USER MOD reduce.3.24.130724 H: found=0, std=0, add=638, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 641 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: B 134 GLN : amide:sc= -0.489! C(o=0.78!,f=-14!) USER MOD Set 1.2: B 173 LYS NZ :NH3+ 172:sc= 1.27 (180deg=0) USER MOD Set 2.1: B 142 GLN :FLIP amide:sc= -0.0347 F(o=-2.9!,f=-0.36) USER MOD Set 2.2: B 182 ASN : amide:sc= -0.327 K(o=-0.36,f=-9.5!) USER MOD Single : B 117 ASN : amide:sc= 0.505 K(o=0.51,f=-2) USER MOD Single : B 119 GLN : amide:sc= 0.221 K(o=0.22,f=-0.42) USER MOD Single : B 121 GLN : amide:sc= -2.84! C(o=-2.8!,f=-7.6!) USER MOD Single : B 137 SER OG : rot -37:sc= 0.528 USER MOD Single : B 138 SER OG : rot 119:sc= -1.69! USER MOD Single : B 140 ASN : amide:sc= -7.79! C(o=-7.8!,f=-13!) USER MOD Single : B 145 GLN : amide:sc= 0.532 K(o=0.53,f=0) USER MOD Single : B 152 SER OG : rot 180:sc= 0 USER MOD Single : B 153 ASN :FLIP amide:sc= 0 F(o=-0.83,f=0) USER MOD Single : B 156 SER OG : rot -18:sc= 0.0891 USER MOD Single : B 159 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : B 161 GLN : amide:sc= -0.0744 X(o=-0.074,f=-0.091) USER MOD Single : B 162 LYS NZ :NH3+ 139:sc= 0.801 (180deg=-0.294) USER MOD Single : B 163 GLN :FLIP amide:sc= -1.43 F(o=-2.1!,f=-1.4) USER MOD Single : B 166 LYS NZ :NH3+ -160:sc= -0.0468 (180deg=-0.385) USER MOD Single : B 176 GLN : amide:sc= 0.583 K(o=0.58,f=-0.21) USER MOD Single : B 178 GLN : amide:sc= -1.01 K(o=-1,f=-2) USER MOD Single : B 179 SER OG : rot 180:sc= 0 USER MOD Single : B 180 HIS : no HE2:sc= 0.738 K(o=0.74,f=-4.1!) USER MOD Single : B 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 186 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : B 187 LYS NZ :NH3+ 161:sc= -0.0775 (180deg=-0.471) USER MOD Single : B 190 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : B 195 LYS NZ :NH3+ -164:sc= 2.23 (180deg=1.67) USER MOD Single : B 197 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : B 198 SER OG : rot 180:sc= 0 USER MOD Single : B 199 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY B 116 -10.123 7.135 -11.211 1.00 43.50 N ATOM 2 CA GLY B 116 -10.674 7.584 -9.948 1.00 51.03 C ATOM 3 C GLY B 116 -9.614 7.577 -8.885 1.00 55.12 C ATOM 4 O GLY B 116 -9.275 6.526 -8.357 1.00 71.11 O ATOM 0 HA2 GLY B 116 -11.082 8.589 -10.058 1.00 51.03 H new ATOM 0 HA3 GLY B 116 -11.499 6.936 -9.653 1.00 51.03 H new ATOM 10 N ASN B 117 -9.065 8.732 -8.596 1.00 42.41 N ATOM 11 CA ASN B 117 -7.998 8.857 -7.612 1.00 13.23 C ATOM 12 C ASN B 117 -8.604 9.060 -6.235 1.00 52.13 C ATOM 13 O ASN B 117 -8.188 8.446 -5.254 1.00 15.13 O ATOM 14 CB ASN B 117 -7.095 10.037 -7.977 1.00 73.32 C ATOM 15 CG ASN B 117 -5.821 10.129 -7.144 1.00 54.21 C ATOM 16 OD1 ASN B 117 -4.803 9.556 -7.506 1.00 63.23 O ATOM 17 ND2 ASN B 117 -5.834 10.905 -6.092 1.00 10.35 N ATOM 0 H ASN B 117 -9.339 9.613 -9.030 1.00 42.41 H new ATOM 0 HA ASN B 117 -7.397 7.948 -7.604 1.00 13.23 H new ATOM 0 HB2 ASN B 117 -6.823 9.960 -9.030 1.00 73.32 H new ATOM 0 HB3 ASN B 117 -7.660 10.962 -7.861 1.00 73.32 H new ATOM 0 HD21 ASN B 117 -4.981 11.045 -5.551 1.00 10.35 H new ATOM 0 HD22 ASN B 117 -6.697 11.371 -5.812 1.00 10.35 H new ATOM 24 N GLU B 118 -9.616 9.903 -6.170 1.00 24.14 N ATOM 25 CA GLU B 118 -10.314 10.138 -4.932 1.00 20.43 C ATOM 26 C GLU B 118 -11.455 9.143 -4.852 1.00 64.51 C ATOM 27 O GLU B 118 -12.579 9.428 -5.284 1.00 4.54 O ATOM 28 CB GLU B 118 -10.869 11.579 -4.821 1.00 44.13 C ATOM 29 CG GLU B 118 -9.840 12.720 -4.789 1.00 15.24 C ATOM 30 CD GLU B 118 -9.045 12.885 -6.063 1.00 74.53 C ATOM 31 OE1 GLU B 118 -9.628 13.268 -7.104 1.00 53.31 O ATOM 32 OE2 GLU B 118 -7.824 12.663 -6.042 1.00 52.43 O1- ATOM 0 H GLU B 118 -9.970 10.435 -6.965 1.00 24.14 H new ATOM 0 HA GLU B 118 -9.611 10.013 -4.108 1.00 20.43 H new ATOM 0 HB2 GLU B 118 -11.539 11.750 -5.663 1.00 44.13 H new ATOM 0 HB3 GLU B 118 -11.473 11.641 -3.916 1.00 44.13 H new ATOM 0 HG2 GLU B 118 -10.359 13.654 -4.577 1.00 15.24 H new ATOM 0 HG3 GLU B 118 -9.149 12.545 -3.965 1.00 15.24 H new ATOM 39 N GLN B 119 -11.151 7.964 -4.385 1.00 61.40 N ATOM 40 CA GLN B 119 -12.125 6.887 -4.346 1.00 31.52 C ATOM 41 C GLN B 119 -12.880 6.885 -3.032 1.00 32.23 C ATOM 42 O GLN B 119 -12.675 7.760 -2.178 1.00 54.13 O ATOM 43 CB GLN B 119 -11.434 5.540 -4.530 1.00 41.20 C ATOM 44 CG GLN B 119 -10.532 5.475 -5.738 1.00 1.52 C ATOM 45 CD GLN B 119 -9.956 4.102 -5.968 1.00 61.52 C ATOM 46 OE1 GLN B 119 -9.773 3.322 -5.037 1.00 24.42 O ATOM 47 NE2 GLN B 119 -9.608 3.813 -7.193 1.00 12.13 N ATOM 0 H GLN B 119 -10.231 7.715 -4.021 1.00 61.40 H new ATOM 0 HA GLN B 119 -12.832 7.049 -5.160 1.00 31.52 H new ATOM 0 HB2 GLN B 119 -10.847 5.319 -3.638 1.00 41.20 H new ATOM 0 HB3 GLN B 119 -12.193 4.762 -4.613 1.00 41.20 H new ATOM 0 HG2 GLN B 119 -11.094 5.780 -6.621 1.00 1.52 H new ATOM 0 HG3 GLN B 119 -9.718 6.189 -5.616 1.00 1.52 H new ATOM 0 HE21 GLN B 119 -9.775 4.484 -7.942 1.00 12.13 H new ATOM 0 HE22 GLN B 119 -9.169 2.916 -7.400 1.00 12.13 H new ATOM 56 N ILE B 120 -13.753 5.925 -2.880 1.00 13.15 N ATOM 57 CA ILE B 120 -14.486 5.756 -1.657 1.00 72.34 C ATOM 58 C ILE B 120 -13.616 5.017 -0.648 1.00 63.42 C ATOM 59 O ILE B 120 -13.170 3.900 -0.897 1.00 15.52 O ATOM 60 CB ILE B 120 -15.851 5.030 -1.878 1.00 14.33 C ATOM 61 CG1 ILE B 120 -15.670 3.702 -2.659 1.00 2.13 C ATOM 62 CG2 ILE B 120 -16.824 5.960 -2.593 1.00 74.13 C ATOM 63 CD1 ILE B 120 -16.952 2.909 -2.868 1.00 15.40 C ATOM 0 H ILE B 120 -13.975 5.239 -3.601 1.00 13.15 H new ATOM 0 HA ILE B 120 -14.732 6.743 -1.265 1.00 72.34 H new ATOM 0 HB ILE B 120 -16.264 4.773 -0.903 1.00 14.33 H new ATOM 0 HG12 ILE B 120 -15.234 3.925 -3.633 1.00 2.13 H new ATOM 0 HG13 ILE B 120 -14.955 3.077 -2.125 1.00 2.13 H new ATOM 0 HG21 ILE B 120 -17.774 5.447 -2.744 1.00 74.13 H new ATOM 0 HG22 ILE B 120 -16.986 6.852 -1.988 1.00 74.13 H new ATOM 0 HG23 ILE B 120 -16.409 6.247 -3.559 1.00 74.13 H new ATOM 0 HD11 ILE B 120 -16.730 1.997 -3.422 1.00 15.40 H new ATOM 0 HD12 ILE B 120 -17.381 2.650 -1.900 1.00 15.40 H