22 H new ATOM 0 HG3 ARG A 127 -2.791 14.681 7.167 1.00 30.22 H new ATOM 0 HD2 ARG A 127 -1.685 16.821 6.792 1.00 64.43 H new ATOM 0 HD3 ARG A 127 -3.381 16.977 6.383 1.00 64.43 H new ATOM 0 HE ARG A 127 -2.941 17.718 9.139 1.00 50.24 H new ATOM 0 HH11 ARG A 127 -2.580 18.846 5.849 1.00 72.34 H new ATOM 0 HH12 ARG A 127 -2.619 20.546 6.329 1.00 72.34 H new ATOM 0 HH21 ARG A 127 -2.964 19.854 9.705 1.00 31.31 H new ATOM 0 HH22 ARG A 127 -2.832 21.103 8.462 1.00 31.31 H new ATOM 2023 N SER A 128 -7.122 13.776 8.700 1.00 10.22 N ATOM 2024 CA SER A 128 -8.554 13.711 9.032 1.00 32.33 C ATOM 2025 C SER A 128 -8.863 12.536 9.977 1.00 73.44 C ATOM 2026 O SER A 128 -9.872 12.543 10.686 1.00 3.54 O ATOM 2027 CB SER A 128 -9.389 13.583 7.748 1.00 61.44 C ATOM 2028 OG SER A 128 -10.782 13.595 8.026 1.00 13.32 O ATOM 0 H SER A 128 -6.910 13.550 7.728 1.00 10.22 H new ATOM 0 HA SER A 128 -8.818 14.635 9.547 1.00 32.33 H new ATOM 0 HB2 SER A 128 -9.145 14.403 7.072 1.00 61.44 H new ATOM 0 HB3 SER A 128 -9.128 12.658 7.234 1.00 61.44 H new ATOM 0 HG SER A 128 -11.284 13.513 7.188 1.00 13.32 H new ATOM 2034 N GLY A 129 -7.986 11.530 9.985 1.00 43.13 N ATOM 2035 CA GLY A 129 -8.163 10.366 10.858 1.00 72.23 C ATOM 2036 C GLY A 129 -8.443 9.072 10.093 1.00 54.33 C ATOM 2037 O GLY A 129 -8.421 7.980 10.668 1.00 3.33 O ATOM 0 H GLY A 129 -7.151 11.497 9.401 1.00 43.13 H new ATOM 0 HA2 GLY A 129 -7.266 10.235 11.463 1.00 72.23 H new ATOM 0 HA3 GLY A 129 -8.986 10.558 11.546 1.00 72.23 H new ATOM 2041 N ASN A 130 -8.697 9.190 8.794 1.00 34.45 N ATOM 2042 CA ASN A 130 -9.023 8.034 7.957 1.00 63.20 C ATOM 2043 C ASN A 130 -7.758 7.337 7.433 1.00 11.43 C ATOM 2044 O ASN A 130 -7.378 7.513 6.276 1.00 34.12 O ATOM 2045 CB ASN A 130 -9.881 8.463 6.764 1.00 62.05 C ATOM 2046 CG ASN A 130 -11.164 9.161 7.161 1.00 3.14 C ATOM 2047 OD1 ASN A 130 -11.730 8.906 8.217 1.00 52.20 O ATOM 2048 ND2 ASN A 130 -11.639 10.040 6.305 1.00 52.30 N ATOM 0 H ASN A 130 -8.684 10.078 8.293 1.00 34.45 H new ATOM 0 HA ASN A 130 -9.576 7.332 8.582 1.00 63.20 H new ATOM 0 HB2 ASN A 130 -9.297 9.128 6.128 1.00 62.05 H new ATOM 0 HB3 ASN A 130 -10.125 7.584 6.168 1.00 62.05 H new ATOM 0 HD21 ASN A 130 -12.507 10.535 6.511 1.00 52.30 H new ATOM 0 HD22 ASN A 130 -11.140 10.226 5.435 1.00 52.30 H new ATOM 2055 N TYR A 131 -7.100 6.556 8.282 1.00 