USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 573 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 109 GLN : amide:sc= -4.13! C(o=-3.1!,f=-8.3!) USER MOD Set 1.2: A 113 HIS : no HE2:sc= 1.05 K(o=-3.1,f=-14!) USER MOD Set 2.1: A 90 SER OG : rot 180:sc= 1.04 USER MOD Set 2.2: A 102 THR OG1 : rot -113:sc= 1.22 USER MOD Single : A 95 ASN : amide:sc= -1.73! C(o=-1.7!,f=-3.7!) USER MOD Single : A 100 SER OG : rot 50:sc= 0.145 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc=-0.000142 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 117 GLN :FLIP amide:sc=-0.00232 F(o=-1.1,f=-0.0023) USER MOD Single : A 119 SER OG : rot 165:sc= -4.39! USER MOD Single : A 125 GLN : amide:sc= -0.0846 X(o=-0.085,f=0) USER MOD Single : A 132 THR OG1 : rot 59:sc= 0.558 USER MOD Single : A 136 LYS NZ :NH3+ 152:sc= 1.29 (180deg=0.87) USER MOD Single : A 141 GLN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : A 147 TYR OH : rot 50:sc= -0.0244 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot -95:sc= 1.03 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl 141:sc= -0.458 (180deg=-1.58!) USER MOD Single : A 158 ASN : amide:sc= 0.0488 X(o=0.049,f=0) USER MOD ----------------------------------------------------------------- ATOM 28 N PRO A 88 12.145 -9.205 -3.532 1.00 0.00 N ATOM 29 CA PRO A 88 12.040 -7.781 -3.818 1.00 0.00 C ATOM 30 C PRO A 88 10.885 -7.486 -4.769 1.00 0.00 C ATOM 31 O PRO A 88 10.990 -7.708 -5.977 1.00 0.00 O ATOM 32 CB PRO A 88 13.388 -7.433 -4.476 1.00 0.00 C ATOM 33 CG PRO A 88 14.185 -8.702 -4.486 1.00 0.00 C ATOM 34 CD PRO A 88 13.202 -9.825 -4.328 1.00 0.00 C ATOM 0 HA PRO A 88 11.840 -7.195 -2.921 1.00 0.00 H new ATOM 0 HB2 PRO A 88 13.242 -7.057 -5.488 1.00 0.00 H new ATOM 0 HB3 PRO A 88 13.905 -6.653 -3.917 1.00 0.00 H new ATOM 0 HG2 PRO A 88 14.742 -8.803 -5.417 1.00 0.00 H new ATOM 0 HG3 PRO A 88 14.914 -8.708 -3.676 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.832 -10.179 -5.290 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.643 -10.683 -3.820 1.00 0.00 H new ATOM 42 N LEU A 89 9.774 -7.025 -4.217 1.00 0.00 N ATOM 43 CA LEU A 89 8.609 -6.683 -5.014 1.00 0.00 C ATOM 44 C LEU A 89 8.349 -5.185 -4.940 1.00 0.00 C ATOM 45 O LEU A 89 7.810 -4.683 -3.958 1.00 0.00 O ATOM 46 CB LEU A 89 7.385 -7.469 -4.532 1.00 0.00 C ATOM 47 CG LEU A 89 6.074 -7.159 -5.258 1.00 0.00 C ATOM 48 CD1 LEU A 89 6.175 -7.504 -6.736 1.00 0.00 C ATOM 49 CD2 LEU A 89 4.927 -7.916 -4.610 1.00 0.00 C ATOM 0 H LEU A 89 9.655 -6.879 -3.215 1.00 0.00 H new ATOM 0 HA LEU A 89 8.800 -6.952 -6.053 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.595 -8.534 -4.636 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.246 -7.274 -3.469 1.00 0.00 H new ATOM 0 HG LEU A 89 5.880 -6.089 -5.176 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.230 -7.274 -7.229 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.974 -6.919 -7.192 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.393 -8.566 -6.848 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.999 -7.688 -5.134 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.121 -8.987 -4.664 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.837 -7.616 -3.566 1.00 0.00 H new ATOM 61 N SER A 90 8.762 -4.475 -5.969 1.00 0.00 N ATOM 62 CA SER A 90 8.593 -3.038 -6.008 1.00 0.00 C ATOM 63 C SER A 90 7.285 -2.695 -6.715 1.00 0.00 C ATOM 64 O SER A 90 7.168 -2.852 -7.931 1.00 0.00 O ATOM 65 CB SER A 90 9.787 -2.395 -6.718 1.00 0.00 C ATOM 66 OG SER A 90 9.914 -1.026 -6.379 1.00 0.00 O ATOM 0 H SER A 90 9.218 -4.871 -6.791 1.00 0.00 H new ATOM 0 HA SER A 90 8.548 -2.645 -4.992 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.701 -2.924 -6.448 1.00 0.00 H new ATOM 0 HB3 SER A 90 9.667 -2.495 -7.797 1.00 0.00 H new ATOM 0 HG SER A 90 10.686 -0.643 -6.847 1.00 0.00 H new ATOM 72 N ILE A 91 6.301 -2.256 -5.941 1.00 0.00 N ATOM 73 CA ILE A 91 4.985 -1.923 -6.477 1.00 0.00 C ATOM 74 C ILE A 91 4.808 -0.411 -6.541 1.00 0.00 C ATOM 75 O ILE A 91 5.389 0.319 -5.744 1.00 0.00 O ATOM 76 CB ILE A 91 3.848 -2.531 -5.631 1.00 0.00 C ATOM 77 CG1 ILE A 91 3.899 -2.002 -4.192 1.00 0.00 C ATOM 78 CG2 ILE A 91 3.936 -4.049 -5.646 1.00 0.00 C ATOM 79 CD1 ILE A 91 2.735 -2.453 -3.333 1.00 0.00 C ATOM 0 H ILE A 91 6.389 -2.121 -4.934 1.00 0.00 H new ATOM 0 HA ILE A 91 4.930 -2.347 -7.479 1.00 0.00 H new ATOM 0 HB ILE A 91 2.895 -2.233 -6.068 1.00 0.00 H new ATOM 0 HG12 ILE A 91 4.829 -2.329 -3.727 1.00 0.00 H new ATOM 0 HG13 ILE A 91 3.920 -0.912 -4.216 1.00 0.00 H new ATOM 0 HG21 ILE A 91 3.128 -4.466 -5.045 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.849 -4.408 -6.671 1.00 0.00 H new ATOM 0 HG23 ILE A 91 4.895 -4.362 -5.232 1.00 0.00 H new ATOM 0 HD11 ILE A 91 2.841 -2.039 -2.330 1.00 0.00 H new ATOM 0 HD12 ILE A 91 1.801 -2.103 -3.773 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.724 -3.542 -3.277 1.00 0.00 H new ATOM 91 N LEU A 92 3.997 0.058 -7.470 1.00 0.00 N ATOM 92 CA LEU A 92 3.894 1.484 -7.713 1.00 0.00 C ATOM 93 C LEU A 92 2.721 2.101 -6.963 1.00 0.00 C ATOM 94 O LEU A 92 1.559 1.831 -7.264 1.00 0.00 O ATOM 95 CB LEU A 92 3.754 1.754 -9.209 1.00 0.00 C ATOM 96 CG LEU A 92 3.989 3.203 -9.626 1.00 0.00 C ATOM 97 CD1 LEU A 92 5.403 3.634 -9.265 1.00 0.00 C ATOM 98 CD2 LEU A 92 3.745 3.370 -11.113 1.00 0.00 C ATOM 0 H LEU A 92 3.405 -0.522 -8.064 1.00 0.00 H new ATOM 0 HA LEU A 92 4.808 1.948 -7.343 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.458 1.118 -9.745 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.753 1.458 -9.525 1.00 0.00 H new ATOM 0 HG LEU A 92 3.286 3.839 -9.088 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.556 4.670 -9.568 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.546 3.546 -8.188 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.121 2.995 -9.780 1.00 0.00 H new ATOM 0 HD21 LEU A 92 3.917 4.409 -11.395 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.427 2.726 -11.668 1.00 0.00 H new ATOM 0 HD23 LEU A 92 2.716 3.096 -11.346 1.00 0.00 H new ATOM 110 N VAL A 93 3.030 2.936 -5.983 1.00 0.00 N ATOM 111 CA VAL A 93 2.006 3.660 -5.256 1.00 0.00 C ATOM 112 C VAL A 93 2.020 5.124 -5.672 1.00 0.00 C ATOM 113 O VAL A 93 3.054 5.791 -5.608 1.00 0.00 O ATOM 114 CB VAL A 93 2.195 3.553 -3.726 1.00 0.00 C ATOM 115 CG1 VAL A 93 1.094 4.306 -2.989 1.00 0.00 C ATOM 116 CG2 VAL A 93 2.232 2.093 -3.291 1.00 0.00 C ATOM 0 H VAL A 93 3.983 3.127 -5.675 1.00 0.00 H new ATOM 0 HA VAL A 93 1.045 3.209 -5.503 1.00 0.00 H new ATOM 0 HB VAL A 93 3.150 4.012 -3.469 1.00 0.00 H new ATOM 0 HG11 VAL A 93 1.249 4.216 -1.914 1.00 0.00 H new ATOM 0 HG12 VAL A 93 1.120 5.358 -3.273 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.125 3.883 -3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.366 2.039 -2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.295 1.608 -3.566 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.061 1.587 -3.785 1.00 0.00 H new ATOM 126 N ARG A 94 0.880 5.610 -6.125 1.00 0.00 N ATOM 127 CA ARG A 94 0.767 6.985 -6.562 1.00 0.00 C ATOM 128 C ARG A 94 0.144 7.816 -5.451 1.00 0.00 C ATOM 129 O ARG A 94 -0.967 7.527 -5.011 1.00 0.00 O ATOM 130 CB ARG A 94 -0.066 7.062 -7.840 1.00 0.00 C ATOM 131 CG ARG A 94 0.249 8.271 -8.704 1.00 0.00 C ATOM 132 CD ARG A 94 -0.447 8.178 -10.053 1.00 0.00 C ATOM 133 NE ARG A 94 0.060 9.167 -11.007 1.00 0.00 N ATOM 134 CZ ARG A 94 -0.417 9.324 -12.245 1.00 0.00 C ATOM 135 NH1 ARG A 94 -1.461 8.611 -12.654 1.00 0.00 N ATOM 136 NH2 ARG A 94 0.139 10.212 -13.064 1.00 0.00 N ATOM 0 H ARG A 94 0.018 5.070 -6.199 1.00 0.00 H new ATOM 0 HA ARG A 94 1.757 7.384 -6.783 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.098 6.157 -8.425 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -1.123 7.083 -7.573 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.066 9.180 -8.191 1.00 0.00 H new ATOM 0 HG3 ARG A 94 1.326 8.345 -8.852 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.310 7.177 -10.462 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.519 8.323 -9.918 1.00 0.00 H new ATOM 0 HE ARG A 94 0.824 9.773 -10.708 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -1.900 7.942 -12.022 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -1.823 8.733 -13.600 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.930 10.773 -12.747 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -0.225 10.332 -14.009 1.00 0.00 H new ATOM 150 N ASN A 95 0.867 8.844 -5.007 1.00 0.00 N ATOM 151 CA ASN A 95 0.473 9.632 -3.832 1.00 0.00 C ATOM 152 C ASN A 95 -0.859 