new ATOM 0 HD13 ILE B 120 -17.665 3.511 -3.431 1.00 15.40 H new ATOM 75 N GLN B 121 -13.330 5.666 0.447 1.00 31.15 N ATOM 76 CA GLN B 121 -12.459 5.096 1.452 1.00 74.41 C ATOM 77 C GLN B 121 -13.166 4.970 2.792 1.00 73.22 C ATOM 78 O GLN B 121 -13.002 3.987 3.512 1.00 63.31 O ATOM 79 CB GLN B 121 -11.164 5.913 1.579 1.00 50.23 C ATOM 80 CG GLN B 121 -11.344 7.381 1.954 1.00 22.34 C ATOM 81 CD GLN B 121 -10.017 8.083 2.110 1.00 14.12 C ATOM 82 OE1 GLN B 121 -9.024 7.468 2.471 1.00 73.01 O ATOM 83 NE2 GLN B 121 -9.985 9.366 1.863 1.00 74.34 N ATOM 0 H GLN B 121 -13.687 6.595 0.672 1.00 31.15 H new ATOM 0 HA GLN B 121 -12.191 4.090 1.130 1.00 74.41 H new ATOM 0 HB2 GLN B 121 -10.530 5.440 2.329 1.00 50.23 H new ATOM 0 HB3 GLN B 121 -10.629 5.862 0.631 1.00 50.23 H new ATOM 0 HG2 GLN B 121 -11.934 7.883 1.187 1.00 22.34 H new ATOM 0 HG3 GLN B 121 -11.906 7.453 2.885 1.00 22.34 H new ATOM 0 HE21 GLN B 121 -10.832 9.849 1.563 1.00 74.34 H new ATOM 0 HE22 GLN B 121 -9.113 9.884 1.970 1.00 74.34 H new ATOM 92 N ALA B 122 -13.980 5.942 3.114 1.00 41.21 N ATOM 93 CA ALA B 122 -14.695 5.917 4.349 1.00 24.13 C ATOM 94 C ALA B 122 -16.058 5.315 4.116 1.00 2.40 C ATOM 95 O ALA B 122 -17.081 6.012 4.093 1.00 73.44 O ATOM 96 CB ALA B 122 -14.789 7.306 4.955 1.00 72.12 C ATOM 0 H ALA B 122 -14.160 6.760 2.532 1.00 41.21 H new ATOM 0 HA ALA B 122 -14.157 5.299 5.068 1.00 24.13 H new ATOM 0 HB1 ALA B 122 -15.339 7.256 5.895 1.00 72.12 H new ATOM 0 HB2 ALA B 122 -13.786 7.690 5.141 1.00 72.12 H new ATOM 0 HB3 ALA B 122 -15.310 7.970 4.265 1.00 72.12 H new ATOM 102 N VAL B 123 -16.057 4.039 3.846 1.00 32.32 N ATOM 103 CA VAL B 123 -17.253 3.306 3.572 1.00 1.33 C ATOM 104 C VAL B 123 -17.067 1.854 3.987 1.00 40.25 C ATOM 105 O VAL B 123 -16.063 1.215 3.656 1.00 2.34 O ATOM 106 CB VAL B 123 -17.672 3.418 2.060 1.00 22.10 C ATOM 107 CG1 VAL B 123 -16.573 2.931 1.124 1.00 31.50 C ATOM 108 CG2 VAL B 123 -18.981 2.686 1.783 1.00 61.11 C ATOM 0 H VAL B 123 -15.209 3.474 3.811 1.00 32.32 H new ATOM 0 HA VAL B 123 -18.065 3.740 4.155 1.00 1.33 H new ATOM 0 HB VAL B 123 -17.830 4.478 1.859 1.00 22.10 H new ATOM 0 HG11 VAL B 123 -16.906 3.027 0.091 1.00 31.50 H new ATOM 0 HG12 VAL B 123 -15.676 3.532 1.273 1.00 31.50 H new ATOM 0 HG13 VAL B 123 -16.350 1.886 1.338 1.00 31.50 H new ATOM 0 HG21 VAL B 123 -19.238 2.786 0.728 1.00 61.11 H new ATOM 0 HG22 VAL B 123 -18.867 1.631 2.030 1.00 61.11 H new ATOM 0 HG23 VAL B 123 -19.775 3.118 2.392 1.00 61.11 H new ATOM 118 N ILE B 124 -17.987 1.365 4.756 1.00 62.51 N ATOM 119 CA ILE B 124 -17.950 0.003 5.192 1.00 71.11 C ATOM 120 C ILE B 124 -18.745 -0.864 4.224 1.00 0.30 C ATOM 121 O ILE B 124 -19.980 -0.816 4.177 1.00 33.21 O ATOM 122 CB ILE B 124 -18.415 -0.178 6.694 1.00 52.55 C ATOM 123 CG1 ILE B 124 -17.320 0.272 7.697 1.00 73.02 C ATOM 124 CG2 ILE B 124 -18.820 -1.610 7.000 1.00 35.02 C ATOM 125 CD1 ILE B 124 -16.980 1.746 7.689 1.00 64.21 C ATOM 0 H ILE B 124 -18.786 1.898 5.100 1.00 62.51 H new ATOM 0 HA ILE B 124 -16.912 -0.328 5.181 1.00 71.11 H new ATOM 0 HB ILE B 124 -19.288 0.463 6.815 1.00 52.55 H new ATOM 0 HG12 ILE B 124 -17.641 -0.001 8.702 1.00 73.02 H new ATOM 0 HG13 ILE B 124 -16.411 -0.292 7.489 1.00 73.02 H new ATOM 0 HG21 ILE B 124 -19.131 -1.685 8.042 1.00 35.02 H new ATOM 0 HG22 ILE B 124 -19.647 -1.901 6.352 1.00 35.02 H new ATOM 0 HG23 ILE B 124 -17.973 -2.273 6.826 1.00 35.02 H new ATOM 0 HD11 ILE B 124 -16.204 1.944 8.428 1.00 64.21 H new ATOM 0 HD12 ILE B 124 -16.620 2.031 6.700 1.00 64.21 H new ATOM 0 HD13 ILE B 124 -17.870 2.326 7.932 1.00 64.21 H new ATOM 137 N ASP B 125 -18.018 -1.568 3.396 1.00 72.44 N ATOM 138 CA ASP B 125 -18.566 -2.492 2.418 1.00 72.14 C ATOM 139 C ASP B 125 -17.502 -3.507 2.097 1.00 42.52 C ATOM 140 O ASP B 125 -16.330 -3.148 2.013 1.00 35.22 O ATOM 141 CB ASP B 125 -18.992 -1.762 1.135 1.00 54.42 C ATOM 142 CG ASP B 125 -19.445 -2.716 0.047 1.00 62.03 C ATOM 143 OD1 ASP B 125 -20.623 -3.132 0.044 1.00 52.23 O1- ATOM 144 OD2 ASP B 125 -18.623 -3.076 -0.810 1.00 71.31 O ATOM 0 H ASP B 125 -16.999 -1.518 3.377 1.00 72.44 H new ATOM 0 HA ASP B 125 -19.453 -2.972 2.831 1.00 72.14 H new ATOM 0 HB2 ASP B 125 -19.801 -1.070 1.367 1.00 54.42 H new ATOM 0 HB3 ASP B 125 -18.158 -1.165 0.766 1.00 54.42 H new ATOM 149 N ALA B 126 -17.897 -4.748 1.909 1.00 42.32 N ATOM 150 CA ALA B 126 -16.983 -5.859 1.666 1.00 24.12 C ATOM 151 C ALA B 126 -16.131 -5.671 0.405 1.00 75.33 C ATOM 152 O ALA B 126 -15.031 -6.227 0.306 1.00 30.15 O ATOM 153 CB ALA B 126 -17.751 -7.170 1.600 1.00 5.20 C ATOM 0 H ALA B 126 -18.879 -5.025 1.920 1.00 42.32 H new ATOM 0 HA ALA B 126 -16.290 -5.886 2.507 1.00 24.12 H new ATOM 0 HB1 ALA B 126 -17.056 -7.990 1.418 1.00 5.20 H new ATOM 0 HB2 ALA B 126 -18.269 -7.336 2.544 1.00 5.20 H new ATOM 0 HB3 ALA B 126 -18.479 -7.125 0.790 1.00 5.20 H new ATOM 159 N GLY B 127 -16.618 -4.898 -0.544 1.00 40.01 N ATOM 160 CA GLY B 127 -15.885 -4.674 -1.767 1.00 12.24 C ATOM 161 C GLY B 127 -14.952 -3.488 -1.652 1.00 34.14 C ATOM 162 O GLY B 127 -14.060 -3.302 -2.486 1.00 44.31 O ATOM 0 H GLY B 127 -17.516 -4.417 -0.490 1.00 40.01 H new ATOM 0 HA2 GLY B 127 -15.310 -5.566 -2.015 1.00 12.24 H new ATOM 0 HA3 GLY B 127 -16.585 -4.508 -2.586 1.00 12.24 H new ATOM 166 N ALA B 128 -15.132 -2.705 -0.606 1.00 63.14 N ATOM 167 CA ALA B 128 -14.319 -1.524 -0.389 1.00 40.55 C ATOM 168 C ALA B 128 -12.958 -1.897 0.181 1.00 61.14 C ATOM 169 O ALA B 128 -11.961 -1.238 -0.101 1.00 12.21 O ATOM 170 CB ALA B 128 -15.033 -0.539 0.523 1.00 63.33 C ATOM 0 H ALA B 128 -15.839 -2.867 0.111 1.00 63.14 H new ATOM 0 HA ALA B 128 -14.160 -1.042 -1.354 1.00 40.55 H new ATOM 0 HB1 ALA B 128 -14.405 0.339 0.672 1.00 63.33 H new ATOM 0 HB2 ALA B 128 -15.976 -0.238 0.066 1.00 63.33 H new ATOM 0 HB3 ALA B 128 -15.231 -1.011 1.485 1.00 63.33 H new ATOM 176 N LEU B 129 -12.908 -2.983 0.949 1.00 55.53 N ATOM 177 CA LEU B 129 -11.646 -3.413 1.561 1.00 45.21 C ATOM 178 C LEU B 129 -10.545 -3.733 0.514 1.00 33.52 C ATOM 179 O LEU B 129 -9.434 -3.259 0.650 1.00 22.43 