61.21 N ATOM 2056 CA TYR A 131 -5.932 5.781 7.845 1.00 63.43 C ATOM 2057 C TYR A 131 -6.323 4.760 6.764 1.00 65.20 C ATOM 2058 O TYR A 131 -5.616 4.580 5.773 1.00 22.14 O ATOM 2059 CB TYR A 131 -5.284 5.062 9.032 1.00 40.21 C ATOM 2060 CG TYR A 131 -4.735 6.000 10.092 1.00 34.02 C ATOM 2061 CD1 TYR A 131 -5.540 6.455 11.131 1.00 1.22 C ATOM 2062 CD2 TYR A 131 -3.410 6.425 10.055 1.00 63.11 C ATOM 2063 CE1 TYR A 131 -5.041 7.304 12.099 1.00 1.45 C ATOM 2064 CE2 TYR A 131 -2.906 7.274 11.021 1.00 43.13 C ATOM 2065 CZ TYR A 131 -3.726 7.709 12.040 1.00 24.44 C ATOM 2066 OH TYR A 131 -3.226 8.551 13.008 1.00 61.43 O ATOM 0 H TYR A 131 -7.346 6.439 9.265 1.00 61.21 H new ATOM 0 HA TYR A 131 -5.210 6.478 7.420 1.00 63.43 H new ATOM 0 HB2 TYR A 131 -6.020 4.402 9.491 1.00 40.21 H new ATOM 0 HB3 TYR A 131 -4.475 4.431 8.665 1.00 40.21 H new ATOM 0 HD1 TYR A 131 -6.572 6.139 11.181 1.00 1.22 H new ATOM 0 HD2 TYR A 131 -2.765 6.085 9.258 1.00 63.11 H new ATOM 0 HE1 TYR A 131 -5.679 7.649 12.899 1.00 1.45 H new ATOM 0 HE2 TYR A 131 -1.876 7.595 10.978 1.00 43.13 H new ATOM 0 HH TYR A 131 -2.593 8.061 13.573 1.00 61.43 H new ATOM 2076 N ALA A 132 -7.466 4.107 6.965 1.00 60.12 N ATOM 2077 CA ALA A 132 -7.980 3.122 6.010 1.00 12.32 C ATOM 2078 C ALA A 132 -8.352 3.765 4.664 1.00 64.14 C ATOM 2079 O ALA A 132 -8.004 3.251 3.599 1.00 23.20 O ATOM 2080 CB ALA A 132 -9.187 2.405 6.601 1.00 50.13 C ATOM 0 H ALA A 132 -8.058 4.242 7.785 1.00 60.12 H new ATOM 0 HA ALA A 132 -7.185 2.401 5.819 1.00 12.32 H new ATOM 0 HB1 ALA A 132 -9.563 1.675 5.885 1.00 50.13 H new ATOM 0 HB2 ALA A 132 -8.894 1.895 7.519 1.00 50.13 H new ATOM 0 HB3 ALA A 132 -9.969 3.131 6.823 1.00 50.13 H new ATOM 2086 N GLU A 133 -9.059 4.894 4.719 1.00 72.42 N ATOM 2087 CA GLU A 133 -9.479 5.601 3.502 1.00 34.40 C ATOM 2088 C GLU A 133 -8.284 6.206 2.751 1.00 24.13 C ATOM 2089 O GLU A 133 -8.293 6.285 1.523 1.00 20.14 O ATOM 2090 CB GLU A 133 -10.517 6.679 3.839 1.00 61.34 C ATOM 2091 CG GLU A 133 -11.857 6.107 4.296 1.00 3.35 C ATOM 2092 CD GLU A 133 -12.491 5.195 3.252 1.00 24.51 C ATOM 2093 OE1 GLU A 133 -13.190 5.708 2.353 1.00 3.11 O ATOM 2094 OE2 GLU A 133 -12.285 3.966 3.318 1.00 12.20 O ATOM 0 H GLU A 133 -9.353 5.340 5.588 1.00 72.42 H new ATOM 0 HA GLU A 133 -9.939 4.870 2.838 1.00 34.40 H new ATOM 0 HB2 GLU A 133 -10.119 7.324 