10.341 -4.034 1.00 0.00 C ATOM 153 O ASN A 95 -1.519 10.727 -3.070 1.00 0.00 O ATOM 154 CB ASN A 95 1.545 10.670 -3.487 1.00 0.00 C ATOM 155 CG ASN A 95 1.637 11.809 -4.492 1.00 0.00 C ATOM 156 OD1 ASN A 95 1.407 11.632 -5.692 1.00 0.00 O ATOM 157 ND2 ASN A 95 1.977 12.992 -4.000 1.00 0.00 N ATOM 0 H ASN A 95 1.735 9.154 -5.444 1.00 0.00 H new ATOM 0 HA ASN A 95 0.364 8.926 -3.009 1.00 0.00 H new ATOM 0 HB2 ASN A 95 1.334 11.083 -2.501 1.00 0.00 H new ATOM 0 HB3 ASN A 95 2.513 10.173 -3.424 1.00 0.00 H new ATOM 0 HD21 ASN A 95 2.057 13.798 -4.620 1.00 0.00 H new ATOM 0 HD22 ASN A 95 2.159 13.096 -3.002 1.00 0.00 H new ATOM 207 N ARG A 99 3.232 11.942 -8.074 1.00 0.00 N ATOM 208 CA ARG A 99 4.366 11.160 -7.607 1.00 0.00 C ATOM 209 C ARG A 99 4.092 9.674 -7.726 1.00 0.00 C ATOM 210 O ARG A 99 3.175 9.140 -7.095 1.00 0.00 O ATOM 211 CB ARG A 99 4.716 11.512 -6.161 1.00 0.00 C ATOM 212 CG ARG A 99 5.352 12.882 -6.005 1.00 0.00 C ATOM 213 CD ARG A 99 6.638 12.981 -6.807 1.00 0.00 C ATOM 214 NE ARG A 99 7.346 14.232 -6.555 1.00 0.00 N ATOM 215 CZ ARG A 99 8.643 14.409 -6.792 1.00 0.00 C ATOM 216 NH1 ARG A 99 9.353 13.443 -7.362 1.00 0.00 N ATOM 217 NH2 ARG A 99 9.225 15.558 -6.475 1.00 0.00 N ATOM 0 HA ARG A 99 5.217 11.407 -8.242 1.00 0.00 H new ATOM 0 HB2 ARG A 99 3.810 11.470 -5.556 1.00 0.00 H new ATOM 0 HB3 ARG A 99 5.397 10.758 -5.767 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.653 13.651 -6.335 1.00 0.00 H new ATOM 0 HG3 ARG A 99 5.561 13.072 -4.952 1.00 0.00 H new ATOM 0 HD2 ARG A 99 7.286 12.141 -6.557 1.00 0.00 H new ATOM 0 HD3 ARG A 99 6.409 12.902 -7.870 1.00 0.00 H new ATOM 0 HE ARG A 99 6.816 15.016 -6.175 1.00 0.00 H new ATOM 0 HH11 ARG A 99 8.904 12.564 -7.619 1.00 0.00 H new ATOM 0 HH12 ARG A 99 10.347 13.580 -7.543 1.00 0.00 H new ATOM 0 HH21 ARG A 99 8.678 16.306 -6.049 1.00 0.00 H new ATOM 0 HH22 ARG A 99 10.220 15.693 -6.657 1.00 0.00 H new ATOM 231 N SER A 100 4.885 9.022 -8.552 1.00 0.00 N ATOM 232 CA SER A 100 4.798 7.589 -8.731 1.00 0.00 C ATOM 233 C SER A 100 5.947 6.908 -7.995 1.00 0.00 C ATOM 234 O SER A 100 7.002 6.631 -8.569 1.00 0.00 O ATOM 235 CB SER A 100 4.806 7.243 -10.224 1.00 0.00 C ATOM 236 OG SER A 100 5.862 7.907 -10.904 1.00 0.00 O ATOM 0 H SER A 100 5.606 9.471 -9.117 1.00 0.00 H new ATOM 0 HA SER A 100 3.861 7.225 -8.310 1.00 0.00 H new ATOM 0 HB2 SER A 100 4.912 6.165 -10.349 1.00 0.00 H new ATOM 0 HB3 SER A 100 3.851 7.523 -10.669 1.00 0.00 H new ATOM 0 HG SER A 100 6.702 7.770 -10.417 1.00 0.00 H new ATOM 242 N SER A 101 5.755 6.680 -6.710 1.00 0.00 N ATOM 243 CA SER A 101 6.792 6.088 -5.888 1.00 0.00 C ATOM 244 C SER A 101 6.603 4.585 -5.791 1.00 0.00 C ATOM 245 O SER A 101 5.583 4.100 -5.304 1.00 0.00 O ATOM 246 CB SER A 101 6.793 6.729 -4.500 1.00 0.00 C ATOM 247 OG SER A 101 7.151 8.099 -4.582 1.00 0.00 O ATOM 0 H SER A 101 4.891 6.896 -6.213 1.00 0.00 H new ATOM 0 HA SER A 101 7.759 6.275 -6.354 1.00 0.00 H new ATOM 0 HB2 SER A 101 5.806 6.632 -4.048 1.00 0.00 H new ATOM 0 HB3 SER A 101 7.493 6.203 -3.851 1.00 0.00 H new ATOM 0 HG SER A 101 7.145 8.493 -3.685 1.00 0.00 H new ATOM 253 N THR A 102 7.584 3.846 -6.278 1.00 0.00 N ATOM 254 CA THR A 102 7.520 2.406 -6.236 1.00 0.00 C ATOM 255 C THR A 102 8.113 1.900 -4.908 1.00 0.00 C ATOM 256 O THR A 102 9.302 2.071 -4.624 1.00 0.00 O ATOM 257 CB THR A 102 8.224 1.776 -7.468 1.00 0.00 C ATOM 258 OG1 THR A 102 8.008 0.364 -7.499 1.00 0.00 O ATOM 259 CG2 THR A 102 9.719 2.063 -7.487 1.00 0.00 C ATOM 0 H THR A 102 8.430 4.223 -6.705 1.00 0.00 H new ATOM 0 HA THR A 102 6.477 2.094 -6.283 1.00 0.00 H new ATOM 0 HB THR A 102 7.784 2.235 -8.353 1.00 0.00 H new ATOM 0 HG1 THR A 102 8.859 -0.100 -7.353 1.00 0.00 H new ATOM 0 HG21 THR A 102 10.167 1.602 -8.367 1.00 0.00 H new ATOM 0 HG22 THR A 102 9.882 3.140 -7.519 1.00 0.00 H new ATOM 0 HG23 THR A 102 10.180 1.653 -6.588 1.00 0.00 H new ATOM 267 N TYR A 103 7.258 1.323 -4.076 1.00 0.00 N ATOM 268 CA TYR A 103 7.661 0.862 -2.755 1.00 0.00 C ATOM 269 C TYR A 103 8.134 -0.579 -2.813 1.00 0.00 C ATOM 270 O TYR A 103 7.468 -1.436 -3.398 1.00 0.00 O ATOM 271 CB TYR A 103 6.503 0.981 -1.760 1.00 0.00 C ATOM 272 CG TYR A 103 6.188 2.401 -1.333 1.00 0.00 C ATOM 273 CD1 TYR A 103 5.483 3.261 -2.167 1.00 0.00 C ATOM 274 CD2 TYR A 103 6.588 2.879 -0.090 1.00 0.00 C ATOM 275 CE1 TYR A 103 5.189 4.554 -1.775 1.00 0.00 C ATOM 276 CE2 TYR A 103 6.294 4.170 0.309 1.00 0.00 C ATOM 277 CZ TYR A 103 5.596 5.003 -0.536 1.00 0.00 C ATOM 278 OH TYR A 103 5.303 6.287 -0.143 1.00 0.00 O ATOM 0 H TYR A 103 6.275 1.162 -4.294 1.00 0.00 H new ATOM 0 HA TYR A 103 8.483 1.494 -2.418 1.00 0.00 H new ATOM 0 HB2 TYR A 103 5.610 0.542 -2.206 1.00 0.00 H new ATOM 0 HB3 TYR A 103 6.739 0.392 -0.874 1.00 0.00 H new ATOM 0 HD1 TYR A 103 5.160 2.914 -3.137 1.00 0.00 H new ATOM 0 HD2 TYR A 103 7.138 2.230 0.576 1.00 0.00 H new ATOM 0 HE1 TYR A 103 4.643 5.210 -2.437 1.00 0.00 H new ATOM 0 HE2 TYR A 103 6.611 4.523 1.279 1.00 0.00 H new ATOM 0 HH TYR A 103 5.660 6.443 0.756 1.00 0.00 H new ATOM 288 N GLU A 104 9.280 -0.839 -2.208 1.00 0.00 N ATOM 289 CA GLU A 104 9.807 -2.187 -2.139 1.00 0.00 C ATOM 290 C GLU A 104 9.123 -2.954 -1.020 1.00 0.00 C ATOM 291 O GLU A 104 9.443 -2.786 0.161 1.00 0.00 O ATOM 292 CB GLU A 104 11.321 -2.167 -1.929 1.00 0.00 C ATOM 293 CG GLU A 104 11.948 -3.549 -1.888 1.00 0.00 C ATOM 294 CD GLU A 104 13.450 -3.502 -1.725 1.00 0.00 C ATOM 295 OE1 GLU A 104 14.156 -3.408 -2.751 1.00 0.00 O ATOM 296 OE2 GLU A 104 13.929 -3.564 -0.570 1.00 0.00 O ATOM 0 H GLU A 104 9.862 -0.133 -1.758 1.00 0.00 H new ATOM 0 HA GLU A 104 9.605 -2.689 -3.085 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.783 -1.591 -2.731 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.543 -1.649 -0.996 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.515 -4.116 -1.064 1.00 0.00 H new ATOM 0 HG3 GLU A 104 11.703 -4.083 -2.806 1.00 0.00 H new ATOM 303 N VAL A 105 8.156 -3.767 -1.396 1.00 0.00 N ATOM 304 CA VAL A 105 7.428 -4.580 -0.446 1.00 0.00 C ATOM 305 C VAL A 105 7.736 -6.047 -0.692 1.00 0.00 C ATOM 306 O VAL A 105 8.503 -6.382 -1.594 1.00 0.00 O ATOM 307 CB VAL A 105 5.906 -4.334 -0.529 1.00 0.00 C ATOM 308 CG1 VAL A 105 5.589 -2.872 -0.261 1.00 0.00 C ATOM 309 CG2 VAL A 105 5.357 -4.762 -1.883 1.00 0.00 C ATOM 0 H VAL A 105 7.855 -3.882 -2.364 1.00 0.00 H new ATOM 0 HA VAL A 105 7.750 -4.299 0.557 1.00 0.00 H new ATOM 0 HB VAL A 105 5.422 -4.940 0.237 1.00 0.00 H new ATOM 0 HG11 VAL A 105 4.512 -2.716 -0.323 1.00 0.00 H new ATOM 0 HG12 VAL A 105 5.938 -2.601 0.735 1.00 0.00 H new ATOM 0 HG13 VAL A 105 6.089 -2.249 -1.003 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.283 -4.578 -1.915 1.00 0.00 H new ATOM 0 HG22 VAL A 105 5.847 -4.190 -2.671 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.548 -5.825 -2.034 1.00 0.00 H new ATOM 319 N ARG A 106 7.153 -6.915 0.112 1.00 0.00 N ATOM 320 CA ARG A 106 7.418 -8.337 0.008 1.00 0.00 C ATOM 321 C ARG A 106 6.128 -9.122 0.183 1.00 0.00 C ATOM 322 O ARG A 106 5.239 -8.702 0.917 1.00 0.00 O ATOM 323 CB ARG A 106 8.484 -8.731 1.037 1.00 0.00 C ATOM 324 CG ARG A 106 9.842 -8.134 0.692 1.00 0.00 C ATOM 325 CD ARG A 106 10.862 -8.251 1.807 1.00 0.00 C ATOM 326 NE ARG A 106 12.176 -7.801 1.344 1.00 0.00 N ATOM 327 CZ ARG A 106 12.562 -6.522 1.290 1.00 0.00 C ATOM 328 NH1 ARG A 106 11.792 -5.564 1.793 1.00 0.00 N ATOM 329 NH2 ARG A 106 13.732 -6.204 0.746 1.00 0.00 N ATOM 0 H ARG A 106 6.492 -6.660 0.846 1.00 0.00 H new ATOM 0 HA ARG A 106 7.806 -8.576 -0.982 1.00 0.00 H new ATOM 0 HB2 ARG A 106 8.178 -8.393 2.027 1.00 0.00 H new ATOM 0 HB3 ARG A 106 8.564 -9.817 1.082 1.00 0.00 H new ATOM 0 HG2 ARG A 106 10.231 -8.630 -0.197 1.00 0.00 H new ATOM 0 HG3 ARG A 106 9.712 -7.082 0.440 1.00 0.00 H new ATOM 0 HD2 ARG A 106 10.546 -7.653 2.662 1.00 0.00 H new ATOM 0 HD3 ARG A 106 10.923 -9.285 2.146 1.00 0.00 H new ATOM 0 HE ARG A 106 12.842 -8.512 1.042 1.00 0.00 H new ATOM 0 HH11 ARG A 106 10.899 -5.802 2.225 1.00 0.00 H new ATOM 0 HH12 ARG A 106 12.094 -4.591 1.748 1.00 0.00 H new ATOM 0 HH21 ARG A 106 14.335 -6.935 0.370 1.00 0.00 H new ATOM 0 HH22 ARG A 106 14.027 -5.228 0.705 1.00 0.00 H new ATOM 343 N LEU A 107 6.026 -10.248 -0.513 1.00 0.00 N ATOM 344 CA LEU A 107 4.778 -11.010 -0.565 1.00 0.00 C ATOM 345 C LEU A 107 4.471 -11.665 0.777 1.00 0.00 C ATOM 346 O LEU A 107 3.307 -11.834 1.138 1.00 0.00 O ATOM 347 CB LEU A 107 4.823 -12.074 -1.673 1.00 0.00 C ATOM 348 CG LEU A 107 4.971 -11.552 -3.111 1.00 0.00 C ATOM 349 CD1 LEU A 107 6.411 -11.159 -3.414 1.00 0.00 