O ATOM 180 CB LEU B 129 -11.798 -4.549 2.610 1.00 71.14 C ATOM 181 CG LEU B 129 -12.701 -4.279 3.840 1.00 72.10 C ATOM 182 CD1 LEU B 129 -12.559 -2.857 4.373 1.00 71.02 C ATOM 183 CD2 LEU B 129 -14.144 -4.635 3.575 1.00 45.41 C ATOM 0 H LEU B 129 -13.711 -3.575 1.162 1.00 55.53 H new ATOM 0 HA LEU B 129 -11.309 -2.542 2.124 1.00 45.21 H new ATOM 0 HB2 LEU B 129 -12.185 -5.429 2.097 1.00 71.14 H new ATOM 0 HB3 LEU B 129 -10.803 -4.804 2.974 1.00 71.14 H new ATOM 0 HG LEU B 129 -12.345 -4.943 4.628 1.00 72.10 H new ATOM 0 HD11 LEU B 129 -13.214 -2.724 5.234 1.00 71.02 H new ATOM 0 HD12 LEU B 129 -11.526 -2.682 4.673 1.00 71.02 H new ATOM 0 HD13 LEU B 129 -12.836 -2.147 3.594 1.00 71.02 H new ATOM 0 HD21 LEU B 129 -14.739 -4.429 4.465 1.00 45.41 H new ATOM 0 HD22 LEU B 129 -14.519 -4.040 2.742 1.00 45.41 H new ATOM 0 HD23 LEU B 129 -14.218 -5.694 3.326 1.00 45.41 H new ATOM 195 N PRO B 130 -10.813 -4.542 -0.550 1.00 0.32 N ATOM 196 CA PRO B 130 -9.835 -4.747 -1.622 1.00 63.11 C ATOM 197 C PRO B 130 -9.423 -3.432 -2.287 1.00 21.50 C ATOM 198 O PRO B 130 -8.286 -3.266 -2.666 1.00 1.14 O ATOM 199 CB PRO B 130 -10.583 -5.609 -2.626 1.00 74.52 C ATOM 200 CG PRO B 130 -11.558 -6.352 -1.799 1.00 3.43 C ATOM 201 CD PRO B 130 -12.010 -5.371 -0.770 1.00 14.32 C ATOM 0 HA PRO B 130 -8.915 -5.194 -1.246 1.00 63.11 H new ATOM 0 HB2 PRO B 130 -11.081 -5.001 -3.382 1.00 74.52 H new ATOM 0 HB3 PRO B 130 -9.909 -6.284 -3.153 1.00 74.52 H new ATOM 0 HG2 PRO B 130 -12.395 -6.710 -2.399 1.00 3.43 H new ATOM 0 HG3 PRO B 130 -11.100 -7.227 -1.337 1.00 3.43 H new ATOM 0 HD2 PRO B 130 -12.853 -4.776 -1.123 1.00 14.32 H new ATOM 0 HD3 PRO B 130 -12.331 -5.867 0.146 1.00 14.32 H new ATOM 209 N ALA B 131 -10.343 -2.485 -2.373 1.00 12.31 N ATOM 210 CA ALA B 131 -10.075 -1.211 -3.042 1.00 41.31 C ATOM 211 C ALA B 131 -9.000 -0.409 -2.332 1.00 3.12 C ATOM 212 O ALA B 131 -8.223 0.300 -2.985 1.00 52.45 O ATOM 213 CB ALA B 131 -11.346 -0.396 -3.223 1.00 12.14 C ATOM 0 H ALA B 131 -11.284 -2.569 -1.989 1.00 12.31 H new ATOM 0 HA ALA B 131 -9.693 -1.450 -4.034 1.00 41.31 H new ATOM 0 HB1 ALA B 131 -11.108 0.543 -3.723 1.00 12.14 H new ATOM 0 HB2 ALA B 131 -12.056 -0.959 -3.828 1.00 12.14 H new ATOM 0 HB3 ALA B 131 -11.786 -0.187 -2.248 1.00 12.14 H new ATOM 219 N LEU B 132 -8.916 -0.549 -1.019 1.00 31.23 N ATOM 220 CA LEU B 132 -7.896 0.158 -0.271 1.00 71.30 C ATOM 221 C LEU B 132 -6.524 -0.485 -0.480 1.00 32.55 C ATOM 222 O LEU B 132 -5.493 0.153 -0.326 1.00 34.51 O ATOM 223 CB LEU B 132 -8.277 0.305 1.234 1.00 34.00 C ATOM 224 CG LEU B 132 -8.433 -0.971 2.105 1.00 41.21 C ATOM 225 CD1 LEU B 132 -7.090 -1.573 2.541 1.00 25.22 C ATOM 226 CD2 LEU B 132 -9.328 -0.705 3.305 1.00 65.03 C ATOM 0 H LEU B 132 -9.533 -1.137 -0.458 1.00 31.23 H new ATOM 0 HA LEU B 132 -7.832 1.174 -0.661 1.00 71.30 H new ATOM 0 HB2 LEU B 132 -7.520 0.932 1.704 1.00 34.00 H new ATOM 0 HB3 LEU B 132 -9.219 0.852 1.282 1.00 34.00 H new ATOM 0 HG LEU B 132 -8.911 -1.718 1.472 1.00 41.21 H new ATOM 0 HD11 LEU B 132 -7.269 -2.462 3.146 1.00 25.22 H new ATOM 0 HD12 LEU B 132 -6.510 -1.845 1.659 1.00 25.22 H new ATOM 0 HD13 LEU B 132 -6.536 -0.840 3.127 1.00 25.22 H new ATOM 0 HD21 LEU B 132 -9.421 -1.615 3.898 1.00 65.03 H new ATOM 0 HD22 LEU B 132 -8.891 0.084 3.917 1.00 65.03 H new ATOM 0 HD23 LEU B 132 -10.314 -0.394 2.961 1.00 65.03 H new ATOM 238 N VAL B 133 -6.518 -1.762 -0.801 1.00 20.30 N ATOM 239 CA VAL B 133 -5.278 -2.446 -1.062 1.00 2.44 C ATOM 240 C VAL B 133 -4.833 -2.271 -2.489 1.00 41.43 C ATOM 241 O VAL B 133 -3.650 -2.373 -2.808 1.00 11.14 O ATOM 242 CB VAL B 133 -5.346 -3.925 -0.693 1.00 33.41 C ATOM 243 CG1 VAL B 133 -5.831 -4.841 -1.769 1.00 1.21 C ATOM 244 CG2 VAL B 133 -4.101 -4.385 -0.059 1.00 60.04 C ATOM 0 H VAL B 133 -7.354 -2.340 -0.886 1.00 20.30 H new ATOM 0 HA VAL B 133 -4.530 -1.983 -0.418 1.00 2.44 H new ATOM 0 HB VAL B 133 -6.140 -3.986 0.051 1.00 33.41 H new ATOM 0 HG11 VAL B 133 -5.839 -5.866 -1.398 1.00 1.21 H new ATOM 0 HG12 VAL B 133 -6.840 -4.554 -2.064 1.00 1.21 H new ATOM 0 HG13 VAL B 133 -5.168 -4.772 -2.631 1.00 1.21 H new ATOM 0 HG21 VAL B 133 -4.188 -5.443 0.189 1.00 60.04 H new ATOM 0 HG22 VAL B 133 -3.268 -4.241 -0.747 1.00 60.04 H new ATOM 0 HG23 VAL B 133 -3.923 -3.812 0.851 1.00 60.04 H new ATOM 254 N GLN B 134 -5.793 -2.008 -3.337 1.00 51.03 N ATOM 255 CA GLN B 134 -5.559 -1.925 -4.763 1.00 1.43 C ATOM 256 C GLN B 134 -4.500 -0.898 -5.142 1.00 10.22 C ATOM 257 O GLN B 134 -3.666 -1.155 -6.008 1.00 3.33 O ATOM 258 CB GLN B 134 -6.831 -1.681 -5.580 1.00 62.21 C ATOM 259 CG GLN B 134 -7.825 -2.835 -5.634 1.00 72.32 C ATOM 260 CD GLN B 134 -7.285 -4.101 -6.294 1.00 12.24 C ATOM 261 OE1 GLN B 134 -6.091 -4.416 -6.239 1.00 42.42 O ATOM 262 NE2 GLN B 134 -8.159 -4.827 -6.930 1.00 42.35 N ATOM 0 H GLN B 134 -6.762 -1.844 -3.062 1.00 51.03 H new ATOM 0 HA GLN B 134 -5.181 -2.914 -5.021 1.00 1.43 H new ATOM 0 HB2 GLN B 134 -7.340 -0.809 -5.170 1.00 62.21 H new ATOM 0 HB3 GLN B 134 -6.541 -1.430 -6.600 1.00 62.21 H new ATOM 0 HG2 GLN B 134 -8.140 -3.075 -4.619 1.00 72.32 H new ATOM 0 HG3 GLN B 134 -8.713 -2.508 -6.175 1.00 72.32 H new ATOM 0 HE21 GLN B 134 -9.137 -4.540 -6.957 1.00 42.35 H new ATOM 0 HE22 GLN B 134 -7.865 -5.683 -7.401 1.00 42.35 H new ATOM 271 N LEU B 135 -4.501 0.234 -4.455 1.00 31.00 N ATOM 272 CA LEU B 135 -3.562 1.307 -4.759 1.00 53.40 C ATOM 273 C LEU B 135 -2.135 0.932 -4.416 1.00 44.52 C ATOM 274 O LEU B 135 -1.214 1.528 -4.931 1.00 61.22 O ATOM 275 CB LEU B 135 -3.935 2.673 -4.121 1.00 12.34 C ATOM 276 CG LEU B 135 -4.246 2.703 -2.613 1.00 11.04 C ATOM 277 CD1 LEU B 135 -3.931 4.089 -2.033 1.00 24.03 C ATOM 278 CD2 LEU B 135 -5.725 2.391 -2.389 1.00 52.53 C ATOM 0 H LEU B 135 -5.139 0.435 -3.685 1.00 31.00 H new ATOM 0 HA LEU B 135 -3.636 1.440 -5.838 1.00 53.40 H new ATOM 0 HB2 LEU B 135 -3.113 3.364 -4.307 1.00 12.34 H new ATOM 0 HB3 LEU B 135 -4.805 3.063 -4.650 1.00 12.34 H new ATOM 0 HG LEU B 135 -3.629 1.956 -2.113 1.00 11.04 H new ATOM 0 HD11 LEU B 135 -4.155 4.097 -0.966 1.00 