4.623 1.00 61.34 H new ATOM 0 HB3 GLU A 133 -10.678 7.305 2.962 1.00 61.34 H new ATOM 0 HG2 GLU A 133 -11.713 5.549 5.221 1.00 3.35 H new ATOM 0 HG3 GLU A 133 -12.540 6.926 4.521 1.00 3.35 H new ATOM 2101 N GLY A 134 -7.255 6.620 3.487 1.00 20.54 N ATOM 2102 CA GLY A 134 -6.015 7.051 2.847 1.00 15.12 C ATOM 2103 C GLY A 134 -5.399 5.940 2.002 1.00 13.33 C ATOM 2104 O GLY A 134 -4.981 6.160 0.862 1.00 21.34 O ATOM 0 H GLY A 134 -7.253 6.666 4.506 1.00 20.54 H new ATOM 0 HA2 GLY A 134 -6.213 7.919 2.218 1.00 15.12 H new ATOM 0 HA3 GLY A 134 -5.302 7.366 3.609 1.00 15.12 H new ATOM 2108 N LEU A 135 -5.363 4.731 2.563 1.00 62.04 N ATOM 2109 CA LEU A 135 -4.867 3.556 1.844 1.00 22.34 C ATOM 2110 C LEU A 135 -5.773 3.185 0.659 1.00 25.32 C ATOM 2111 O LEU A 135 -5.285 2.893 -0.429 1.00 63.12 O ATOM 2112 CB LEU A 135 -4.743 2.359 2.796 1.00 54.22 C ATOM 2113 CG LEU A 135 -3.724 2.526 3.933 1.00 51.54 C ATOM 2114 CD1 LEU A 135 -3.718 1.296 4.833 1.00 22.22 C ATOM 2115 CD2 LEU A 135 -2.327 2.797 3.373 1.00 4.44 C ATOM 0 H LEU A 135 -5.672 4.539 3.516 1.00 62.04 H new ATOM 0 HA LEU A 135 -3.883 3.810 1.449 1.00 22.34 H new ATOM 0 HB2 LEU A 135 -5.722 2.161 3.234 1.00 54.22 H new ATOM 0 HB3 LEU A 135 -4.471 1.479 2.213 1.00 54.22 H new ATOM 0 HG LEU A 135 -4.020 3.386 4.534 1.00 51.54 H new ATOM 0 HD11 LEU A 135 -2.990 1.434 5.632 1.00 22.22 H new ATOM 0 HD12 LEU A 135 -4.709 1.156 5.265 1.00 22.22 H new ATOM 0 HD13 LEU A 135 -3.451 0.417 4.246 1.00 22.22 H new ATOM 0 HD21 LEU A 135 -1.621 2.912 4.196 1.00 4.44 H new ATOM 0 HD22 LEU A 135 -2.019 1.962 2.744 1.00 4.44 H new ATOM 0 HD23 LEU A 135 -2.344 3.711 2.779 1.00 4.44 H new ATOM 2127 N SER A 136 -7.093 3.196 0.871 1.00 72.23 N ATOM 2128 CA SER A 136 -8.045 2.839 -0.198 1.00 61.04 C ATOM 2129 C SER A 136 -7.947 3.817 -1.378 1.00 21.23 C ATOM 2130 O SER A 136 -8.031 3.411 -2.541 1.00 61.35 O ATOM 2131 CB SER A 136 -9.488 2.783 0.332 1.00 0.00 C ATOM 2132 OG SER A 136 -9.923 4.038 0.824 1.00 44.34 O ATOM 0 H SER A 136 -7.527 3.444 1.760 1.00 72.23 H new ATOM 0 HA SER A 136 -7.775 1.845 -0.553 1.00 61.04 H new ATOM 0 HB2 SER A 136 -10.155 2.456 -0.466 1.00 0.00 H new ATOM 0 HB3 SER A 136 -9.553 2.040 1.127 1.00 0.00 H new ATOM 0 HG SER A 136 -9.147 4.616 0.978 1.00 44.34 H new ATOM 2138 N GLU A 137 -7.762 5.100 -1.073 1.00 55.04 N ATOM 2139 CA GLU A 