C ATOM 350 CD2 LEU A 107 4.490 -12.596 -4.104 1.00 0.00 C ATOM 0 H LEU A 107 6.791 -10.656 -1.050 1.00 0.00 H new ATOM 0 HA LEU A 107 3.979 -10.305 -0.794 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.654 -12.749 -1.466 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.910 -12.666 -1.616 1.00 0.00 H new ATOM 0 HG LEU A 107 4.353 -10.659 -3.207 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.481 -10.794 -4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.726 -10.374 -2.727 1.00 0.00 H new ATOM 0 HD13 LEU A 107 7.058 -12.028 -3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.601 -12.212 -5.118 1.00 0.00 H new ATOM 0 HD22 LEU A 107 5.083 -13.504 -3.993 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.441 -12.822 -3.914 1.00 0.00 H new ATOM 362 N THR A 108 5.519 -12.034 1.506 1.00 0.00 N ATOM 363 CA THR A 108 5.365 -12.569 2.857 1.00 0.00 C ATOM 364 C THR A 108 4.756 -11.510 3.780 1.00 0.00 C ATOM 365 O THR A 108 4.052 -11.826 4.742 1.00 0.00 O ATOM 366 CB THR A 108 6.728 -13.024 3.429 1.00 0.00 C ATOM 367 OG1 THR A 108 7.367 -13.937 2.522 1.00 0.00 O ATOM 368 CG2 THR A 108 6.559 -13.701 4.782 1.00 0.00 C ATOM 0 H THR A 108 6.485 -11.973 1.185 1.00 0.00 H new ATOM 0 HA THR A 108 4.700 -13.431 2.803 1.00 0.00 H new ATOM 0 HB THR A 108 7.347 -12.136 3.556 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.230 -14.217 2.893 1.00 0.00 H new ATOM 0 HG21 THR A 108 7.534 -14.010 5.159 1.00 0.00 H new ATOM 0 HG22 THR A 108 6.103 -13.003 5.484 1.00 0.00 H new ATOM 0 HG23 THR A 108 5.918 -14.576 4.673 1.00 0.00 H new ATOM 376 N GLN A 109 5.010 -10.252 3.448 1.00 0.00 N ATOM 377 CA GLN A 109 4.560 -9.126 4.249 1.00 0.00 C ATOM 378 C GLN A 109 3.087 -8.834 3.981 1.00 0.00 C ATOM 379 O GLN A 109 2.620 -8.910 2.837 1.00 0.00 O ATOM 380 CB GLN A 109 5.404 -7.898 3.909 1.00 0.00 C ATOM 381 CG GLN A 109 5.110 -6.681 4.751 1.00 0.00 C ATOM 382 CD GLN A 109 5.322 -5.408 3.961 1.00 0.00 C ATOM 383 OE1 GLN A 109 6.419 -4.859 3.920 1.00 0.00 O ATOM 384 NE2 GLN A 109 4.263 -4.914 3.346 1.00 0.00 N ATOM 0 H GLN A 109 5.534 -9.985 2.615 1.00 0.00 H new ATOM 0 HA GLN A 109 4.675 -9.371 5.305 1.00 0.00 H new ATOM 0 HB2 GLN A 109 6.457 -8.155 4.021 1.00 0.00 H new ATOM 0 HB3 GLN A 109 5.247 -7.645 2.860 1.00 0.00 H new ATOM 0 HG2 GLN A 109 4.082 -6.723 5.110 1.00 0.00 H new ATOM 0 HG3 GLN A 109 5.754 -6.679 5.630 1.00 0.00 H new ATOM 0 HE21 GLN A 109 3.368 -5.399 3.403 1.00 0.00 H new ATOM 0 HE22 GLN A 109 4.340 -4.047 2.814 1.00 0.00 H new ATOM 393 N THR A 110 2.361 -8.494 5.027 1.00 0.00 N ATOM 394 CA THR A 110 0.955 -8.161 4.901 1.00 0.00 C ATOM 395 C THR A 110 0.785 -6.706 4.472 1.00 0.00 C ATOM 396 O THR A 110 1.743 -5.920 4.497 1.00 0.00 O ATOM 397 CB THR A 110 0.206 -8.402 6.228 1.00 0.00 C ATOM 398 OG1 THR A 110 0.863 -7.712 7.304 1.00 0.00 O ATOM 399 CG2 THR A 110 0.130 -9.886 6.540 1.00 0.00 C ATOM 0 H THR A 110 2.723 -8.441 5.979 1.00 0.00 H new ATOM 0 HA THR A 110 0.528 -8.811 4.138 1.00 0.00 H new ATOM 0 HB THR A 110 -0.807 -8.015 6.121 1.00 0.00 H new ATOM 0 HG1 THR A 110 0.377 -7.872 8.140 1.00 0.00 H new ATOM 0 HG21 THR A 110 -0.402 -10.033 7.480 1.00 0.00 H new ATOM 0 HG22 THR A 110 -0.400 -10.400 5.738 1.00 0.00 H new ATOM 0 HG23 THR A 110 1.138 -10.292 6.626 1.00 0.00 H new ATOM 407 N VAL A 111 -0.428 -6.349 4.072 1.00 0.00 N ATOM 408 CA VAL A 111 -0.737 -4.973 3.708 1.00 0.00 C ATOM 409 C VAL A 111 -0.605 -4.064 4.930 1.00 0.00 C ATOM 410 O VAL A 111 -0.356 -2.866 4.803 1.00 0.00 O ATOM 411 CB VAL A 111 -2.160 -4.849 3.122 1.00 0.00 C ATOM 412 CG1 VAL A 111 -2.453 -3.420 2.698 1.00 0.00 C ATOM 413 CG2 VAL A 111 -2.343 -5.800 1.951 1.00 0.00 C ATOM 0 H VAL A 111 -1.214 -6.994 3.991 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.025 -4.665 2.943 1.00 0.00 H new ATOM 0 HB VAL A 111 -2.869 -5.122 3.903 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -3.462 -3.361 2.289 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.373 -2.760 3.562 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.735 -3.111 1.938 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.352 -5.697 1.553 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.619 -5.561 1.172 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.189 -6.825 2.287 1.00 0.00 H new ATOM 423 N ALA A 112 -0.733 -4.657 6.114 1.00 0.00 N ATOM 424 CA ALA A 112 -0.635 -3.922 7.370 1.00 0.00 C ATOM 425 C ALA A 112 0.678 -3.146 7.477 1.00 0.00 C ATOM 426 O ALA A 112 0.700 -2.028 7.991 1.00 0.00 O ATOM 427 CB ALA A 112 -0.779 -4.871 8.547 1.00 0.00 C ATOM 0 H ALA A 112 -0.907 -5.656 6.229 1.00 0.00 H new ATOM 0 HA ALA A 112 -1.448 -3.197 7.389 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -0.704 -4.310 9.478 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -1.749 -5.366 8.499 1.00 0.00 H new ATOM 0 HB3 ALA A 112 0.012 -5.620 8.510 1.00 0.00 H new ATOM 433 N HIS A 113 1.773 -3.724 6.983 1.00 0.00 N ATOM 434 CA HIS A 113 3.057 -3.033 7.030 1.00 0.00 C ATOM 435 C HIS A 113 3.012 -1.801 6.138 1.00 0.00 C ATOM 436 O HIS A 113 3.511 -0.748 6.508 1.00 0.00 O ATOM 437 CB HIS A 113 4.220 -3.930 6.598 1.00 0.00 C ATOM 438 CG HIS A 113 5.567 -3.362 6.964 1.00 0.00 C ATOM 439 ND1 HIS A 113 6.680 -3.463 6.155 1.00 0.00 N ATOM 440 CD2 HIS A 113 5.972 -2.674 8.061 1.00 0.00 C ATOM 441 CE1 HIS A 113 7.703 -2.858 6.734 1.00 0.00 C ATOM 442 NE2 HIS A 113 7.299 -2.373 7.889 1.00 0.00 N ATOM 0 H HIS A 113 1.797 -4.649 6.555 1.00 0.00 H new ATOM 0 HA HIS A 113 3.230 -2.745 8.067 1.00 0.00 H new ATOM 0 HB2 HIS A 113 4.107 -4.910 7.061 1.00 0.00 H new ATOM 0 HB3 HIS A 113 4.175 -4.080 5.519 1.00 0.00 H new ATOM 0 HD1 HIS A 113 6.709 -3.932 5.250 1.00 0.00 H new ATOM 0 HD2 HIS A 113 5.362 -2.412 8.913 1.00 0.00 H new ATOM 0 HE1 HIS A 113 8.701 -2.776 6.328 1.00 0.00 H new ATOM 451 N LEU A 114 2.405 -1.946 4.962 1.00 0.00 N ATOM 452 CA LEU A 114 2.269 -0.830 4.031 1.00 0.00 C ATOM 453 C LEU A 114 1.369 0.238 4.633 1.00 0.00 C ATOM 454 O LEU A 114 1.665 1.431 4.555 1.00 0.00 O ATOM 455 CB LEU A 114 1.687 -1.310 2.698 1.00 0.00 C ATOM 456 CG LEU A 114 1.593 -0.240 1.607 1.00 0.00 C ATOM 457 CD1 LEU A 114 2.978 0.228 1.191 1.00 0.00 C ATOM 458 CD2 LEU A 114 0.823 -0.765 0.407 1.00 0.00 C ATOM 0 H LEU A 114 2.001 -2.823 4.633 1.00 0.00 H new ATOM 0 HA LEU A 114 3.257 -0.408 3.847 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.299 -2.132 2.327 1.00 0.00 H new ATOM 0 HB3 LEU A 114 0.690 -1.711 2.878 1.00 0.00 H new ATOM 0 HG LEU A 114 1.053 0.615 2.014 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.887 0.988 0.415 1.00 0.00 H new ATOM 0 HD12 LEU A 114 3.494 0.650 2.054 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.547 -0.618 0.806 1.00 0.00 H new ATOM 0 HD21 LEU A 114 0.767 0.010 -0.357 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.333 -1.639 0.001 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -0.185 -1.044 0.715 1.00 0.00 H new ATOM 470 N LYS A 115 0.280 -0.215 5.245 1.00 0.00 N ATOM 471 CA LYS A 115 -0.656 0.655 5.949 1.00 0.00 C ATOM 472 C LYS A 115 0.087 1.545 6.938 1.00 0.00 C ATOM 473 O LYS A 115 -0.077 2.761 6.931 1.00 0.00 O ATOM 474 CB LYS A 115 -1.686 -0.204 6.697 1.00 0.00 C ATOM 475 CG LYS A 115 -2.777 0.582 7.411 1.00 0.00 C ATOM 476 CD LYS A 115 -3.850 1.067 6.448 1.00 0.00 C ATOM 477 CE LYS A 115 -5.046 1.631 7.199 1.00 0.00 C ATOM 478 NZ LYS A 115 -6.200 1.904 6.300 1.00 0.00 N ATOM 0 H LYS A 115 0.020 -1.201 5.267 1.00 0.00 H new ATOM 0 HA LYS A 115 -1.165 1.290 5.223 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.155 -0.885 5.986 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.162 -0.818 7.429 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.233 -0.045 8.177 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.334 1.437 7.921 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.435 1.832 5.792 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.172 0.242 5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.350 0.927 7.974 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.754 2.553 7.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -6.991 2.287 6.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -5.920 2.596 5.