24.03 H new ATOM 0 HD12 LEU B 135 -2.875 4.315 -2.183 1.00 24.03 H new ATOM 0 HD13 LEU B 135 -4.538 4.841 -2.537 1.00 24.03 H new ATOM 0 HD21 LEU B 135 -5.944 2.413 -1.321 1.00 52.53 H new ATOM 0 HD22 LEU B 135 -6.335 3.136 -2.900 1.00 52.53 H new ATOM 0 HD23 LEU B 135 -5.952 1.402 -2.786 1.00 52.53 H new ATOM 290 N LEU B 136 -1.962 -0.087 -3.584 1.00 21.22 N ATOM 291 CA LEU B 136 -0.629 -0.547 -3.189 1.00 44.41 C ATOM 292 C LEU B 136 -0.038 -1.293 -4.343 1.00 40.11 C ATOM 293 O LEU B 136 1.147 -1.285 -4.576 1.00 61.31 O ATOM 294 CB LEU B 136 -0.740 -1.536 -2.052 1.00 1.14 C ATOM 295 CG LEU B 136 0.476 -1.697 -1.132 1.00 52.41 C ATOM 296 CD1 LEU B 136 0.769 -0.397 -0.394 1.00 41.23 C ATOM 297 CD2 LEU B 136 0.239 -2.825 -0.141 1.00 34.05 C ATOM 0 H LEU B 136 -2.728 -0.615 -3.166 1.00 21.22 H new ATOM 0 HA LEU B 136 -0.026 0.312 -2.893 1.00 44.41 H new ATOM 0 HB2 LEU B 136 -1.591 -1.246 -1.436 1.00 1.14 H new ATOM 0 HB3 LEU B 136 -0.972 -2.513 -2.477 1.00 1.14 H new ATOM 0 HG LEU B 136 1.342 -1.945 -1.746 1.00 52.41 H new ATOM 0 HD11 LEU B 136 1.635 -0.533 0.253 1.00 41.23 H new ATOM 0 HD12 LEU B 136 0.976 0.393 -1.116 1.00 41.23 H new ATOM 0 HD13 LEU B 136 -0.095 -0.119 0.210 1.00 41.23 H new ATOM 0 HD21 LEU B 136 1.110 -2.929 0.507 1.00 34.05 H new ATOM 0 HD22 LEU B 136 -0.639 -2.599 0.465 1.00 34.05 H new ATOM 0 HD23 LEU B 136 0.076 -3.757 -0.683 1.00 34.05 H new ATOM 309 N SER B 137 -0.909 -1.898 -5.085 1.00 11.45 N ATOM 310 CA SER B 137 -0.537 -2.749 -6.140 1.00 2.00 C ATOM 311 C SER B 137 -0.620 -1.985 -7.494 1.00 23.45 C ATOM 312 O SER B 137 -0.821 -2.584 -8.570 1.00 1.12 O ATOM 313 CB SER B 137 -1.419 -4.001 -6.125 1.00 70.13 C ATOM 314 OG SER B 137 -1.067 -4.911 -7.150 1.00 44.15 O ATOM 0 H SER B 137 -1.917 -1.804 -4.962 1.00 11.45 H new ATOM 0 HA SER B 137 0.497 -3.071 -6.014 1.00 2.00 H new ATOM 0 HB2 SER B 137 -1.332 -4.494 -5.157 1.00 70.13 H new ATOM 0 HB3 SER B 137 -2.463 -3.710 -6.241 1.00 70.13 H new ATOM 0 HG SER B 137 -0.807 -4.414 -7.954 1.00 44.15 H new ATOM 320 N SER B 138 -0.508 -0.688 -7.396 1.00 30.13 N ATOM 321 CA SER B 138 -0.570 0.263 -8.487 1.00 70.24 C ATOM 322 C SER B 138 0.376 -0.057 -9.690 1.00 64.22 C ATOM 323 O SER B 138 1.317 -0.848 -9.586 1.00 31.04 O ATOM 324 CB SER B 138 -0.263 1.621 -7.884 1.00 65.30 C ATOM 325 OG SER B 138 0.774 1.507 -6.942 1.00 2.10 O ATOM 0 H SER B 138 -0.361 -0.232 -6.496 1.00 30.13 H new ATOM 0 HA SER B 138 -1.564 0.223 -8.933 1.00 70.24 H new ATOM 0 HB2 SER B 138 0.024 2.320 -8.670 1.00 65.30 H new ATOM 0 HB3 SER B 138 -1.155 2.026 -7.407 1.00 65.30 H new ATOM 0 HG SER B 138 1.535 2.055 -7.226 1.00 2.10 H new ATOM 331 N PRO B 139 0.084 0.551 -10.860 1.00 3.54 N ATOM 332 CA PRO B 139 0.901 0.407 -12.106 1.00 24.41 C ATOM 333 C PRO B 139 2.182 1.231 -11.979 1.00 3.55 C ATOM 334 O PRO B 139 3.230 0.956 -12.578 1.00 33.11 O ATOM 335 CB PRO B 139 0.029 1.167 -13.135 1.00 51.14 C ATOM 336 CG PRO B 139 -0.629 2.181 -12.266 1.00 12.24 C ATOM 337 CD PRO B 139 -1.079 1.421 -11.096 1.00 64.24 C ATOM 0 HA PRO B 139 1.150 -0.629 -12.337 1.00 24.41 H new ATOM 0 HB2 PRO B 139 0.628 1.626 -13.922 1.00 51.14 H new ATOM 0 HB3 PRO B 139 -0.693 0.514 -13.624 1.00 51.14 H new ATOM 0 HG2 PRO B 139 0.065 2.972 -11.983 1.00 12.24 H new ATOM 0 HG3 PRO B 139 -1.466 2.658 -12.776 1.00 12.24 H new ATOM 0 HD2 PRO B 139 -1.292 2.065 -10.243 1.00 64.24 H new ATOM 0 HD3 PRO B 139 -1.986 0.851 -11.299 1.00 64.24 H new ATOM 345 N ASN B 140 2.041 2.238 -11.182 1.00 23.02 N ATOM 346 CA ASN B 140 2.928 3.289 -11.032 1.00 20.23 C ATOM 347 C ASN B 140 2.972 3.525 -9.581 1.00 43.12 C ATOM 348 O ASN B 140 1.937 3.816 -8.991 1.00 34.53 O ATOM 349 CB ASN B 140 2.306 4.569 -11.671 1.00 62.14 C ATOM 350 CG ASN B 140 3.283 5.693 -11.923 1.00 24.03 C ATOM 351 OD1 ASN B 140 2.918 6.843 -11.865 1.00 54.34 O ATOM 352 ND2 ASN B 140 4.513 5.374 -12.257 1.00 42.30 N ATOM 0 H ASN B 140 1.224 2.332 -10.578 1.00 23.02 H new ATOM 0 HA ASN B 140 3.898 3.077 -11.482 1.00 20.23 H new ATOM 0 HB2 ASN B 140 1.838 4.295 -12.617 1.00 62.14 H new ATOM 0 HB3 ASN B 140 1.514 4.935 -11.018 1.00 62.14 H new ATOM 0 HD21 ASN B 140 5.188 6.106 -12.476 1.00 42.30 H new ATOM 0 HD22 ASN B 140 4.793 4.394 -12.298 1.00 42.30 H new ATOM 359 N GLU B 141 4.106 3.396 -8.986 1.00 73.15 N ATOM 360 CA GLU B 141 4.220 3.642 -7.562 1.00 45.35 C ATOM 361 C GLU B 141 3.926 5.128 -7.285 1.00 73.44 C ATOM 362 O GLU B 141 3.494 5.526 -6.223 1.00 64.43 O ATOM 363 CB GLU B 141 5.612 3.331 -7.081 1.00 72.42 C ATOM 364 CG GLU B 141 6.230 2.063 -7.605 1.00 31.50 C ATOM 365 CD GLU B 141 6.988 2.317 -8.865 1.00 2.21 C ATOM 366 OE1 GLU B 141 8.152 2.772 -8.779 1.00 72.31 O ATOM 367 OE2 GLU B 141 6.434 2.110 -9.957 1.00 2.24 O1- ATOM 0 H GLU B 141 4.974 3.123 -9.447 1.00 73.15 H new ATOM 0 HA GLU B 141 3.509 3.003 -7.038 1.00 45.35 H new ATOM 0 HB2 GLU B 141 6.261 4.164 -7.350 1.00 72.42 H new ATOM 0 HB3 GLU B 141 5.594 3.279 -5.992 1.00 72.42 H new ATOM 0 HG2 GLU B 141 6.898 1.642 -6.853 1.00 31.50 H new ATOM 0 HG3 GLU B 141 5.451 1.323 -7.788 1.00 31.50 H new ATOM 374 N GLN B 142 4.152 5.907 -8.292 1.00 51.13 N ATOM 375 CA GLN B 142 3.952 7.334 -8.284 1.00 31.54 C ATOM 376 C GLN B 142 2.461 7.680 -8.141 1.00 51.24 C ATOM 377 O GLN B 142 2.089 8.491 -7.298 1.00 5.41 O ATOM 378 CB GLN B 142 4.477 7.860 -9.595 1.00 3.13 C ATOM 379 CG GLN B 142 5.967 7.566 -9.864 1.00 43.42 C ATOM 380 CD GLN B 142 6.991 8.437 -9.106 1.00 72.43 C ATOM 381 OE1 GLN B 142 6.644 8.970 -7.966 1.00 44.11 O flip ATOM 382 NE2 GLN B 142 8.103 8.652 -9.599 1.00 63.34 N flip ATOM 0 H GLN B 142 4.497 5.558 -9.186 1.00 51.13 H new ATOM 0 HA GLN B 142 4.473 7.784 -7.439 1.00 31.54 H new ATOM 0 HB2 GLN B 142 3.886 7.432 -10.404 1.00 3.13 H new ATOM 0 HB3 GLN B 142 4.324 8.939 -9.624 1.00 3.13 H new ATOM 0 HG2 GLN B 142 6.158 6.522 -9.616 1.00 43.42 H new ATOM 0 HG3 GLN B 142 6.149 7.679 -10.933 1.00 43.42 H new ATOM 0 HE21 GLN B 142 8.356 8.227 -10.491 1.00 63.34 H new ATOM 0 HE22 GLN B 142 8.768 9.255 -9.114 1.00 63.34 H new ATOM 391 N ILE B 143 1.614 