137 -7.514 6.120 -2.101 1.00 62.45 C ATOM 2140 C GLU A 137 -6.168 5.894 -2.801 1.00 13.50 C ATOM 2141 O GLU A 137 -6.059 6.039 -4.020 1.00 40.52 O ATOM 2142 CB GLU A 137 -7.562 7.526 -1.485 1.00 52.30 C ATOM 2143 CG GLU A 137 -8.974 7.998 -1.158 1.00 32.32 C ATOM 2144 CD GLU A 137 -9.815 8.217 -2.407 1.00 51.32 C ATOM 2145 OE1 GLU A 137 -9.713 9.305 -3.011 1.00 2.22 O ATOM 2146 OE2 GLU A 137 -10.577 7.307 -2.799 1.00 62.13 O ATOM 0 H GLU A 137 -7.779 5.463 -0.120 1.00 55.04 H new ATOM 0 HA GLU A 137 -8.301 6.034 -2.850 1.00 62.45 H new ATOM 0 HB2 GLU A 137 -6.964 7.536 -0.574 1.00 52.30 H new ATOM 0 HB3 GLU A 137 -7.102 8.233 -2.176 1.00 52.30 H new ATOM 0 HG2 GLU A 137 -9.462 7.262 -0.519 1.00 32.32 H new ATOM 0 HG3 GLU A 137 -8.922 8.927 -0.591 1.00 32.32 H new ATOM 2153 N GLY A 138 -5.143 5.540 -2.027 1.00 23.34 N ATOM 2154 CA GLY A 138 -3.846 5.210 -2.608 1.00 23.31 C ATOM 2155 C GLY A 138 -3.919 4.028 -3.572 1.00 53.20 C ATOM 2156 O GLY A 138 -3.410 4.094 -4.694 1.00 32.53 O ATOM 0 H GLY A 138 -5.185 5.475 -1.010 1.00 23.34 H new ATOM 0 HA2 GLY A 138 -3.456 6.081 -3.135 1.00 23.31 H new ATOM 0 HA3 GLY A 138 -3.142 4.979 -1.809 1.00 23.31 H new ATOM 2160 N VAL A 139 -4.564 2.949 -3.131 1.00 63.12 N ATOM 2161 CA VAL A 139 -4.802 1.773 -3.975 1.00 75.42 C ATOM 2162 C VAL A 139 -5.552 2.157 -5.256 1.00 3.54 C ATOM 2163 O VAL A 139 -5.178 1.751 -6.356 1.00 10.44 O ATOM 2164 CB VAL A 139 -5.623 0.699 -3.216 1.00 3.04 C ATOM 2165 CG1 VAL A 139 -5.974 -0.477 -4.125 1.00 42.40 C ATOM 2166 CG2 VAL A 139 -4.869 0.215 -1.978 1.00 1.25 C ATOM 0 H VAL A 139 -4.935 2.863 -2.185 1.00 63.12 H new ATOM 0 HA VAL A 139 -3.826 1.364 -4.236 1.00 75.42 H new ATOM 0 HB VAL A 139 -6.555 1.162 -2.893 1.00 3.04 H new ATOM 0 HG11 VAL A 139 -6.550 -1.212 -3.563 1.00 42.40 H new ATOM 0 HG12 VAL A 139 -6.566 -0.121 -4.968 1.00 42.40 H new ATOM 0 HG13 VAL A 139 -5.058 -0.938 -4.494 1.00 42.40 H new ATOM 0 HG21 VAL A 139 -5.464 -0.538 -1.461 1.00 1.25 H new ATOM 0 HG22 VAL A 139 -3.916 -0.219 -2.279 1.00 1.25 H new ATOM 0 HG23 VAL A 139 -4.689 1.057 -1.309 1.00 1.25 H new ATOM 2176 N LEU A 140 -6.612 2.945 -5.094 1.00 30.14 N ATOM 2177 CA LEU A 140 -7.408 3.418 -6.226 1.00 64.52 C ATOM 2178 C LEU A 140 -6.550 4.245 -7.198 1.00 35.13 C ATOM 2179 O LEU A 140 -6.684 4.127 -8.414 1.00 72.13 O ATOM 2180 CB LEU A 140 -8.594 