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.497 1.021 5.839 1.00 0.00 H new ATOM 492 N GLN A 116 0.929 0.930 7.763 1.00 0.00 N ATOM 493 CA GLN A 116 1.658 1.658 8.794 1.00 0.00 C ATOM 494 C GLN A 116 2.825 2.464 8.217 1.00 0.00 C ATOM 495 O GLN A 116 3.236 3.465 8.801 1.00 0.00 O ATOM 496 CB GLN A 116 2.170 0.700 9.869 1.00 0.00 C ATOM 497 CG GLN A 116 1.067 0.027 10.668 1.00 0.00 C ATOM 498 CD GLN A 116 1.613 -0.843 11.782 1.00 0.00 C ATOM 499 OE1 GLN A 116 2.692 -0.580 12.323 1.00 0.00 O ATOM 500 NE2 GLN A 116 0.878 -1.885 12.136 1.00 0.00 N ATOM 0 H GLN A 116 1.123 -0.071 7.737 1.00 0.00 H new ATOM 0 HA GLN A 116 0.957 2.363 9.241 1.00 0.00 H new ATOM 0 HB2 GLN A 116 2.783 -0.067 9.396 1.00 0.00 H new ATOM 0 HB3 GLN A 116 2.818 1.249 10.553 1.00 0.00 H new ATOM 0 HG2 GLN A 116 0.412 0.788 11.092 1.00 0.00 H new ATOM 0 HG3 GLN A 116 0.457 -0.582 10.000 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -0.008 -2.068 11.664 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.197 -2.505 12.880 1.00 0.00 H new ATOM 509 N GLN A 117 3.378 2.031 7.090 1.00 0.00 N ATOM 510 CA GLN A 117 4.413 2.817 6.425 1.00 0.00 C ATOM 511 C GLN A 117 3.817 4.137 5.962 1.00 0.00 C ATOM 512 O GLN A 117 4.340 5.220 6.253 1.00 0.00 O ATOM 513 CB GLN A 117 5.015 2.056 5.238 1.00 0.00 C ATOM 514 CG GLN A 117 5.862 0.861 5.647 1.00 0.00 C ATOM 515 CD GLN A 117 6.484 0.149 4.463 1.00 0.00 C ATOM 516 OE1 GLN A 117 5.777 -0.837 3.929 1.00 0.00 O flip ATOM 517 NE2 GLN A 117 7.587 0.478 4.030 1.00 0.00 N flip ATOM 0 H GLN A 117 3.134 1.157 6.624 1.00 0.00 H new ATOM 0 HA GLN A 117 5.219 3.007 7.134 1.00 0.00 H new ATOM 0 HB2 GLN A 117 4.208 1.714 4.590 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.627 2.741 4.651 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.652 1.195 6.320 1.00 0.00 H new ATOM 0 HG3 GLN A 117 5.244 0.157 6.205 1.00 0.00 H new ATOM 0 HE21 GLN A 117 8.100 1.243 4.469 1.00 0.00 H new ATOM 0 HE22 GLN A 117 7.989 -0.014 3.232 1.00 0.00 H new ATOM 526 N VAL A 118 2.691 4.038 5.274 1.00 0.00 N ATOM 527 CA VAL A 118 1.960 5.209 4.842 1.00 0.00 C ATOM 528 C VAL A 118 1.468 5.995 6.053 1.00 0.00 C ATOM 529 O VAL A 118 1.599 7.214 6.096 1.00 0.00 O ATOM 530 CB VAL A 118 0.759 4.836 3.943 1.00 0.00 C ATOM 531 CG1 VAL A 118 -0.019 6.077 3.536 1.00 0.00 C ATOM 532 CG2 VAL A 118 1.228 4.079 2.709 1.00 0.00 C ATOM 0 H VAL A 118 2.265 3.152 5.004 1.00 0.00 H new ATOM 0 HA VAL A 118 2.642 5.824 4.255 1.00 0.00 H new ATOM 0 HB VAL A 118 0.096 4.189 4.517 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.859 5.789 2.904 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.392 6.581 4.427 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.635 6.752 2.984 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.368 3.825 2.089 1.00 0.00 H new ATOM 0 HG22 VAL A 118 1.915 4.704 2.138 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.737 3.165 3.015 1.00 0.00 H new ATOM 542 N SER A 119 0.945 5.283 7.051 1.00 0.00 N ATOM 543 CA SER A 119 0.372 5.918 8.231 1.00 0.00 C ATOM 544 C SER A 119 1.445 6.641 9.044 1.00 0.00 C ATOM 545 O SER A 119 1.148 7.566 9.803 1.00 0.00 O ATOM 546 CB SER A 119 -0.353 4.886 9.105 1.00 0.00 C ATOM 547 OG SER A 119 0.559 4.042 9.773 1.00 0.00 O ATOM 0 H SER A 119 0.908 4.264 7.063 1.00 0.00 H new ATOM 0 HA SER A 119 -0.353 6.657 7.891 1.00 0.00 H new ATOM 0 HB2 SER A 119 -0.977 5.401 9.836 1.00 0.00 H new ATOM 0 HB3 SER A 119 -1.019 4.286 8.485 1.00 0.00 H new ATOM 0 HG SER A 119 0.096 3.565 10.493 1.00 0.00 H new ATOM 553 N GLY A 120 2.689 6.214 8.889 1.00 0.00 N ATOM 554 CA GLY A 120 3.785 6.887 9.546 1.00 0.00 C ATOM 555 C GLY A 120 4.115 8.207 8.885 1.00 0.00 C ATOM 556 O GLY A 120 4.333 9.215 9.561 1.00 0.00 O ATOM 0 H GLY A 120 2.957 5.412 8.319 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.531 7.058 10.592 1.00 0.00 H new ATOM 0 HA3 GLY A 120 4.665 6.245 9.533 1.00 0.00 H new ATOM 560 N LEU A 121 4.133 8.211 7.560 1.00 0.00 N ATOM 561 CA LEU A 121 4.493 9.406 6.806 1.00 0.00 C ATOM 562 C LEU A 121 3.283 10.321 6.590 1.00 0.00 C ATOM 563 O LEU A 121 3.164 11.378 7.213 1.00 0.00 O ATOM 564 CB LEU A 121 5.093 9.009 5.455 1.00 0.00 C ATOM 565 CG LEU A 121 6.248 8.005 5.526 1.00 0.00 C ATOM 566 CD1 LEU A 121 6.740 7.658 4.131 1.00 0.00 C ATOM 567 CD2 LEU A 121 7.388 8.551 6.372 1.00 0.00 C ATOM 0 H LEU A 121 3.903 7.401 6.984 1.00 0.00 H new ATOM 0 HA LEU A 121 5.232 9.958 7.387 1.00 0.00 H new ATOM 0 HB2 LEU A 121 4.303 8.587 4.834 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.446 9.910 4.953 1.00 0.00 H new ATOM 0 HG LEU A 121 5.878 7.095 5.999 1.00 0.00 H new ATOM 0 HD11 LEU A 121 7.560 6.944 4.202 1.00 0.00 H new ATOM 0 HD12 LEU A 121 5.925 7.218 3.556 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.088 8.563 3.633 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.196 7.821 6.408 1.00 0.00 H new ATOM 0 HD22 LEU A 121 7.756 9.478 5.932 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.030 8.746 7.383 1.00 0.00 H new ATOM 579 N GLU A 122 2.386 9.895 5.715 1.00 0.00 N ATOM 580 CA GLU A 122 1.238 10.701 5.309 1.00 0.00 C ATOM 581 C GLU A 122 -0.018 10.254 6.051 1.00 0.00 C ATOM 582 O GLU A 122 -1.123 10.703 5.758 1.00 0.00 O ATOM 583 CB GLU A 122 1.026 10.565 3.806 1.00 0.00 C ATOM 584 CG GLU A 122 0.293 11.735 3.170 1.00 0.00 C ATOM 585 CD GLU A 122 1.133 12.998 3.140 1.00 0.00 C ATOM 586 OE1 GLU A 122 1.235 13.679 4.181 1.00 0.00 O ATOM 587 OE2 GLU A 122 1.687 13.322 2.067 1.00 0.00 O ATOM 0 H GLU A 122 2.430 8.981 5.264 1.00 0.00 H new ATOM 0 HA GLU A 122 1.435 11.744 5.557 1.00 0.00 H new ATOM 0 HB2 GLU A 122 1.996 10.453 3.323 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.465 9.651 3.611 1.00 0.00 H new ATOM 0 HG2 GLU A 122 0.005 11.470 2.153 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -0.627 11.927 3.722 1.00 0.00 H new ATOM 594 N GLY A 123 0.176 9.349 7.000 1.00 0.00 N ATOM 595 CA GLY A 123 -0.917 8.686 7.695 1.00 0.00 C ATOM 596 C GLY A 123 -1.803 9.593 8.522 1.00 0.00 C ATOM 597 O GLY A 123 -2.626 9.090 9.281 1.00 0.00 O ATOM 0 H GLY A 123 1.101 9.053 7.311 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -1.536 8.174 6.959 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -0.499 7.920 8.348 1.00 0.00 H new ATOM 601 N VAL A 124 -1.583 10.904 8.416 1.00 0.00 N ATOM 602 CA VAL A 124 -2.404 11.928 9.072 1.00 0.00 C ATOM 603 C VAL A 124 -3.880 11.531 9.133 1.00 0.00 C ATOM 604 O VAL A 124 -4.629 11.813 8.199 1.00 0.00 O ATOM 605 CB VAL A 124 -2.300 13.261 8.304 1.00 0.00 C ATOM 606 CG1 VAL A 124 -3.146 14.333 8.968 1.00 0.00 C ATOM 607 CG2 VAL A 124 -0.845 13.697 8.163 1.00 0.00 C ATOM 0 H VAL A 124 -0.818 11.292 7.864 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.025 12.032 10.088 1.00 0.00 H new ATOM 0 HB VAL A 124 -2.693 13.109 7.299 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -3.057 15.265 8.409 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.189 14.016 8.982 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -2.800 14.489 9.990 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -0.799 14.640 7.618 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.407 13.828 9.152 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -0.288 12.935 7.618 1.00 0.00 H new ATOM 617 N GLN A 125 -4.275 10.895 10.245 1.00 0.00 N ATOM 618 CA GLN A 125 -5.607 10.294 10.393 1.00 0.00 C ATOM 619 C GLN A 125 -5.969 9.450 9.167 1.00 0.00 C ATOM 620 O GLN A 125 -6.308 9.977 8.113 1.00 0.00 O ATOM 621 CB GLN A 125 -6.677 11.360 10.655 1.00 0.00 C ATOM 622 CG GLN A 125 -6.519 12.053 12.001 1.00 0.00 C ATOM 623 CD GLN A 125 -7.632 13.041 12.291 1.00 0.00 C ATOM 624 OE1 GLN A 125 -8.662 12.688 12.870 1.00 0.00 O ATOM 625 NE2 GLN A 125 -7.428 14.292 11.906 1.00 0.00 N ATOM 0 H GLN A 125 -3.680 10.783 11.066 1.00 0.00 H new ATOM 0 HA GLN A 125 -5.574 9.636 11.261 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -6.637 12.107 9.862 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.662 10.896 10.606 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -6.493 11.301 12.790 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -5.562 12.574 12.025 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.562 14.544 11.429 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -8.137 15.003 12.086 1.00 0.00 H new ATOM 634 N ASP A 126 -5.930 8.130 9.324 1.00 0.00 N ATOM 635 CA ASP A 126 -6.059 7.204 8.189 1.00 0.00 C ATOM 636 C ASP A 126 -7.406 7.323 7.465 1.00 0.00 C ATOM 637 O ASP A 126 -7.640 6.634 6.474 1.00 0.00 O ATOM 638 CB ASP A 126 -5.825 5.751 8.628 1.00 0.00 C ATOM 639 CG ASP A 126 -6.835 5.259 9.647 1.00 0.00 C ATOM 640 OD1 ASP A 126 -6.668 5.568 10.847 1.00 0.00 O ATOM 641 OD2 ASP A 126 -7.781 4.543 9.264 1.00 0.00 O ATOM 0 H ASP A 126 -5.810 7.671 10.227 1.00 0.00 H new ATOM 0 HA ASP A 126 -5.285 7.494 7.478 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -5.860 5.104 7.751 