7.041 -8.959 1.00 34.31 N ATOM 392 CA ILE B 143 0.171 7.285 -8.911 1.00 21.53 C ATOM 393 C ILE B 143 -0.370 6.845 -7.548 1.00 1.45 C ATOM 394 O ILE B 143 -1.345 7.388 -7.045 1.00 53.35 O ATOM 395 CB ILE B 143 -0.594 6.594 -10.107 1.00 14.02 C ATOM 396 CG1 ILE B 143 -0.617 5.085 -10.034 1.00 73.10 C ATOM 397 CG2 ILE B 143 -0.129 7.076 -11.433 1.00 44.30 C ATOM 398 CD1 ILE B 143 -1.820 4.547 -9.302 1.00 51.44 C ATOM 0 H ILE B 143 1.903 6.356 -9.657 1.00 34.31 H new ATOM 0 HA ILE B 143 -0.006 8.354 -9.031 1.00 21.53 H new ATOM 0 HB ILE B 143 -1.631 6.908 -9.992 1.00 14.02 H new ATOM 0 HG12 ILE B 143 -0.602 4.678 -11.045 1.00 73.10 H new ATOM 0 HG13 ILE B 143 0.289 4.737 -9.537 1.00 73.10 H new ATOM 0 HG21 ILE B 143 -0.687 6.569 -12.220 1.00 44.30 H new ATOM 0 HG22 ILE B 143 -0.292 8.151 -11.507 1.00 44.30 H new ATOM 0 HG23 ILE B 143 0.934 6.862 -11.546 1.00 44.30 H new ATOM 0 HD11 ILE B 143 -1.778 3.458 -9.284 1.00 51.44 H new ATOM 0 HD12 ILE B 143 -1.824 4.927 -8.280 1.00 51.44 H new ATOM 0 HD13 ILE B 143 -2.729 4.867 -9.812 1.00 51.44 H new ATOM 410 N LEU B 144 0.333 5.877 -6.948 1.00 55.31 N ATOM 411 CA LEU B 144 0.034 5.380 -5.625 1.00 51.23 C ATOM 412 C LEU B 144 0.118 6.496 -4.605 1.00 35.13 C ATOM 413 O LEU B 144 -0.784 6.657 -3.805 1.00 44.33 O ATOM 414 CB LEU B 144 0.966 4.177 -5.286 1.00 3.21 C ATOM 415 CG LEU B 144 1.081 3.692 -3.818 1.00 52.24 C ATOM 416 CD1 LEU B 144 1.521 2.252 -3.787 1.00 13.41 C ATOM 417 CD2 LEU B 144 2.138 4.486 -3.082 1.00 24.12 C ATOM 0 H LEU B 144 1.133 5.419 -7.384 1.00 55.31 H new ATOM 0 HA LEU B 144 -0.991 5.011 -5.595 1.00 51.23 H new ATOM 0 HB2 LEU B 144 0.636 3.329 -5.886 1.00 3.21 H new ATOM 0 HB3 LEU B 144 1.969 4.435 -5.624 1.00 3.21 H new ATOM 0 HG LEU B 144 0.105 3.818 -3.350 1.00 52.24 H new ATOM 0 HD11 LEU B 144 1.600 1.918 -2.752 1.00 13.41 H new ATOM 0 HD12 LEU B 144 0.790 1.637 -4.312 1.00 13.41 H new ATOM 0 HD13 LEU B 144 2.492 2.158 -4.274 1.00 13.41 H new ATOM 0 HD21 LEU B 144 2.207 4.134 -2.053 1.00 24.12 H new ATOM 0 HD22 LEU B 144 3.101 4.355 -3.576 1.00 24.12 H new ATOM 0 HD23 LEU B 144 1.869 5.542 -3.087 1.00 24.12 H new ATOM 429 N GLN B 145 1.171 7.304 -4.671 1.00 62.02 N ATOM 430 CA GLN B 145 1.342 8.381 -3.710 1.00 14.14 C ATOM 431 C GLN B 145 0.311 9.465 -3.918 1.00 53.32 C ATOM 432 O GLN B 145 -0.197 10.046 -2.959 1.00 13.44 O ATOM 433 CB GLN B 145 2.753 8.956 -3.727 1.00 31.14 C ATOM 434 CG GLN B 145 3.809 7.919 -3.440 1.00 35.44 C ATOM 435 CD GLN B 145 5.137 8.506 -3.005 1.00 5.04 C ATOM 436 OE1 GLN B 145 6.000 8.820 -3.817 1.00 4.41 O ATOM 437 NE2 GLN B 145 5.327 8.601 -1.724 1.00 60.40 N ATOM 0 H GLN B 145 1.909 7.233 -5.372 1.00 62.02 H new ATOM 0 HA GLN B 145 1.188 7.949 -2.721 1.00 14.14 H new ATOM 0 HB2 GLN B 145 2.946 9.405 -4.701 1.00 31.14 H new ATOM 0 HB3 GLN B 145 2.824 9.755 -2.989 1.00 31.14 H new ATOM 0 HG2 GLN B 145 3.445 7.249 -2.661 1.00 35.44 H new ATOM 0 HG3 GLN B 145 3.964 7.314 -4.334 1.00 35.44 H new ATOM 0 HE21 GLN B 145 4.586 8.331 -1.077 1.00 60.40 H new ATOM 0 HE22 GLN B 145 6.217 8.946 -1.365 1.00 60.40 H new ATOM 446 N GLU B 146 -0.034 9.689 -5.160 1.00 55.14 N ATOM 447 CA GLU B 146 -1.041 10.675 -5.500 1.00 32.43 C ATOM 448 C GLU B 146 -2.434 10.226 -5.063 1.00 61.02 C ATOM 449 O GLU B 146 -3.258 11.041 -4.633 1.00 62.21 O ATOM 450 CB GLU B 146 -1.009 11.033 -6.977 1.00 61.15 C ATOM 451 CG GLU B 146 0.285 11.699 -7.406 1.00 73.43 C ATOM 452 CD GLU B 146 0.214 12.254 -8.799 1.00 74.32 C ATOM 453 OE1 GLU B 146 -0.232 13.401 -8.958 1.00 22.34 O1- ATOM 454 OE2 GLU B 146 0.598 11.556 -9.761 1.00 3.34 O ATOM 0 H GLU B 146 0.367 9.201 -5.961 1.00 55.14 H new ATOM 0 HA GLU B 146 -0.800 11.582 -4.946 1.00 32.43 H new ATOM 0 HB2 GLU B 146 -1.156 10.128 -7.566 1.00 61.15 H new ATOM 0 HB3 GLU B 146 -1.843 11.698 -7.201 1.00 61.15 H new ATOM 0 HG2 GLU B 146 0.524 12.503 -6.710 1.00 73.43 H new ATOM 0 HG3 GLU B 146 1.098 10.976 -7.348 1.00 73.43 H new ATOM 461 N ALA B 147 -2.702 8.940 -5.170 1.00 15.44 N ATOM 462 CA ALA B 147 -3.955 8.394 -4.677 1.00 72.45 C ATOM 463 C ALA B 147 -3.956 8.404 -3.164 1.00 11.52 C ATOM 464 O ALA B 147 -4.965 8.726 -2.525 1.00 71.22 O ATOM 465 CB ALA B 147 -4.186 6.989 -5.200 1.00 4.23 C ATOM 0 H ALA B 147 -2.074 8.255 -5.591 1.00 15.44 H new ATOM 0 HA ALA B 147 -4.771 9.019 -5.040 1.00 72.45 H new ATOM 0 HB1 ALA B 147 -5.131 6.608 -4.814 1.00 4.23 H new ATOM 0 HB2 ALA B 147 -4.220 7.007 -6.289 1.00 4.23 H new ATOM 0 HB3 ALA B 147 -3.373 6.341 -4.873 1.00 4.23 H new ATOM 471 N LEU B 148 -2.792 8.119 -2.598 1.00 50.13 N ATOM 472 CA LEU B 148 -2.595 8.064 -1.164 1.00 10.21 C ATOM 473 C LEU B 148 -2.888 9.367 -0.516 1.00 72.25 C ATOM 474 O LEU B 148 -3.248 9.382 0.610 1.00 11.01 O ATOM 475 CB LEU B 148 -1.171 7.681 -0.785 1.00 24.22 C ATOM 476 CG LEU B 148 -0.796 6.207 -0.743 1.00 12.12 C ATOM 477 CD1 LEU B 148 0.688 6.076 -0.454 1.00 75.04 C ATOM 478 CD2 LEU B 148 -1.595 5.481 0.335 1.00 53.12 C ATOM 0 H LEU B 148 -1.948 7.917 -3.134 1.00 50.13 H new ATOM 0 HA LEU B 148 -3.288 7.299 -0.813 1.00 10.21 H new ATOM 0 HB2 LEU B 148 -0.499 8.173 -1.488 1.00 24.22 H new ATOM 0 HB3 LEU B 148 -0.967 8.102 0.199 1.00 24.22 H new ATOM 0 HG LEU B 148 -1.027 5.756 -1.708 1.00 12.12 H new ATOM 0 HD11 LEU B 148 0.961 5.021 -0.423 1.00 75.04 H new ATOM 0 HD12 LEU B 148 1.257 6.575 -1.238 1.00 75.04 H new ATOM 0 HD13 LEU B 148 0.914 6.537 0.507 1.00 75.04 H new ATOM 0 HD21 LEU B 148 -1.313 4.428 0.350 1.00 53.12 H new ATOM 0 HD22 LEU B 148 -1.384 5.927 1.307 1.00 53.12 H new ATOM 0 HD23 LEU B 148 -2.660 5.568 0.120 1.00 53.12 H new ATOM 490 N TRP B 149 -2.706 10.451 -1.213 1.00 72.11 N ATOM 491 CA TRP B 149 -2.987 11.751 -0.650 1.00 73.33 C ATOM 492 C TRP B 149 -4.362 11.802 -0.018 1.00 33.51 C ATOM 493 O TRP B 149 -4.514 12.249 1.114 1.00 12.44 O ATOM 494 CB TRP B 149 -2.852 12.832 -1.676 1.00 5.20 C ATOM 495 CG TRP B 149 -1.450 13.157 -2.112 1.00 21.45 C ATOM 496 CD1 TRP B 149 -1.047 13.419 -3.385 1.00 14.14 C ATOM 497 CD2 TRP B 149 -0.259 13.249 -1.293 1.00 64.10 C ATOM 498 NE1 TRP B 149 0.294 