4.253 -5.722 1.00 43.13 C ATOM 2181 CG LEU A 140 -9.575 4.732 -6.805 1.00 4.42 C ATOM 2182 CD1 LEU A 140 -10.159 3.548 -7.573 1.00 11.14 C ATOM 2183 CD2 LEU A 140 -10.685 5.573 -6.184 1.00 45.33 C ATOM 0 H LEU A 140 -6.942 3.271 -4.186 1.00 30.14 H new ATOM 0 HA LEU A 140 -7.786 2.549 -6.765 1.00 64.52 H new ATOM 0 HB2 LEU A 140 -9.147 3.663 -4.991 1.00 43.13 H new ATOM 0 HB3 LEU A 140 -8.205 5.126 -5.198 1.00 43.13 H new ATOM 0 HG LEU A 140 -9.026 5.354 -7.512 1.00 4.42 H new ATOM 0 HD11 LEU A 140 -10.850 3.913 -8.333 1.00 11.14 H new ATOM 0 HD12 LEU A 140 -9.353 2.992 -8.052 1.00 11.14 H new ATOM 0 HD13 LEU A 140 -10.691 2.894 -6.883 1.00 11.14 H new ATOM 0 HD21 LEU A 140 -11.371 5.904 -6.964 1.00 45.33 H new ATOM 0 HD22 LEU A 140 -11.229 4.975 -5.453 1.00 45.33 H new ATOM 0 HD23 LEU A 140 -10.250 6.442 -5.690 1.00 45.33 H new ATOM 2195 N ALA A 141 -5.661 5.070 -6.649 1.00 53.04 N ATOM 2196 CA ALA A 141 -4.765 5.899 -7.464 1.00 23.15 C ATOM 2197 C ALA A 141 -3.837 5.037 -8.336 1.00 35.00 C ATOM 2198 O ALA A 141 -3.753 5.228 -9.551 1.00 2.41 O ATOM 2199 CB ALA A 141 -3.949 6.828 -6.572 1.00 1.23 C ATOM 0 H ALA A 141 -5.539 5.185 -5.643 1.00 53.04 H new ATOM 0 HA ALA A 141 -5.381 6.501 -8.132 1.00 23.15 H new ATOM 0 HB1 ALA A 141 -3.289 7.437 -7.189 1.00 1.23 H new ATOM 0 HB2 ALA A 141 -4.621 7.476 -6.010 1.00 1.23 H new ATOM 0 HB3 ALA A 141 -3.353 6.235 -5.878 1.00 1.23 H new ATOM 2205 N VAL A 142 -3.144 4.085 -7.709 1.00 71.12 N ATOM 2206 CA VAL A 142 -2.272 3.157 -8.438 1.00 54.23 C ATOM 2207 C VAL A 142 -3.066 2.366 -9.487 1.00 55.15 C ATOM 2208 O VAL A 142 -2.633 2.214 -10.633 1.00 71.51 O ATOM 2209 CB VAL A 142 -1.568 2.168 -7.476 1.00 11.52 C ATOM 2210 CG1 VAL A 142 -0.682 1.188 -8.246 1.00 53.31 C ATOM 2211 CG2 VAL A 142 -0.756 2.926 -6.426 1.00 0.04 C ATOM 0 H VAL A 142 -3.168 3.935 -6.700 1.00 71.12 H new ATOM 0 HA VAL A 142 -1.514 3.759 -8.939 1.00 54.23 H new ATOM 0 HB VAL A 142 -2.337 1.590 -6.963 1.00 11.52 H new ATOM 0 HG11 VAL A 142 -0.200 0.506 -7.546 1.00 53.31 H new ATOM 0 HG12 VAL A 142 -1.293 0.618 -8.946 1.00 53.31 H new ATOM 0 HG13 VAL A 142 0.080 1.741 -8.796 1.00 53.31 H new ATOM 0 HG21 VAL A 142 -0.269 2.214 -5.759 1.00 0.04 H new ATOM 0 HG22 VAL A 142 -0.000 3.536 -6.921 1.00 0.04 H new ATOM 0 HG23 VAL A 142 -1.419 3.569 -5.848 1.00 0.04 H new ATOM 2221 N GLN