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.823 5.663 9.049 1.00 0.00 H new ATOM 646 N ASP A 127 -8.274 8.201 7.941 1.00 0.00 N ATOM 647 CA ASP A 127 -9.547 8.451 7.278 1.00 0.00 C ATOM 648 C ASP A 127 -9.505 9.734 6.444 1.00 0.00 C ATOM 649 O ASP A 127 -10.453 10.032 5.712 1.00 0.00 O ATOM 650 CB ASP A 127 -10.686 8.524 8.296 1.00 0.00 C ATOM 651 CG ASP A 127 -11.103 7.156 8.795 1.00 0.00 C ATOM 652 OD1 ASP A 127 -11.671 6.380 8.001 1.00 0.00 O ATOM 653 OD2 ASP A 127 -10.869 6.849 9.983 1.00 0.00 O ATOM 0 H ASP A 127 -8.122 8.754 8.785 1.00 0.00 H new ATOM 0 HA ASP A 127 -9.730 7.615 6.604 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -10.375 9.137 9.142 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -11.544 9.019 7.842 1.00 0.00 H new ATOM 658 N LEU A 128 -8.417 10.499 6.547 1.00 0.00 N ATOM 659 CA LEU A 128 -8.270 11.706 5.741 1.00 0.00 C ATOM 660 C LEU A 128 -7.724 11.367 4.358 1.00 0.00 C ATOM 661 O LEU A 128 -7.722 12.205 3.457 1.00 0.00 O ATOM 662 CB LEU A 128 -7.357 12.717 6.432 1.00 0.00 C ATOM 663 CG LEU A 128 -7.873 13.243 7.771 1.00 0.00 C ATOM 664 CD1 LEU A 128 -6.901 14.253 8.350 1.00 0.00 C ATOM 665 CD2 LEU A 128 -9.254 13.864 7.617 1.00 0.00 C ATOM 0 H LEU A 128 -7.635 10.306 7.173 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.257 12.154 5.628 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.383 12.255 6.591 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.203 13.562 5.762 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.955 12.401 8.458 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.282 14.619 9.304 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.932 13.778 8.504 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -6.790 15.089 7.659 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -9.598 14.230 8.584 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -9.203 14.694 6.912 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -9.951 13.113 7.245 1.00 0.00 H new ATOM 677 N PHE A 129 -7.245 10.145 4.204 1.00 0.00 N ATOM 678 CA PHE A 129 -6.825 9.649 2.903 1.00 0.00 C ATOM 679 C PHE A 129 -7.491 8.304 2.630 1.00 0.00 C ATOM 680 O PHE A 129 -7.747 7.530 3.552 1.00 0.00 O ATOM 681 CB PHE A 129 -5.294 9.527 2.818 1.00 0.00 C ATOM 682 CG PHE A 129 -4.682 8.495 3.727 1.00 0.00 C ATOM 683 CD1 PHE A 129 -4.306 8.821 5.022 1.00 0.00 C ATOM 684 CD2 PHE A 129 -4.469 7.200 3.279 1.00 0.00 C ATOM 685 CE1 PHE A 129 -3.733 7.872 5.851 1.00 0.00 C ATOM 686 CE2 PHE A 129 -3.894 6.249 4.103 1.00 0.00 C ATOM 687 CZ PHE A 129 -3.527 6.586 5.390 1.00 0.00 C ATOM 0 H PHE A 129 -7.137 9.475 4.966 1.00 0.00 H new ATOM 0 HA PHE A 129 -7.136 10.364 2.141 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -5.021 9.290 1.790 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -4.855 10.498 3.049 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.462 9.825 5.387 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -4.756 6.930 2.273 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -3.447 8.137 6.858 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -3.733 5.245 3.740 1.00 0.00 H new ATOM 0 HZ PHE A 129 -3.079 5.845 6.036 1.00 0.00 H new ATOM 697 N TRP A 130 -7.781 8.042 1.368 1.00 0.00 N ATOM 698 CA TRP A 130 -8.451 6.816 0.967 1.00 0.00 C ATOM 699 C TRP A 130 -7.748 6.208 -0.239 1.00 0.00 C ATOM 700 O TRP A 130 -8.045 6.531 -1.386 1.00 0.00 O ATOM 701 CB TRP A 130 -9.927 7.096 0.651 1.00 0.00 C ATOM 702 CG TRP A 130 -10.680 5.911 0.110 1.00 0.00 C ATOM 703 CD1 TRP A 130 -10.930 4.731 0.749 1.00 0.00 C ATOM 704 CD2 TRP A 130 -11.292 5.802 -1.181 1.00 0.00 C ATOM 705 NE1 TRP A 130 -11.657 3.896 -0.066 1.00 0.00 N ATOM 706 CE2 TRP A 130 -11.893 4.531 -1.255 1.00 0.00 C ATOM 707 CE3 TRP A 130 -11.393 6.659 -2.278 1.00 0.00 C ATOM 708 CZ2 TRP A 130 -12.582 4.098 -2.386 1.00 0.00 C ATOM 709 CZ3 TRP A 130 -12.075 6.229 -3.400 1.00 0.00 C ATOM 710 CH2 TRP A 130 -12.666 4.959 -3.446 1.00 0.00 C ATOM 0 H TRP A 130 -7.560 8.669 0.595 1.00 0.00 H new ATOM 0 HA TRP A 130 -8.407 6.102 1.790 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -10.421 7.442 1.559 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -9.984 7.909 -0.073 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -10.604 4.489 1.750 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -11.970 2.956 0.176 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -10.946 7.642 -2.250 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -13.034 3.118 -2.425 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -12.154 6.883 -4.256 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -13.198 4.654 -4.335 1.00 0.00 H new ATOM 721 N LEU A 131 -6.781 5.356 0.022 1.00 0.00 N ATOM 722 CA LEU A 131 -6.056 4.710 -1.054 1.00 0.00 C ATOM 723 C LEU A 131 -6.747 3.406 -1.424 1.00 0.00 C ATOM 724 O LEU A 131 -7.376 2.771 -0.578 1.00 0.00 O ATOM 725 CB LEU A 131 -4.589 4.444 -0.668 1.00 0.00 C ATOM 726 CG LEU A 131 -4.332 3.272 0.296 1.00 0.00 C ATOM 727 CD1 LEU A 131 -2.845 2.965 0.360 1.00 0.00 C ATOM 728 CD2 LEU A 131 -4.860 3.568 1.693 1.00 0.00 C ATOM 0 H LEU A 131 -6.479 5.095 0.961 1.00 0.00 H new ATOM 0 HA LEU A 131 -6.054 5.380 -1.914 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -4.023 4.264 -1.582 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.185 5.351 -0.217 1.00 0.00 H new ATOM 0 HG LEU A 131 -4.867 2.404 -0.088 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -2.674 2.134 1.045 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -2.486 2.696 -0.633 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -2.307 3.844 0.715 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -4.660 2.718 2.345 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -4.364 4.454 2.089 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -5.935 3.745 1.646 1.00 0.00 H new ATOM 740 N THR A 132 -6.649 3.015 -2.682 1.00 0.00 N ATOM 741 CA THR A 132 -7.273 1.789 -3.139 1.00 0.00 C ATOM 742 C THR A 132 -6.656 1.313 -4.446 1.00 0.00 C ATOM 743 O THR A 132 -5.955 2.060 -5.135 1.00 0.00 O ATOM 744 CB THR A 132 -8.805 1.954 -3.290 1.00 0.00 C ATOM 745 OG1 THR A 132 -9.388 0.811 -3.928 1.00 0.00 O ATOM 746 CG2 THR A 132 -9.163 3.207 -4.068 1.00 0.00 C ATOM 0 H THR A 132 -6.144 3.529 -3.404 1.00 0.00 H new ATOM 0 HA THR A 132 -7.091 1.030 -2.378 1.00 0.00 H new ATOM 0 HB THR A 132 -9.211 2.046 -2.283 1.00 0.00 H new ATOM 0 HG1 THR A 132 -9.191 0.007 -3.403 1.00 0.00 H new ATOM 0 HG21 THR A 132 -10.247 3.286 -4.152 1.00 0.00 H new ATOM 0 HG22 THR A 132 -8.775 4.082 -3.547 1.00 0.00 H new ATOM 0 HG23 THR A 132 -8.725 3.154 -5.065 1.00 0.00 H new ATOM 754 N PHE A 133 -6.910 0.059 -4.758 1.00 0.00 N ATOM 755 CA PHE A 133 -6.396 -0.571 -5.962 1.00 0.00 C ATOM 756 C PHE A 133 -7.443 -1.508 -6.545 1.00 0.00 C ATOM 757 O PHE A 133 -7.830 -1.389 -7.704 1.00 0.00 O ATOM 758 CB PHE A 133 -5.101 -1.343 -5.656 1.00 0.00 C ATOM 759 CG PHE A 133 -4.838 -2.474 -6.613 1.00 0.00 C ATOM 760 CD1 PHE A 133 -4.337 -2.231 -7.881 1.00 0.00 C ATOM 761 CD2 PHE A 133 -5.125 -3.779 -6.246 1.00 0.00 C ATOM 762 CE1 PHE A 133 -4.129 -3.272 -8.766 1.00 0.00 C ATOM 763 CE2 PHE A 133 -4.915 -4.821 -7.122 1.00 0.00 C ATOM 764 CZ PHE A 133 -4.419 -4.568 -8.384 1.00 0.00 C ATOM 0 H PHE A 133 -7.482 -0.558 -4.181 1.00 0.00 H new ATOM 0 HA PHE A 133 -6.169 0.205 -6.693 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -4.259 -0.651 -5.683 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.155 -1.740 -4.642 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -4.107 -1.219 -8.181 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -5.518 -3.982 -5.261 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -3.741 -3.073 -9.754 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.138 -5.834 -6.821 1.00 0.00 H new ATOM 0 HZ PHE A 133 -4.257 -5.383 -9.074 1.00 0.00 H new ATOM 774 N GLU A 134 -7.910 -2.422 -5.715 1.00 0.00 N ATOM 775 CA GLU A 134 -8.842 -3.453 -6.143 1.00 0.00 C ATOM 776 C GLU A 134 -10.281 -2.947 -6.017 1.00 0.00 C ATOM 777 O GLU A 134 -11.241 -3.690 -6.206 1.00 0.00 O ATOM 778 CB GLU A 134 -8.649 -4.691 -5.264 1.00 0.00 C ATOM 779 CG GLU A 134 -9.321 -5.947 -5.791 1.00 0.00 C ATOM 780 CD GLU A 134 -9.748 -6.877 -4.675 1.00 0.00 C ATOM 781 OE1 GLU A 134 -8.893 -7.617 -4.147 1.00 0.00 O ATOM 782 OE2 GLU A 134 -10.945 -6.865 -4.321 1.00 0.00 O ATOM 0 H GLU A 134 -7.656 -2.472 -4.728 1.00 0.00 H new ATOM 0 HA GLU A 134 -8.652 -3.706 -7.186 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -7.581 -4.883 -5.157 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -9.036 -4.478 -4.268 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -10.192 -5.669 -6.384 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -8.636 -6.472 -6.457 1.00 0.00 H new ATOM 789 N GLY A 135 -10.416 -1.671 -5.692 1.00 0.00 N ATOM 790 CA GLY A 135 -11.715 -1.124 -5.358 1.00 0.00 C ATOM 791 C GLY A 135 -11.877 -1.033 -3.857 1.00 0.00 C ATOM 792 O GLY A 135 -12.649 -0.222 -3.345 1.00 0.00 O ATOM 0 H GLY A 135 -9.647 -1.002 -5.653 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -11.826 -0.135 -5.803 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -12.500 -1.752 -5.778 1.00 0.00 H new ATOM 796 N LYS A 136 -11.096 -1.848 -3.162 1.00 0.00 N ATOM 797 CA LYS A 136 -11.080 -1.871 -1.707 1.00 0.00 C ATOM 798 C LYS A 136 -9.857 -1.106 -1.212 1.00 0.00 C ATOM 799 O LYS A 136 -8.839 -1.060 -1.904 1.00 0.00 O ATOM 800 CB LYS A 136 -11.011 -3.314 -1.190 1.00 0.00 C ATOM 801 CG LYS A 136 -12.161 -4.208 -1.633 1.00 0.00 C ATOM 802 CD LYS A 136 -12.019 -5.603 -1.040 1.00 0.00 C ATOM 803 CE LYS A 136 -13.152 -6.528 -1.462 1.00 0.00 C ATOM 804 NZ LYS A 136 -13.175 -6.759 -2.929 1.00 0.00 N ATOM 0 H LYS A 136 -10.454 -2.513 -3.593 1.00 0.00 H new ATOM 0 HA LYS A 136 -11.995 -1.408 -1.337 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.074 -3.760 -1.523 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.984 -3.294 -0.101 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -13.109 -3.770 -1.321 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -12.181 -4.270 -2.721 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.067 -6.033 -1.352 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.996 -5.533 0.047 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -13.049 -7.483 -0.948 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -14.104 -6.099 -1.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -13.594 -7.690 -3.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.743 -6.019 -3.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -12.204 -6.730 -3.300 1.00 0.00 H new ATOM 818 N PRO A 137 -9.921 -0.526 -0.004 1.00 0.00 N ATOM 819 CA PRO A 137 -8.806 0.250 0.565 1.00 0.00 C ATOM 820 C PRO A 137 -7.644 -0.634 1.027 1.00 0.00 C ATOM 821 O PRO A 137 -6.840 -0.220 1.865 1.00 0.00 O ATOM 822 CB PRO A 137 -9.446 0.950 1.762 1.00 0.00 C ATOM 823 CG PRO A 137 -10.561 0.052 2.174 1.00 0.00 C ATOM 824 CD PRO A 137 -11.081 -0.573 0.909 1.00 0.00 C ATOM 0 HA PRO A 137 -8.368 0.927 -0.168 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -8.728 1.087 2.571 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -9.814 1.940 1.492 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -10.211 -0.710 2.870 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -11.345 0.612 2.683 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -11.418 -1.596 1.076 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -11.930 -0.019 0.508 1.00 0.00 H new ATOM 832 N LEU A 138 -7.573 -1.841 0.460 1.00 0.00 N ATOM 833 CA LEU A 138 -6.557 -2.840 0.792 1.00 0.00 C ATOM 834 C LEU A 138 -6.756 -3.372 2.209 1.00 0.00 C ATOM 835 O LEU A 138 -6.671 -2.630 3.190 1.00 0.00 O ATOM 836 CB LEU A 138 -5.134 -2.283 0.625 1.00 0.00 C ATOM 837 CG LEU A 138 -4.801 -1.719 -0.762 1.00 0.00 C ATOM 838 CD1 LEU A 138 -3.324 -1.367 -0.850 1.00 0.00 C ATOM 839 CD2 LEU A 138 -5.185 -2.704 -1.857 1.00 0.00 C ATOM 0 H LEU A 138 -8.231 -2.155 -0.254 1.00 0.00 H new ATOM 0 HA LEU A 138 -6.677 -3.665 0.090 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.982 -1.496 1.363 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.423 -3.077 0.855 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.383 -0.810 -0.909 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.103 -0.968 -1.840 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.083 -0.619 -0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -2.726 -2.262 -0.678 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -4.939 -2.280 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.636 -3.635 -1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -6.256 -2.903 -1.808 1.00 0.00 H new ATOM 851 N GLU A 139 -7.030 -4.662 2.312 1.00 0.00 N ATOM 852 CA GLU A 139 -7.264 -5.282 3.605 1.00 0.00 C ATOM 853 C GLU A 139 -5.934 -5.643 4.262 1.00 0.00 C ATOM 854 O GLU A 139 -5.140 -6.398 3.700 1.00 0.00 O ATOM 855 CB GLU A 139 -8.142 -6.520 3.435 1.00 0.00 C ATOM 856 CG GLU A 139 -8.647 -7.096 4.744 1.00 0.00 C ATOM 857 CD GLU A 139 -9.680 -8.177 4.528 1.00 0.00 C ATOM 858 OE1 GLU A 139 -10.817 -7.843 4.128 1.00 0.00 O ATOM 859 OE2 GLU A 139 -9.365 -9.360 4.746 1.00 0.00 O ATOM 0 H GLU A 139 -7.096 -5.299 1.518 1.00 0.00 H new ATOM 0 HA GLU A 139 -7.784 -4.577 4.254 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.996 -6.265 2.807 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -7.575 -7.286 2.906 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -7.808 -7.504 5.308 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.079 -6.298 5.348 1.00 0.00 H new ATOM 866 N ASP A 140 -5.701 -5.103 5.457 1.00 0.00 N ATOM 867 CA ASP A 140 -4.421 -5.267 6.146 1.00 0.00 C ATOM 868 C ASP A 140 -4.230 -6.706 6.620 1.00 0.00 C ATOM 869 O ASP A 140 -3.110 -7.133 6.911 1.00 0.00 O ATOM 870 CB ASP A 140 -4.320 -4.303 7.332 1.00 0.00 C ATOM 871 CG ASP A 140 -5.067 -4.793 8.556 1.00 0.00 C ATOM 872 OD1 ASP A 140 -6.309 -4.891 8.500 1.00 0.00 O ATOM 873 OD2 ASP A 140 -4.408 -5.080 9.580 1.00 0.00 O ATOM 0 H ASP A 140 -6.384 -4.546 5.970 1.00 0.00 H new ATOM 0 HA ASP A 140 -3.628 -5.034 5.435 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.270 -4.158 7.587 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -4.714 -3.330 7.038 1.00 0.00 H new ATOM 878 N GLN A 141 -5.333 -7.444 6.684 1.00 0.00 N ATOM 879 CA GLN A 141 -5.312 -8.846 7.084 1.00 0.00 C ATOM 880 C GLN A 141 -4.652 -9.698 6.008 1.00 0.00 C ATOM 881 O GLN A 141 -4.116 -10.773 6.289 1.00 0.00 O ATOM 882 CB GLN A 141 -6.739 -9.343 7.322 1.00 0.00 C ATOM 883 CG GLN A 141 -7.480 -8.572 8.397 1.00 0.00 C ATOM 884 CD GLN A 141 -8.963 -8.900 8.450 1.00 0.00 C ATOM 885 OE1 GLN A 141 -9.324 -10.118 8.071 1.00 0.00 O flip ATOM 886 NE2 GLN A 141 -9.778 -8.059 8.833 1.00 0.00 N flip ATOM 0 H GLN A 141 -6.263 -7.089 6.461 1.00 0.00 H new ATOM 0 HA GLN A 141 -4.738 -8.932 8.006 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.298 -9.277 6.389 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -6.706 -10.397 7.600 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -7.031 -8.789 9.366 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -7.356 -7.504 8.220 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -9.460 -7.132 9.116 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -10.771 -8.290 8.867 1.00 0.00 H new ATOM 895 N LEU A 142 -4.684 -9.208 4.778 1.00 0.00 N ATOM 896 CA LEU A 142 -4.166 -9.950 3.642 1.00 0.00 C ATOM 897 C LEU A 142 -2.727 -9.542 3.342 1.00 0.00 C ATOM 898 O LEU A 142 -2.289 -8.453 3.727 1.00 0.00 O ATOM 899 CB LEU A 142 -5.050 -9.710 2.412 1.00 0.00 C ATOM 900 CG LEU A 142 -6.540 -10.023 2.605 1.00 0.00 C ATOM 901 CD1 LEU A 142 -7.309 -9.781 1.317 1.00 0.00 C ATOM 902 CD2 LEU A 142 -6.738 -11.458 3.077 1.00 0.00 C ATOM 0 H LEU A 142 -5.067 -8.293 4.542 1.00 0.00 H new ATOM 0 HA LEU A 142 -4.178 -11.012 3.888 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -4.951 -8.667 2.111 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -4.672 -10.316 1.589 1.00 0.00 H new ATOM 0 HG LEU A 142 -6.927 -9.353 3.373 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -8.363 -10.009 1.474 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -7.203 -8.737 1.021 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.913 -10.423 0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -7.802 -11.655 3.206 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -6.329 -12.145 2.336 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.224 -11.603 4.027 1.00 0.00 H new ATOM 914 N PRO A 143 -1.960 -10.419 2.673 1.00 0.00 N ATOM 915 CA PRO A 143 -0.592 -10.114 2.259 1.00 0.00 C ATOM 916 C PRO A 143 -0.561 -9.210 1.029 1.00 0.00 C ATOM 917 O PRO A 143 -1.494 -9.212 0.220 1.00 0.00 O ATOM 918 CB PRO A 143 -0.013 -11.487 1.927 1.00 0.00 C ATOM 919 CG PRO A 143 -1.187 -12.285 1.477 1.00 0.00 C ATOM 920 CD PRO A 143 -2.362 -11.788 2.277 1.00 0.00 C ATOM 0 HA PRO A 143 -0.035 -9.578 3.027 1.00 0.00 H new ATOM 0 HB2 PRO A 143 0.745 -11.420 1.147 1.00 0.00 H new ATOM 0 HB3 PRO A 143 0.464 -11.938 2.797 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -1.360 -12.155 0.409 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -1.023 -13.349 1.646 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -3.277 -11.781 1.684 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -2.550 -12.418 3.146 1.00 0.00 H new ATOM 928 N LEU A 144 0.515 -8.449 0.880 1.00 0.00 N ATOM 929 CA LEU A 144 0.634 -7.530 -0.242 1.00 0.00 C ATOM 930 C LEU A 144 0.852 -8.272 -1.550 1.00 0.00 C ATOM 931 O LEU A 144 0.555 -7.743 -2.614 1.00 0.00 O ATOM 932 CB LEU A 144 1.758 -6.520 -0.020 1.00 0.00 C ATOM 933 CG LEU A 144 1.320 -5.206 0.627 1.00 0.00 C ATOM 934 CD1 LEU A 144 2.504 -4.274 0.799 1.00 0.00 C ATOM 935 CD2 LEU A 144 0.247 -4.534 -0.214 1.00 0.00 C ATOM 0 H LEU A 144 1.312 -8.450 1.517 1.00 0.00 H new ATOM 0 HA LEU A 144 -0.309 -6.988 -0.308 1.00 0.00 H new ATOM 0 HB2 LEU A 144 2.522 -6.980 0.606 1.00 0.00 H new ATOM 0 HB3 LEU A 144 2.223 -6.298 -0.980 1.00 0.00 H new ATOM 0 HG LEU A 144 0.908 -5.431 1.611 1.00 0.00 H new ATOM 0 HD11 LEU A 144 2.171 -3.345 1.261 1.00 0.00 H new ATOM 0 HD12 LEU A 144 3.251 -4.748 1.435 1.00 0.00 H new ATOM 0 HD13 LEU A 144 2.942 -4.058 -0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -0.055 -3.600 0.260 1.00 0.00 H new ATOM 0 HD22 LEU A 144 0.642 -4.326 -1.209 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -0.617 -5.194 -0.297 1.00 0.00 H new ATOM 947 N GLY A 145 1.355 -9.500 -1.470 1.00 0.00 N ATOM 948 CA GLY A 145 1.550 -10.300 -2.666 1.00 0.00 C ATOM 949 C GLY A 145 0.262 -10.512 -3.441 1.00 0.00 C ATOM 950 O GLY A 145 0.275 -10.600 -4.668 1.00 0.00 O ATOM 0 H GLY A 145 1.631 -9.955 -0.600 1.00 0.00 H new ATOM 0 HA2 GLY A 145 2.281 -9.812 -3.310 1.00 0.00 H new ATOM 0 HA3 GLY A 145 1.966 -11.268 -2.388 1.00 0.00 H new ATOM 954 N GLU A 146 -0.857 -10.554 -2.725 1.00 0.00 N ATOM 955 CA GLU A 146 -2.157 -10.800 -3.337 1.00 0.00 C ATOM 956 C GLU A 146 -2.556 -9.641 -4.253 1.00 0.00 C ATOM 957 O GLU A 146 -3.171 -9.839 -5.300 1.00 0.00 O ATOM 958 CB GLU A 146 -3.217 -11.001 -2.250 1.00 0.00 C ATOM 959 CG GLU A 146 -4.521 -11.586 -2.762 1.00 0.00 C ATOM 960 CD GLU A 146 -4.354 -13.004 -3.270 1.00 0.00 C ATOM 961 OE1 GLU A 146 -4.414 -13.944 -2.451 1.00 0.00 O ATOM 962 OE2 GLU A 146 -4.154 -13.187 -4.491 1.00 0.00 O ATOM 0 H GLU A 146 -0.889 -10.420 -1.714 1.00 0.00 H new ATOM 0 HA GLU A 146 -2.087 -11.705 -3.941 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -2.813 -11.658 -1.480 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -3.422 -10.042 -1.775 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -5.261 -11.574 -1.962 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.908 -10.958 -3.564 1.00 0.00 H new ATOM 969 N TYR A 147 -2.192 -8.428 -3.856 1.00 0.00 N ATOM 970 CA TYR A 147 -2.520 -7.235 -4.633 1.00 0.00 C ATOM 971 C TYR A 147 -1.364 -6.840 -5.546 1.00 0.00 C ATOM 972 O TYR A 147 -1.561 -6.465 -6.703 1.00 0.00 O ATOM 973 CB TYR A 147 -2.825 -6.052 -3.707 1.00 0.00 C ATOM 974 CG TYR A 147 -3.997 -6.242 -2.770 1.00 0.00 C ATOM 975 CD1 TYR A 147 -5.298 -6.030 -3.204 1.00 0.00 C ATOM 976 CD2 TYR A 147 -3.798 -6.597 -1.441 1.00 0.00 C ATOM 977 CE1 TYR A 147 -6.370 -6.169 -2.339 1.00 0.00 C ATOM 978 CE2 TYR A 147 -4.862 -6.733 -0.570 1.00 0.00 C ATOM 979 CZ TYR A 147 -6.144 -6.518 -1.023 1.00 0.00 C ATOM 980 OH TYR A 147 -7.204 -6.635 -0.154 1.00 0.00 O ATOM 0 H TYR A 147 -1.669 -8.242 -3.000 1.00 0.00 H new ATOM 0 HA TYR A 147 -3.397 -7.475 -5.234 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -1.937 -5.841 -3.111 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -3.013 -5.172 -4.321 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -5.477 -5.752 -4.232 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -2.794 -6.770 -1.083 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -7.377 -6.005 -2.692 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -4.689 -7.006 0.460 1.00 0.00 H new ATOM 0 HH TYR A 147 -7.895 -7.202 -0.556 1.00 0.00 H new ATOM 990 N GLY A 148 -0.161 -6.947 -5.010 1.00 0.00 N ATOM 991 CA GLY A 148 1.014 -6.393 -5.650 1.00 0.00 C ATOM 992 C GLY A 148 1.811 -7.395 -6.454 1.00 0.00 C ATOM 993 O GLY A 148 2.907 -7.072 -6.901 1.00 0.00 O ATOM 0 H GLY A 148 0.026 -7.418 -4.125 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.707 -5.579 -6.307 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.660 -5.960 -4.886 1.00 0.00 H new ATOM 997 N LEU A 149 1.291 -8.619 -6.606 1.00 0.00 N ATOM 998 CA LEU A 149 1.971 -9.679 -7.371 1.00 0.00 C ATOM 999 C LEU A 149 2.594 -9.158 -8.672 1.00 0.00 C ATOM 1000 O LEU A 149 3.632 -9.657 -9.114 1.00 0.00 O ATOM 1001 CB LEU A 149 1.013 -10.844 -7.685 1.00 0.00 C ATOM 1002 CG LEU A 149 -0.116 -10.552 -8.686 1.00 0.00 C ATOM 1003 CD1 LEU A 149 -0.766 -11.851 -9.129 1.00 0.00 C ATOM 1004 CD2 LEU A 149 -1.168 -9.627 -8.082 1.00 0.00 C ATOM 0 H LEU A 149 0.396 -8.904 -6.208 1.00 0.00 H new ATOM 0 HA LEU A 149 2.779 -10.040 -6.735 1.00 0.00 H new ATOM 0 HB2 LEU A 149 1.603 -11.677 -8.069 1.00 0.00 H new ATOM 0 HB3 LEU A 149 0.562 -11.177 -6.750 1.00 0.00 H new ATOM 0 HG LEU A 149 0.322 -10.050 -9.549 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.565 -11.635 -9.838 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -0.020 -12.487 -9.606 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -1.180 -12.365 -8.262 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.952 -9.440 -8.815 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -1.601 -10.096 -7.199 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.703 -8.682 -7.800 1.00 0.00 H new ATOM 1016 N LYS A 150 1.961 -8.158 -9.278 1.00 0.00 N ATOM 1017 CA LYS A 150 2.522 -7.483 -10.440 1.00 0.00 C ATOM 1018 C LYS A 150 3.361 -6.289 -9.990 1.00 0.00 C ATOM 1019 O LYS A 150 2.854 -5.402 -9.307 1.00 0.00 O ATOM 1020 CB LYS A 150 1.410 -6.982 -11.364 1.00 0.00 C ATOM 1021 CG LYS A 150 0.468 -8.062 -11.865 1.00 0.00 C ATOM 1022 CD LYS A 150 -0.577 -7.470 -12.793 1.00 0.00 C ATOM 1023 CE LYS A 150 -1.578 -8.511 -13.256 1.00 0.00 C ATOM 1024 NZ LYS A 150 -2.616 -7.924 -14.146 1.00 0.00 N ATOM 0 H LYS A 150 1.055 -7.797 -8.980 1.00 0.00 H new ATOM 0 HA LYS A 150 3.144 -8.197 -10.980 1.00 0.00 H new ATOM 0 HB2 LYS A 150 0.828 -6.228 -10.834 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.865 -6.488 -12.223 1.00 0.00 H new ATOM 0 HG2 LYS A 150 1.034 -8.831 -12.390 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -0.021 -8.547 -11.020 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -1.102 -6.664 -12.281 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -0.085 -7.029 -13.660 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -1.055 -9.308 -13.784 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -2.058 -8.965 -12.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -3.281 -8.667 -14.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -3.132 -7.181 -13.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -2.161 -7.513 -14.986 1.00 0.00 H new ATOM 1038 N PRO A 151 4.644 -6.229 -10.379 1.00 0.00 N ATOM 1039 CA PRO A 151 5.533 -5.109 -10.024 1.00 0.00 C ATOM 1040 C PRO A 151 5.064 -3.782 -10.625 1.00 0.00 C ATOM 1041 O PRO A 151 5.579 -2.712 -10.298 1.00 0.00 O ATOM 1042 CB PRO A 151 6.889 -5.512 -10.621 1.00 0.00 C ATOM 1043 CG PRO A 151 6.787 -6.976 -10.874 1.00 0.00 C ATOM 1044 CD PRO A 151 5.342 -7.247 -11.175 1.00 0.00 C ATOM 0 HA PRO A 151 5.561 -4.945 -8.947 1.00 0.00 H new ATOM 0 HB2 PRO A 151 7.091 -4.967 -11.543 1.00 0.00 H new ATOM 0 HB3 PRO A 151 7.704 -5.287 -9.933 1.00 0.00 H new ATOM 0 HG2 PRO A 151 7.421 -7.272 -11.710 1.00 0.00 H new ATOM 0 HG3 PRO A 151 7.118 -7.546 -10.005 1.00 0.00 H new ATOM 0 HD2 PRO A 151 5.125 -7.147 -12.239 1.00 0.00 H new ATOM 0 HD3 PRO A 151 5.051 -8.256 -10.884 1.00 0.00 H new ATOM 1052 N LEU A 152 4.080 -3.860 -11.508 1.00 0.00 N ATOM 1053 CA LEU A 152 3.533 -2.680 -12.151 1.00 0.00 C ATOM 1054 C LEU A 152 2.167 -2.323 -11.572 1.00 0.00 C ATOM 1055 O LEU A 152 1.474 -1.446 -12.088 1.00 0.00 O ATOM 1056 CB LEU A 152 3.454 -2.888 -13.676 1.00 0.00 C ATOM 1057 CG LEU A 152 2.840 -4.214 -14.152 1.00 0.00 C ATOM 1058 CD1 LEU A 152 1.325 -4.211 -14.010 1.00 0.00 C ATOM 1059 CD2 LEU A 152 3.238 -4.490 -15.595 1.00 0.00 C ATOM 0 H LEU A 152 3.643 -4.736 -11.796 1.00 0.00 H new ATOM 0 HA LEU A 152 4.201 -1.842 -11.955 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.874 -2.070 -14.103 1.00 0.00 H new ATOM 0 HB3 LEU A 152 4.462 -2.812 -14.084 1.00 0.00 H new ATOM 0 HG LEU A 152 3.230 -5.010 -13.517 1.00 0.00 H new ATOM 0 HD11 LEU A 152 0.925 -5.164 -14.356 1.00 