13.686 -3.412 1.00 44.31 N ATOM 499 CE2 TRP B 149 0.801 13.583 -2.151 1.00 41.22 C ATOM 500 CE3 TRP B 149 0.018 13.088 0.077 1.00 50.34 C ATOM 501 CZ2 TRP B 149 2.100 13.760 -1.697 1.00 11.41 C ATOM 502 CZ3 TRP B 149 1.310 13.263 0.519 1.00 0.00 C ATOM 503 CH2 TRP B 149 2.333 13.597 -0.364 1.00 21.30 C ATOM 0 H TRP B 149 -2.364 10.466 -2.174 1.00 72.11 H new ATOM 0 HA TRP B 149 -2.247 11.922 0.132 1.00 73.33 H new ATOM 0 HB2 TRP B 149 -3.427 12.544 -2.556 1.00 5.20 H new ATOM 0 HB3 TRP B 149 -3.308 13.740 -1.280 1.00 5.20 H new ATOM 0 HD1 TRP B 149 -1.694 13.416 -4.250 1.00 14.14 H new ATOM 0 HE1 TRP B 149 0.831 13.925 -4.246 1.00 44.31 H new ATOM 0 HE3 TRP B 149 -0.770 12.831 0.770 1.00 50.34 H new ATOM 0 HZ2 TRP B 149 2.899 14.018 -2.376 1.00 11.41 H new ATOM 0 HZ3 TRP B 149 1.534 13.139 1.568 1.00 0.00 H new ATOM 0 HH2 TRP B 149 3.335 13.730 0.016 1.00 21.30 H new ATOM 514 N ALA B 150 -5.340 11.321 -0.725 1.00 4.41 N ATOM 515 CA ALA B 150 -6.648 11.241 -0.166 1.00 55.10 C ATOM 516 C ALA B 150 -6.800 9.918 0.617 1.00 74.03 C ATOM 517 O ALA B 150 -7.158 9.899 1.799 1.00 33.30 O ATOM 518 CB ALA B 150 -7.706 11.352 -1.255 1.00 15.21 C ATOM 0 H ALA B 150 -5.255 10.981 -1.683 1.00 4.41 H new ATOM 0 HA ALA B 150 -6.791 12.074 0.522 1.00 55.10 H new ATOM 0 HB1 ALA B 150 -8.698 11.289 -0.807 1.00 15.21 H new ATOM 0 HB2 ALA B 150 -7.600 12.308 -1.769 1.00 15.21 H new ATOM 0 HB3 ALA B 150 -7.579 10.539 -1.970 1.00 15.21 H new ATOM 524 N LEU B 151 -6.430 8.835 -0.052 1.00 70.43 N ATOM 525 CA LEU B 151 -6.630 7.454 0.404 1.00 60.43 C ATOM 526 C LEU B 151 -5.836 7.037 1.662 1.00 0.01 C ATOM 527 O LEU B 151 -6.152 6.034 2.293 1.00 1.42 O ATOM 528 CB LEU B 151 -6.439 6.488 -0.761 1.00 30.21 C ATOM 529 CG LEU B 151 -7.430 6.685 -1.936 1.00 35.52 C ATOM 530 CD1 LEU B 151 -7.222 5.655 -3.020 1.00 33.34 C ATOM 531 CD2 LEU B 151 -8.879 6.668 -1.463 1.00 54.11 C ATOM 0 H LEU B 151 -5.966 8.888 -0.959 1.00 70.43 H new ATOM 0 HA LEU B 151 -7.662 7.404 0.750 1.00 60.43 H new ATOM 0 HB2 LEU B 151 -5.422 6.594 -1.140 1.00 30.21 H new ATOM 0 HB3 LEU B 151 -6.536 5.468 -0.389 1.00 30.21 H new ATOM 0 HG LEU B 151 -7.222 7.669 -2.356 1.00 35.52 H new ATOM 0 HD11 LEU B 151 -7.935 5.826 -3.826 1.00 33.34 H new ATOM 0 HD12 LEU B 151 -6.207 5.737 -3.410 1.00 33.34 H new ATOM 0 HD13 LEU B 151 -7.373 4.657 -2.608 1.00 33.34 H new ATOM 0 HD21 LEU B 151 -9.542 6.809 -2.317 1.00 54.11 H new ATOM 0 HD22 LEU B 151 -9.096 5.711 -0.989 1.00 54.11 H new ATOM 0 HD23 LEU B 151 -9.037 7.472 -0.744 1.00 54.11 H new ATOM 543 N SER B 152 -4.804 7.779 2.007 1.00 60.31 N ATOM 544 CA SER B 152 -3.973 7.509 3.190 1.00 74.51 C ATOM 545 C SER B 152 -4.809 7.490 4.492 1.00 11.20 C ATOM 546 O SER B 152 -4.383 6.911 5.505 1.00 33.33 O ATOM 547 CB SER B 152 -2.757 8.469 3.254 1.00 21.44 C ATOM 548 OG SER B 152 -1.874 8.193 4.349 1.00 22.11 O ATOM 0 H SER B 152 -4.505 8.598 1.477 1.00 60.31 H new ATOM 0 HA SER B 152 -3.564 6.503 3.090 1.00 74.51 H new ATOM 0 HB2 SER B 152 -2.199 8.400 2.320 1.00 21.44 H new ATOM 0 HB3 SER B 152 -3.117 9.495 3.336 1.00 21.44 H new ATOM 0 HG SER B 152 -1.128 8.828 4.336 1.00 22.11 H new ATOM 554 N ASN B 153 -6.011 8.111 4.456 1.00 64.24 N ATOM 555 CA ASN B 153 -6.965 8.076 5.591 1.00 44.31 C ATOM 556 C ASN B 153 -7.247 6.632 6.009 1.00 64.55 C ATOM 557 O ASN B 153 -7.575 6.369 7.169 1.00 64.23 O ATOM 558 CB ASN B 153 -8.300 8.755 5.243 1.00 63.41 C ATOM 559 CG ASN B 153 -8.282 10.279 5.220 1.00 23.31 C ATOM 560 OD1 ASN B 153 -7.143 10.885 4.997 1.00 40.43 O flip ATOM 561 ND2 ASN B 153 -9.314 10.910 5.426 1.00 50.30 N flip ATOM 0 H ASN B 153 -6.344 8.643 3.652 1.00 64.24 H new ATOM 0 HA ASN B 153 -6.498 8.622 6.410 1.00 44.31 H new ATOM 0 HB2 ASN B 153 -8.623 8.399 4.265 1.00 63.41 H new ATOM 0 HB3 ASN B 153 -9.050 8.430 5.964 1.00 63.41 H new ATOM 0 HD21 ASN B 153 -10.189 10.415 5.597 1.00 50.30 H new ATOM 0 HD22 ASN B 153 -9.297 11.930 5.426 1.00 50.30 H new ATOM 568 N ILE B 154 -7.124 5.706 5.052 1.00 75.13 N ATOM 569 CA ILE B 154 -7.257 4.274 5.308 1.00 55.41 C ATOM 570 C ILE B 154 -6.188 3.806 6.299 1.00 43.23 C ATOM 571 O ILE B 154 -6.500 3.274 7.350 1.00 31.12 O ATOM 572 CB ILE B 154 -7.109 3.447 3.995 1.00 3.11 C ATOM 573 CG1 ILE B 154 -8.289 3.697 3.034 1.00 50.30 C ATOM 574 CG2 ILE B 154 -6.938 1.956 4.287 1.00 43.33 C ATOM 575 CD1 ILE B 154 -9.644 3.292 3.585 1.00 21.43 C ATOM 0 H ILE B 154 -6.929 5.933 4.077 1.00 75.13 H new ATOM 0 HA ILE B 154 -8.251 4.112 5.724 1.00 55.41 H new ATOM 0 HB ILE B 154 -6.202 3.790 3.498 1.00 3.11 H new ATOM 0 HG12 ILE B 154 -8.316 4.757 2.779 1.00 50.30 H new ATOM 0 HG13 ILE B 154 -8.109 3.151 2.108 1.00 50.30 H new ATOM 0 HG21 ILE B 154 -6.838 1.411 3.349 1.00 43.33 H new ATOM 0 HG22 ILE B 154 -6.044 1.804 4.892 1.00 43.33 H new ATOM 0 HG23 ILE B 154 -7.810 1.589 4.829 1.00 43.33 H new ATOM 0 HD11 ILE B 154 -10.416 3.502 2.844 1.00 21.43 H new ATOM 0 HD12 ILE B 154 -9.640 2.226 3.812 1.00 21.43 H new ATOM 0 HD13 ILE B 154 -9.850 3.856 4.494 1.00 21.43 H new ATOM 587 N ALA B 155 -4.934 4.064 5.971 1.00 10.31 N ATOM 588 CA ALA B 155 -3.805 3.611 6.782 1.00 14.12 C ATOM 589 C ALA B 155 -3.738 4.377 8.098 1.00 64.41 C ATOM 590 O ALA B 155 -3.139 3.918 9.074 1.00 71.04 O ATOM 591 CB ALA B 155 -2.506 3.752 6.004 1.00 41.11 C ATOM 0 H ALA B 155 -4.665 4.591 5.140 1.00 10.31 H new ATOM 0 HA ALA B 155 -3.952 2.557 7.018 1.00 14.12 H new ATOM 0 HB1 ALA B 155 -1.674 3.411 6.620 1.00 41.11 H new ATOM 0 HB2 ALA B 155 -2.557 3.149 5.098 1.00 41.11 H new ATOM 0 HB3 ALA B 155 -2.354 4.798 5.736 1.00 41.11 H new ATOM 597 N SER B 156 -4.354 5.536 8.113 1.00 4.52 N ATOM 598 CA SER B 156 -4.458 6.343 9.302 1.00 54.22 C ATOM 599 C SER B 156 -5.604 5.825 10.188 1.00 33.11 C ATOM 600 O SER B 156 -5.731 6.218 11.349 1.00 31.14 O ATOM 601 CB SER B 156 -4.698 7.811 8.902 1.00 51.15 C ATOM 602 OG SER B 156 -4.811 8.663 10.033 1.00 71.21 O ATOM 0 H SER B 156 -4.800 5.947 7.293 1.00 4.52 H new ATOM 0 HA SER B 156 -3.531 6.280 9.872 1.00 54.22 H new ATOM 0 HB2 SER B 156 -3.877 8.153 8.272 1.00 