A 143 -4.236 1.865 -9.082 1.00 72.42 N ATOM 2222 CA GLN A 143 -5.142 1.169 -10.001 1.00 42.41 C ATOM 2223 C GLN A 143 -5.471 2.041 -11.226 1.00 3.11 C ATOM 2224 O GLN A 143 -5.388 1.582 -12.364 1.00 23.43 O ATOM 2225 CB GLN A 143 -6.440 0.771 -9.278 1.00 53.42 C ATOM 2226 CG GLN A 143 -7.427 0.018 -10.168 1.00 1.24 C ATOM 2227 CD GLN A 143 -8.704 -0.393 -9.453 1.00 53.14 C ATOM 2228 OE1 GLN A 143 -9.163 0.267 -8.525 1.00 13.11 O ATOM 2229 NE2 GLN A 143 -9.295 -1.487 -9.887 1.00 25.11 N ATOM 0 H GLN A 143 -4.579 1.928 -8.123 1.00 72.42 H new ATOM 0 HA GLN A 143 -4.636 0.268 -10.348 1.00 42.41 H new ATOM 0 HB2 GLN A 143 -6.191 0.149 -8.418 1.00 53.42 H new ATOM 0 HB3 GLN A 143 -6.922 1.670 -8.893 1.00 53.42 H new ATOM 0 HG2 GLN A 143 -7.685 0.645 -11.021 1.00 1.24 H new ATOM 0 HG3 GLN A 143 -6.939 -0.873 -10.563 1.00 1.24 H new ATOM 0 HE21 GLN A 143 -8.889 -2.014 -10.660 1.00 25.11 H new ATOM 0 HE22 GLN A 143 -10.159 -1.808 -9.450 1.00 25.11 H new ATOM 2238 N GLN A 144 -5.824 3.302 -10.978 1.00 32.04 N ATOM 2239 CA GLN A 144 -6.144 4.254 -12.051 1.00 44.44 C ATOM 2240 C GLN A 144 -4.987 4.393 -13.053 1.00 23.12 C ATOM 2241 O GLN A 144 -5.201 4.376 -14.270 1.00 74.11 O ATOM 2242 CB GLN A 144 -6.493 5.628 -11.455 1.00 44.12 C ATOM 2243 CG GLN A 144 -7.841 5.668 -10.745 1.00 2.51 C ATOM 2244 CD GLN A 144 -8.126 7.004 -10.076 1.00 32.31 C ATOM 2245 OE1 GLN A 144 -7.221 7.689 -9.601 1.00 22.15 O ATOM 2246 NE2 GLN A 144 -9.382 7.392 -10.041 1.00 43.11 N ATOM 0 H GLN A 144 -5.897 3.693 -10.039 1.00 32.04 H new ATOM 0 HA GLN A 144 -7.007 3.864 -12.591 1.00 44.44 H new ATOM 0 HB2 GLN A 144 -5.713 5.916 -10.750 1.00 44.12 H new ATOM 0 HB3 GLN A 144 -6.491 6.370 -12.253 1.00 44.12 H new ATOM 0 HG2 GLN A 144 -8.630 5.454 -11.465 1.00 2.51 H new ATOM 0 HG3 GLN A 144 -7.872 4.879 -9.994 1.00 2.51 H new ATOM 0 HE21 GLN A 144 -10.110 6.801 -10.444 1.00 43.11 H new ATOM 0 HE22 GLN A 144 -9.629 8.284 -9.611 1.00 43.11 H new ATOM 2255 N VAL A 145 -3.765 4.529 -12.539 1.00 3.41 N ATOM 2256 CA VAL A 145 -2.573 4.630 -13.394 1.00 0.24 C ATOM 2257 C VAL A 145 -2.447 3.409 -14.324 1.00 1.02 C ATOM 2258 O VAL A 145 -2.176 3.543 -15.523 1.00 73.10 O ATOM 2259 CB VAL A 145 -1.279 4.762 -12.549 1.00 5.21 C ATOM 2260 CG1 VAL A 145 -0.046 4.871 -13.447 1.00 44.11 C ATOM 2261 CG2 VAL A 145 -1.370 5.961 -11.606 1.00 3.33 