0.00 H new ATOM 0 HD12 LEU A 152 1.058 -4.064 -12.964 1.00 0.00 H new ATOM 0 HD13 LEU A 152 0.905 -3.403 -14.609 1.00 0.00 H new ATOM 0 HD21 LEU A 152 2.797 -5.432 -15.920 1.00 0.00 H new ATOM 0 HD22 LEU A 152 2.879 -3.682 -16.232 1.00 0.00 H new ATOM 0 HD23 LEU A 152 4.324 -4.554 -15.667 1.00 0.00 H new ATOM 1071 N SER A 153 1.785 -3.002 -10.495 1.00 0.00 N ATOM 1072 CA SER A 153 0.512 -2.730 -9.846 1.00 0.00 C ATOM 1073 C SER A 153 0.501 -1.310 -9.297 1.00 0.00 C ATOM 1074 O SER A 153 1.326 -0.946 -8.460 1.00 0.00 O ATOM 1075 CB SER A 153 0.241 -3.750 -8.736 1.00 0.00 C ATOM 1076 OG SER A 153 1.330 -3.832 -7.832 1.00 0.00 O ATOM 0 H SER A 153 2.337 -3.740 -10.057 1.00 0.00 H new ATOM 0 HA SER A 153 -0.285 -2.822 -10.583 1.00 0.00 H new ATOM 0 HB2 SER A 153 -0.663 -3.470 -8.195 1.00 0.00 H new ATOM 0 HB3 SER A 153 0.058 -4.730 -9.177 1.00 0.00 H new ATOM 0 HG SER A 153 1.917 -4.572 -8.093 1.00 0.00 H new ATOM 1082 N THR A 154 -0.413 -0.498 -9.803 1.00 0.00 N ATOM 1083 CA THR A 154 -0.487 0.889 -9.405 1.00 0.00 C ATOM 1084 C THR A 154 -1.568 1.097 -8.352 1.00 0.00 C ATOM 1085 O THR A 154 -2.764 1.050 -8.652 1.00 0.00 O ATOM 1086 CB THR A 154 -0.757 1.793 -10.619 1.00 0.00 C ATOM 1087 OG1 THR A 154 0.117 1.421 -11.695 1.00 0.00 O ATOM 1088 CG2 THR A 154 -0.534 3.258 -10.264 1.00 0.00 C ATOM 0 H THR A 154 -1.112 -0.780 -10.490 1.00 0.00 H new ATOM 0 HA THR A 154 0.476 1.161 -8.973 1.00 0.00 H new ATOM 0 HB THR A 154 -1.796 1.665 -10.924 1.00 0.00 H new ATOM 0 HG1 THR A 154 -0.055 1.995 -12.470 1.00 0.00 H new ATOM 0 HG21 THR A 154 -0.731 3.878 -11.138 1.00 0.00 H new ATOM 0 HG22 THR A 154 -1.209 3.544 -9.457 1.00 0.00 H new ATOM 0 HG23 THR A 154 0.498 3.401 -9.942 1.00 0.00 H new ATOM 1096 N VAL A 155 -1.138 1.302 -7.118 1.00 0.00 N ATOM 1097 CA VAL A 155 -2.048 1.599 -6.029 1.00 0.00 C ATOM 1098 C VAL A 155 -2.302 3.098 -5.979 1.00 0.00 C ATOM 1099 O VAL A 155 -1.368 3.892 -5.839 1.00 0.00 O ATOM 1100 CB VAL A 155 -1.486 1.124 -4.671 1.00 0.00 C ATOM 1101 CG1 VAL A 155 -2.478 1.398 -3.552 1.00 0.00 C ATOM 1102 CG2 VAL A 155 -1.126 -0.356 -4.725 1.00 0.00 C ATOM 0 H VAL A 155 -0.156 1.267 -6.846 1.00 0.00 H new ATOM 0 HA VAL A 155 -2.980 1.064 -6.211 1.00 0.00 H new ATOM 0 HB VAL A 155 -0.576 1.687 -4.463 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -2.062 1.055 -2.605 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -2.676 2.468 -3.495 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -3.408 0.867 -3.752 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -0.732 -0.670 -3.758 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -2.017 -0.939 -4.961 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -0.372 -0.519 -5.495 1.00 0.00 H new ATOM 1112 N PHE A 156 -3.557 3.488 -6.113 1.00 0.00 N ATOM 1113 CA PHE A 156 -3.907 4.896 -6.142 1.00 0.00 C ATOM 1114 C PHE A 156 -4.267 5.390 -4.751 1.00 0.00 C ATOM 1115 O PHE A 156 -5.313 5.036 -4.199 1.00 0.00 O ATOM 1116 CB PHE A 156 -5.062 5.147 -7.116 1.00 0.00 C ATOM 1117 CG PHE A 156 -4.675 4.951 -8.553 1.00 0.00 C ATOM 1118 CD1 PHE A 156 -4.098 5.986 -9.270 1.00 0.00 C ATOM 1119 CD2 PHE A 156 -4.880 3.736 -9.184 1.00 0.00 C ATOM 1120 CE1 PHE A 156 -3.735 5.813 -10.589 1.00 0.00 C ATOM 1121 CE2 PHE A 156 -4.516 3.559 -10.504 1.00 0.00 C ATOM 1122 CZ PHE A 156 -3.944 4.598 -11.206 1.00 0.00 C ATOM 0 H PHE A 156 -4.349 2.851 -6.203 1.00 0.00 H new ATOM 0 HA PHE A 156 -3.037 5.454 -6.489 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -5.886 4.476 -6.873 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -5.429 6.164 -6.980 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -3.931 6.939 -8.791 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -5.329 2.919 -8.639 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -3.288 6.628 -11.138 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -4.679 2.607 -10.986 1.00 0.00 H new ATOM 0 HZ PHE A 156 -3.660 4.460 -12.239 1.00 0.00 H new ATOM 1132 N MET A 157 -3.385 6.193 -4.181 1.00 0.00 N ATOM 1133 CA MET A 157 -3.629 6.794 -2.887 1.00 0.00 C ATOM 1134 C MET A 157 -4.427 8.073 -3.063 1.00 0.00 C ATOM 1135 O MET A 157 -3.890 9.109 -3.445 1.00 0.00 O ATOM 1136 CB MET A 157 -2.311 7.076 -2.162 1.00 0.00 C ATOM 1137 CG MET A 157 -2.490 7.752 -0.812 1.00 0.00 C ATOM 1138 SD MET A 157 -0.927 8.014 0.046 1.00 0.00 S ATOM 1139 CE MET A 157 -1.495 8.888 1.502 1.00 0.00 C ATOM 0 H MET A 157 -2.489 6.443 -4.599 1.00 0.00 H new ATOM 0 HA MET A 157 -4.203 6.097 -2.276 1.00 0.00 H new ATOM 0 HB2 MET A 157 -1.776 6.137 -2.020 1.00 0.00 H new ATOM 0 HB3 MET A 157 -1.686 7.707 -2.794 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.988 8.711 -0.954 1.00 0.00 H new ATOM 0 HG3 MET A 157 -3.144 7.143 -0.189 1.00 0.00 H new ATOM 0 HE1 MET A 157 -0.934 8.548 2.372 1.00 0.00 H new ATOM 0 HE2 MET A 157 -1.341 9.959 1.367 1.00 0.00 H new ATOM 0 HE3 MET A 157 -2.556 8.690 1.654 1.00 0.00 H new ATOM 1149 N ASN A 158 -5.719 7.986 -2.814 1.00 0.00 N ATOM 1150 CA ASN A 158 -6.594 9.131 -2.968 1.00 0.00 C ATOM 1151 C ASN A 158 -6.593 9.951 -1.690 1.00 0.00 C ATOM 1152 O ASN A 158 -6.669 9.403 -0.596 1.00 0.00 O ATOM 1153 CB ASN A 158 -8.018 8.684 -3.303 1.00 0.00 C ATOM 1154 CG ASN A 158 -8.114 7.918 -4.612 1.00 0.00 C ATOM 1155 OD1 ASN A 158 -8.279 8.506 -5.680 1.00 0.00 O ATOM 1156 ND2 ASN A 158 -8.038 6.599 -4.535 1.00 0.00 N ATOM 0 H ASN A 158 -6.186 7.134 -2.504 1.00 0.00 H new ATOM 0 HA ASN A 158 -6.225 9.743 -3.791 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -8.395 8.057 -2.495 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -8.664 9.560 -3.354 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -8.117 6.033 -5.380 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -7.901 6.148 -3.630 1.00 0.00 H new ATOM 1163 N LEU A 159 -6.498 11.261 -1.822 1.00 0.00 N ATOM 1164 CA LEU A 159 -6.489 12.134 -0.656 1.00 0.00 C ATOM 1165 C LEU A 159 -7.875 12.706 -0.401 1.00 0.00 C ATOM 1166 O LEU A 159 -8.030 13.722 0.274 1.00 0.00 O ATOM 1167 CB LEU A 159 -5.458 13.248 -0.830 1.00 0.00 C ATOM 1168 CG LEU A 159 -4.005 12.796 -0.679 1.00 0.00 C ATOM 1169 CD1 LEU A 159 -3.053 13.902 -1.107 1.00 0.00 C ATOM 1170 CD2 LEU A 159 -3.727 12.385 0.762 1.00 0.00 C ATOM 0 H LEU A 159 -6.426 11.744 -2.717 1.00 0.00 H new ATOM 0 HA LEU A 159 -6.206 11.544 0.215 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -5.586 13.694 -1.817 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -5.660 14.030 -0.098 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.843 11.934 -1.326 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -2.024 13.561 -0.992 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -3.237 14.156 -2.151 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -3.215 14.782 -0.485 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -2.689 12.065 0.855 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -3.907 13.233 1.423 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -4.386 11.562 1.039 1.00 0.00 H new ATOM 1182 N ARG A 160 -8.881 12.039 -0.943 1.00 0.00 N ATOM 1183 CA ARG A 160 -10.258 12.405 -0.675 1.00 0.00 C ATOM 1184 C ARG A 160 -10.616 11.984 0.744 1.00 0.00 C ATOM 1185 O ARG A 160 -10.808 10.798 1.022 1.00 0.00 O ATOM 1186 CB ARG A 160 -11.198 11.742 -1.683 1.00 0.00 C ATOM 1187 CG ARG A 160 -12.650 12.158 -1.525 1.00 0.00 C ATOM 1188 CD ARG A 160 -12.885 13.583 -2.005 1.00 0.00 C ATOM 1189 NE ARG A 160 -14.219 14.063 -1.642 1.00 0.00 N ATOM 1190 CZ ARG A 160 -15.118 14.522 -2.509 1.00 0.00 C ATOM 1191 NH1 ARG A 160 -14.827 14.597 -3.805 1.00 0.00 N ATOM 1192 NH2 ARG A 160 -16.315 14.907 -2.079 1.00 0.00 N ATOM 0 H ARG A 160 -8.768 11.243 -1.570 1.00 0.00 H new ATOM 0 HA ARG A 160 -10.370 13.485 -0.774 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -10.866 11.987 -2.692 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -11.125 10.660 -1.577 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -13.287 11.475 -2.087 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -12.940 12.075 -0.478 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -12.131 14.241 -1.573 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -12.764 13.627 -3.087 1.00 0.00 H new ATOM 0 HE ARG A 160 -14.478 14.044 -0.656 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -13.910 14.302 -4.140 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -15.521 14.950 -4.464 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -16.543 14.850 -1.086 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -17.006 15.259 -2.742 1.00 0.00 H new