C ATOM 0 H VAL A 145 -3.570 4.572 -11.539 1.00 3.41 H new ATOM 0 HA VAL A 145 -2.695 5.529 -13.999 1.00 0.24 H new ATOM 0 HB VAL A 145 -1.177 3.860 -11.946 1.00 5.21 H new ATOM 0 HG11 VAL A 145 0.847 4.962 -12.829 1.00 44.11 H new ATOM 0 HG12 VAL A 145 0.032 3.978 -14.068 1.00 44.11 H new ATOM 0 HG13 VAL A 145 -0.137 5.750 -14.085 1.00 44.11 H new ATOM 0 HG21 VAL A 145 -0.452 6.035 -11.023 1.00 3.33 H new ATOM 0 HG22 VAL A 145 -1.505 6.872 -12.188 1.00 3.33 H new ATOM 0 HG23 VAL A 145 -2.218 5.831 -10.933 1.00 3.33 H new ATOM 2271 N LEU A 146 -2.656 2.220 -13.762 1.00 65.43 N ATOM 2272 CA LEU A 146 -2.607 0.975 -14.533 1.00 61.23 C ATOM 2273 C LEU A 146 -3.763 0.889 -15.544 1.00 11.44 C ATOM 2274 O LEU A 146 -3.553 0.544 -16.706 1.00 22.11 O ATOM 2275 CB LEU A 146 -2.630 -0.231 -13.585 1.00 71.21 C ATOM 2276 CG LEU A 146 -1.415 -0.338 -12.646 1.00 64.32 C ATOM 2277 CD1 LEU A 146 -1.605 -1.472 -11.645 1.00 65.54 C ATOM 2278 CD2 LEU A 146 -0.124 -0.528 -13.448 1.00 75.24 C ATOM 0 H LEU A 146 -2.862 2.090 -12.771 1.00 65.43 H new ATOM 0 HA LEU A 146 -1.676 0.966 -15.100 1.00 61.23 H new ATOM 0 HB2 LEU A 146 -3.536 -0.183 -12.980 1.00 71.21 H new ATOM 0 HB3 LEU A 146 -2.693 -1.142 -14.180 1.00 71.21 H new ATOM 0 HG LEU A 146 -1.332 0.595 -12.089 1.00 64.32 H new ATOM 0 HD11 LEU A 146 -0.735 -1.530 -10.991 1.00 65.54 H new ATOM 0 HD12 LEU A 146 -2.496 -1.284 -11.047 1.00 65.54 H new ATOM 0 HD13 LEU A 146 -1.720 -2.414 -12.180 1.00 65.54 H new ATOM 0 HD21 LEU A 146 0.722 -0.601 -12.764 1.00 75.24 H new ATOM 0 HD22 LEU A 146 -0.193 -1.442 -14.038 1.00 75.24 H new ATOM 0 HD23 LEU A 146 0.020 0.324 -14.113 1.00 75.24 H new ATOM 2290 N ASP A 147 -4.982 1.217 -15.106 1.00 2.20 N ATOM 2291 CA ASP A 147 -6.149 1.236 -16.000 1.00 71.13 C ATOM 2292 C ASP A 147 -5.982 2.264 -17.132 1.00 52.55 C ATOM 2293 O ASP A 147 -6.626 2.164 -18.173 1.00 31.12 O ATOM 2294 CB ASP A 147 -7.436 1.533 -15.217 1.00 63.10 C ATOM 2295 CG ASP A 147 -7.876 0.374 -14.341 1.00 41.22 C ATOM 2296 OD1 ASP A 147 -7.830 -0.784 -14.810 1.00 3.31 O ATOM 2297 OD2 ASP A 147 -8.296 0.614 -13.194 1.00 15.04 O ATOM 0 H ASP A 147 -5.189 1.473 -14.140 1.00 2.20 H new ATOM 0 HA ASP A 147 -6.224 0.244 -16.446 1.00 71.13 H new ATOM 0 HB2 ASP A 147 -7.281 2.414 -14.594 1.00 63.10 H new ATOM 0 HB3 ASP A 147 -8.234 1.775 -15.919 1.00 63.10 H new