51.15 H new ATOM 0 HB3 SER B 156 -5.608 7.879 8.305 1.00 51.15 H new ATOM 0 HG SER B 156 -5.000 8.125 10.830 1.00 71.21 H new ATOM 608 N GLY B 157 -6.418 4.944 9.639 1.00 64.35 N ATOM 609 CA GLY B 157 -7.542 4.422 10.350 1.00 65.32 C ATOM 610 C GLY B 157 -7.249 3.072 10.931 1.00 30.23 C ATOM 611 O GLY B 157 -7.580 2.038 10.330 1.00 41.22 O ATOM 0 H GLY B 157 -6.310 4.579 8.693 1.00 64.35 H new ATOM 0 HA2 GLY B 157 -7.819 5.110 11.149 1.00 65.32 H new ATOM 0 HA3 GLY B 157 -8.398 4.352 9.678 1.00 65.32 H new ATOM 615 N GLY B 158 -6.621 3.075 12.099 1.00 4.51 N ATOM 616 CA GLY B 158 -6.291 1.844 12.796 1.00 1.13 C ATOM 617 C GLY B 158 -7.523 1.027 13.120 1.00 32.24 C ATOM 618 O GLY B 158 -7.459 -0.195 13.238 1.00 23.13 O ATOM 0 H GLY B 158 -6.329 3.923 12.585 1.00 4.51 H new ATOM 0 HA2 GLY B 158 -5.614 1.250 12.182 1.00 1.13 H new ATOM 0 HA3 GLY B 158 -5.760 2.081 13.718 1.00 1.13 H new ATOM 622 N ASN B 159 -8.633 1.704 13.263 1.00 23.14 N ATOM 623 CA ASN B 159 -9.906 1.065 13.519 1.00 4.32 C ATOM 624 C ASN B 159 -10.553 0.660 12.196 1.00 43.12 C ATOM 625 O ASN B 159 -10.699 1.499 11.300 1.00 73.44 O ATOM 626 CB ASN B 159 -10.849 2.028 14.252 1.00 41.53 C ATOM 627 CG ASN B 159 -12.182 1.392 14.584 1.00 73.54 C ATOM 628 OD1 ASN B 159 -12.256 0.206 14.874 1.00 53.51 O ATOM 629 ND2 ASN B 159 -13.236 2.156 14.517 1.00 13.35 N ATOM 0 H ASN B 159 -8.684 2.721 13.205 1.00 23.14 H new ATOM 0 HA ASN B 159 -9.732 0.185 14.138 1.00 4.32 H new ATOM 0 HB2 ASN B 159 -10.373 2.368 15.172 1.00 41.53 H new ATOM 0 HB3 ASN B 159 -11.015 2.910 13.634 1.00 41.53 H new ATOM 0 HD21 ASN B 159 -14.160 1.769 14.710 1.00 13.35 H new ATOM 0 HD22 ASN B 159 -13.137 3.141 14.272 1.00 13.35 H new ATOM 636 N GLU B 160 -10.889 -0.623 12.067 1.00 61.13 N ATOM 637 CA GLU B 160 -11.614 -1.197 10.908 1.00 44.33 C ATOM 638 C GLU B 160 -10.825 -1.269 9.593 1.00 21.45 C ATOM 639 O GLU B 160 -10.854 -2.300 8.916 1.00 55.12 O ATOM 640 CB GLU B 160 -12.987 -0.544 10.687 1.00 21.44 C ATOM 641 CG GLU B 160 -14.007 -0.860 11.764 1.00 75.15 C ATOM 642 CD GLU B 160 -14.300 -2.335 11.853 1.00 34.45 C ATOM 643 OE1 GLU B 160 -15.046 -2.855 11.009 1.00 51.14 O1- ATOM 644 OE2 GLU B 160 -13.763 -3.010 12.747 1.00 5.33 O ATOM 0 H GLU B 160 -10.664 -1.319 12.778 1.00 61.13 H new ATOM 0 HA GLU B 160 -11.762 -2.235 11.205 1.00 44.33 H new ATOM 0 HB2 GLU B 160 -12.858 0.537 10.631 1.00 21.44 H new ATOM 0 HB3 GLU B 160 -13.380 -0.869 9.724 1.00 21.44 H new ATOM 0 HG2 GLU B 160 -13.639 -0.505 12.727 1.00 75.15 H new ATOM 0 HG3 GLU B 160 -14.931 -0.319 11.558 1.00 75.15 H new ATOM 651 N GLN B 161 -10.145 -0.211 9.221 1.00 55.22 N ATOM 652 CA GLN B 161 -9.427 -0.192 7.954 1.00 4.24 C ATOM 653 C GLN B 161 -8.140 -1.002 8.017 1.00 2.21 C ATOM 654 O GLN B 161 -7.769 -1.666 7.061 1.00 4.14 O ATOM 655 CB GLN B 161 -9.108 1.236 7.473 1.00 73.31 C ATOM 656 CG GLN B 161 -10.295 2.099 7.010 1.00 74.15 C ATOM 657 CD GLN B 161 -11.212 2.568 8.119 1.00 63.34 C ATOM 658 OE1 GLN B 161 -10.982 3.618 8.718 1.00 30.32 O ATOM 659 NE2 GLN B 161 -12.273 1.852 8.363 1.00 71.32 N ATOM 0 H GLN B 161 -10.069 0.646 9.768 1.00 55.22 H new ATOM 0 HA GLN B 161 -10.102 -0.652 7.232 1.00 4.24 H new ATOM 0 HB2 GLN B 161 -8.603 1.762 8.284 1.00 73.31 H new ATOM 0 HB3 GLN B 161 -8.399 1.165 6.648 1.00 73.31 H new ATOM 0 HG2 GLN B 161 -9.908 2.972 6.485 1.00 74.15 H new ATOM 0 HG3 GLN B 161 -10.882 1.528 6.290 1.00 74.15 H new ATOM 0 HE21 GLN B 161 -12.434 0.986 7.848 1.00 71.32 H new ATOM 0 HE22 GLN B 161 -12.943 2.157 9.069 1.00 71.32 H new ATOM 668 N LYS B 162 -7.500 -0.991 9.160 1.00 0.01 N ATOM 669 CA LYS B 162 -6.200 -1.633 9.313 1.00 53.04 C ATOM 670 C LYS B 162 -6.282 -3.182 9.310 1.00 54.42 C ATOM 671 O LYS B 162 -5.302 -3.854 9.038 1.00 41.24 O ATOM 672 CB LYS B 162 -5.492 -1.098 10.566 1.00 52.24 C ATOM 673 CG LYS B 162 -4.037 -1.496 10.688 1.00 72.31 C ATOM 674 CD LYS B 162 -3.433 -0.947 11.962 1.00 53.42 C ATOM 675 CE LYS B 162 -3.868 -1.718 13.204 1.00 52.21 C ATOM 676 NZ LYS B 162 -3.441 -3.131 13.159 1.00 22.01 N1+ ATOM 0 H LYS B 162 -7.853 -0.545 10.007 1.00 0.01 H new ATOM 0 HA LYS B 162 -5.604 -1.374 8.438 1.00 53.04 H new ATOM 0 HB2 LYS B 162 -5.558 -0.010 10.568 1.00 52.24 H new ATOM 0 HB3 LYS B 162 -6.027 -1.451 11.448 1.00 52.24 H new ATOM 0 HG2 LYS B 162 -3.951 -2.583 10.679 1.00 72.31 H new ATOM 0 HG3 LYS B 162 -3.481 -1.125 9.827 1.00 72.31 H new ATOM 0 HD2 LYS B 162 -2.346 -0.975 11.885 1.00 53.42 H new ATOM 0 HD3 LYS B 162 -3.717 0.099 12.072 1.00 53.42 H new ATOM 0 HE2 LYS B 162 -3.450 -1.242 14.091 1.00 52.21 H new ATOM 0 HE3 LYS B 162 -4.953 -1.670 13.298 1.00 52.21 H new ATOM 0 HZ1 LYS B 162 -3.104 -3.422 14.099 1.00 22.01 H new ATOM 0 HZ2 LYS B 162 -4.245 -3.728 12.880 1.00 22.01 H new ATOM 0 HZ3 LYS B 162 -2.673 -3.240 12.467 1.00 22.01 H new ATOM 690 N GLN B 163 -7.448 -3.739 9.592 1.00 45.04 N ATOM 691 CA GLN B 163 -7.606 -5.214 9.636 1.00 54.43 C ATOM 692 C GLN B 163 -7.955 -5.755 8.243 1.00 43.34 C ATOM 693 O GLN B 163 -7.781 -6.935 7.934 1.00 51.54 O ATOM 694 CB GLN B 163 -8.716 -5.571 10.607 1.00 0.44 C ATOM 695 CG GLN B 163 -10.084 -5.202 10.096 1.00 12.45 C ATOM 696 CD GLN B 163 -11.129 -5.167 11.173 1.00 32.52 C ATOM 697 OE1 GLN B 163 -12.137 -4.400 10.949 1.00 71.21 O flip ATOM 698 NE2 GLN B 163 -11.042 -5.868 12.180 1.00 35.45 N flip ATOM 0 H GLN B 163 -8.299 -3.215 9.794 1.00 45.04 H new ATOM 0 HA GLN B 163 -6.667 -5.661 9.964 1.00 54.43 H new ATOM 0 HB2 GLN B 163 -8.686 -6.642 10.808 1.00 0.44 H new ATOM 0 HB3 GLN B 163 -8.539 -5.064 11.555 1.00 0.44 H new ATOM 0 HG2 GLN B 163 -10.034 -4.225 9.616 1.00 12.45 H new ATOM 0 HG3 GLN B 163 -10.384 -5.918 9.331 1.00 12.45 H new ATOM 0 HE21 GLN B 163 -10.225 -6.462 12.319 1.00 35.45 H new ATOM 0 HE22 GLN B 163 -11.787 -5.855 12.876 1.00 35.45 H new ATOM 707 N ALA B 164 -8.416 -4.860 7.421 1.00 52.32 N ATOM 708 CA ALA B 164 -8.888 -5.138 6.077 1.00 30.11 C ATOM 709 C ALA B 164 -7.770 -5.533 5.202 1.00 13.35 C ATOM 710 O ALA B 164 -7.911 -6.372 4.360 1.00 74.41 O ATOM 711 CB ALA B 164 -9.388 -3.868 5.549 1.00 12.31 C ATOM 0 H ALA B 164 -8.480 -3.873 7.669 1.00 52.32 H new ATOM 0 HA ALA B 164 -9.633 -5.933 6.106 1.00 30.11 H new ATOM 0 HB1 ALA B 164 -9.758 -4.016 4.535 1.00 12.31 H new ATOM 0 HB2 ALA B 164 -10.198 -3.505 6.181 1.00 12.31 H new ATOM 0 HB3 ALA B 164 -8.581 -3.136 5.537 1.00 12.31 H new ATOM 717 N VAL B 165 -6.665 -4.912 5.423 1.00 3.02 N ATOM 718 CA VAL B 165 -5.500 -5.049 4.590 1.00 13.21 C ATOM 719 C VAL B 165 -5.032 -6.521 4.514 1.00 2.43 C ATOM 720 O VAL B 165 -4.620 -6.995 3.465 1.00 61.00 O ATOM 721 CB VAL B 165 -4.375 -4.124 5.115 1.00 33.10 C ATOM 722 CG1 VAL B 165 -4.915 -2.753 5.317 1.00 41.13 C ATOM 723 CG2 VAL B 165 -3.926 -4.571 6.426 1.00 41.10 C ATOM 0 H VAL B 165 -6.533 -4.274 6.208 1.00 3.02 H new ATOM 0 HA VAL B 165 -5.756 -4.746 3.575 1.00 13.21 H new ATOM 0 HB VAL B 165 -3.562 -4.142 4.389 1.00 33.10 H new ATOM 0 HG11 VAL B 165 -4.124 -2.101 5.687 1.00 41.13 H new ATOM 0 HG12 VAL B 165 -5.291 -2.367 4.369 1.00 41.13 H new ATOM 0 HG13 VAL B 165 -5.727 -2.785 6.043 1.00 41.13 H new ATOM 0 HG21 VAL B 165 -3.135 -3.912 6.784 1.00 41.10 H new ATOM 0 HG22 VAL B 165 -4.762 -4.547 7.125 1.00 41.10 H new ATOM 0 HG23 VAL B 165 -3.544 -5.589 6.352 1.00 41.10 H new ATOM 733 N LYS B 166 -5.184 -7.252 5.610 1.00 72.33 N ATOM 734 CA LYS B 166 -4.770 -8.639 5.666 1.00 62.53 C ATOM 735 C LYS B 166 -5.730 -9.453 4.810 1.00 61.12 C ATOM 736 O LYS B 166 -5.331 -10.287 4.003 1.00 13.14 O ATOM 737 CB LYS B 166 -4.789 -9.186 7.114 1.00 64.02 C ATOM 738 CG LYS B 166 -3.987 -8.402 8.179 1.00 21.20 C ATOM 739 CD LYS B 166 -4.690 -7.120 8.654 1.00 51.32 C ATOM 740 CE LYS B 166 -4.146 -6.654 10.003 1.00 50.03 C ATOM 741 NZ LYS B 166 -4.448 -7.598 11.106 1.00 65.44 N1+ ATOM 0 H LYS B 166 -5.594 -6.901 6.475 1.00 72.33 H new ATOM 0 HA LYS B 166 -3.747 -8.715 5.298 1.00 62.53 H new ATOM 0 HB2 LYS B 166 -5.827 -9.235 7.442 1.00 64.02 H new ATOM 0 HB3 LYS B 166 -4.412 -10.209 7.093 1.00 64.02 H new ATOM 0 HG2 LYS B 166 -3.809 -9.049 9.038 1.00 21.20 H new ATOM 0 HG3 LYS B 166 -3.011 -8.141 7.769 1.00 21.20 H new ATOM 0 HD2 LYS B 166 -4.553 -6.332 7.913 1.00 51.32 H new ATOM 0 HD3 LYS B 166 -5.762 -7.299 8.735 1.00 51.32 H new ATOM 0 HE2 LYS B 166 -3.066 -6.524 9.928 1.00 50.03 H new ATOM 0 HE3 LYS B 166 -4.568 -5.678 10.241 1.00 50.03 H new ATOM 0 HZ1 LYS B 166 -4.370 -7.103 12.017 1.00 65.44 H new ATOM 0 HZ2 LYS B 166 -5.414 -7.966 10.993 1.00 65.44 H new ATOM 0 HZ3 LYS B 166 -3.772 -8.388 11.082 1.00 65.44 H new ATOM 755 N GLU B 167 -6.984 -9.109 4.950 1.00 75.44 N ATOM 756 CA GLU B 167 -8.080 -9.709 4.280 1.00 33.13 C ATOM 757 C GLU B 167 -8.105 -9.403 2.781 1.00 4.33 C ATOM 758 O GLU B 167 -8.439 -10.257 1.963 1.00 61.22 O ATOM 759 CB GLU B 167 -9.312 -9.218 4.985 1.00 35.41 C ATOM 760 CG GLU B 167 -9.767 -10.170 6.051 1.00 14.32 C ATOM 761 CD GLU B 167 -10.109 -11.534 5.497 1.00 71.10 C ATOM 762 OE1 GLU B 167 -9.206 -12.371 5.304 1.00 34.35 O ATOM 763 OE2 GLU B 167 -11.303 -11.801 5.257 1.00 51.30 O1- ATOM 0 H GLU B 167 -7.271 -8.356 5.575 1.00 75.44 H new ATOM 0 HA GLU B 167 -8.007 -10.796 4.323 1.00 33.13 H new ATOM 0 HB2 GLU B 167 -9.111 -8.244 5.431 1.00 35.41 H new ATOM 0 HB3 GLU B 167 -10.113 -9.077 4.259 1.00 35.41 H new ATOM 0 HG2 GLU B 167 -8.984 -10.272 6.802 1.00 14.32 H new ATOM 0 HG3 GLU B 167 -10.640 -9.756 6.555 1.00 14.32 H new ATOM 770 N ALA B 168 -7.729 -8.195 2.440 1.00 51.34 N ATOM 771 CA ALA B 168 -7.674 -7.738 1.068 1.00 12.43 C ATOM 772 C ALA B 168 -6.470 -8.335 0.337 1.00 34.44 C ATOM 773 O ALA B 168 -6.440 -8.385 -0.892 1.00 25.22 O ATOM 774 CB ALA B 168 -7.617 -6.229 1.044 1.00 40.11 C ATOM 0 H ALA B 168 -7.447 -7.487 3.118 1.00 51.34 H new ATOM 0 HA ALA B 168 -8.572 -8.073 0.549 1.00 12.43 H new ATOM 0 HB1 ALA B 168 -7.575 -5.883 0.011 1.00 40.11 H new ATOM 0 HB2 ALA B 168 -8.506 -5.824 1.527 1.00 40.11 H new ATOM 0 HB3 ALA B 168 -6.728 -5.890 1.576 1.00 40.11 H new ATOM 780 N GLY B 169 -5.486 -8.757 1.096 1.00 34.33 N ATOM 781 CA GLY B 169 -4.325 -9.393 0.526 1.00 34.02 C ATOM 782 C GLY B 169 -3.175 -8.435 0.349 1.00 4.54 C ATOM 783 O GLY B 169 -2.460 -8.491 -0.649 1.00 31.44 O ATOM 0 H GLY B 169 -5.468 -8.670 2.112 1.00 34.33 H new ATOM 0 HA2 GLY B 169 -4.013 -10.217 1.168 1.00 34.02 H new ATOM 0 HA3 GLY B 169 -4.588 -9.824 -0.440 1.00 34.02 H new ATOM 787 N ALA B 170 -2.977 -7.567 1.338 1.00 35.41 N ATOM 788 CA ALA B 170 -1.923 -6.548 1.315 1.00 34.41 C ATOM 789 C ALA B 170 -0.542 -7.129 1.188 1.00 73.04 C ATOM 790 O ALA B 170 0.337 -6.466 0.719 1.00 1.24 O ATOM 791 CB ALA B 170 -2.022 -5.645 2.524 1.00 13.24 C ATOM 0 H ALA B 170 -3.545 -7.548 2.185 1.00 35.41 H new ATOM 0 HA ALA B 170 -2.088 -5.953 0.417 1.00 34.41 H new ATOM 0 HB1 ALA B 170 -1.230 -4.897 2.485 1.00 13.24 H new ATOM 0 HB2 ALA B 170 -2.992 -5.147 2.528 1.00 13.24 H new ATOM 0 HB3 ALA B 170 -1.916 -6.239 3.432 1.00 13.24 H new ATOM 797 N LEU B 171 -0.377 -8.377 1.577 1.00 61.22 N ATOM 798 CA LEU B 171 0.904 -9.051 1.462 1.00 71.22 C ATOM 799 C LEU B 171 1.259 -9.220 -0.012 1.00 54.15 C ATOM 800 O LEU B 171 2.313 -8.780 -0.468 1.00 23.24 O ATOM 801 CB LEU B 171 0.836 -10.412 2.145 1.00 35.44 C ATOM 802 CG LEU B 171 0.476 -10.393 3.627 1.00 71.12 C ATOM 803 CD1 LEU B 171 0.419 -11.801 4.165 1.00 70.51 C ATOM 804 CD2 LEU B 171 1.477 -9.561 4.412 1.00 11.20 C ATOM 0 H LEU B 171 -1.119 -8.950 1.979 1.00 61.22 H new ATOM 0 HA LEU B 171 1.674 -8.453 1.949 1.00 71.22 H new ATOM 0 HB2 LEU B 171 0.103 -11.025 1.620 1.00 35.44 H new ATOM 0 HB3 LEU B 171 1.802 -10.903 2.031 1.00 35.44 H new ATOM 0 HG LEU B 171 -0.507 -9.936 3.740 1.00 71.12 H new ATOM 0 HD11 LEU B 171 0.161 -11.776 5.224 1.00 70.51 H new ATOM 0 HD12 LEU B 171 -0.336 -12.368 3.621 1.00 70.51 H new ATOM 0 HD13 LEU B 171 1.391 -12.278 4.040 1.00 70.51 H new ATOM 0 HD21 LEU B 171 1.202 -9.560 5.467 1.00 11.20 H new ATOM 0 HD22 LEU B 171 2.474 -9.987 4.297 1.00 11.20 H new ATOM 0 HD23 LEU B 171 1.474 -8.538 4.036 1.00 11.20 H new ATOM 816 N GLU B 172 0.338 -9.806 -0.744 1.00 61.41 N ATOM 817 CA GLU B 172 0.464 -10.045 -2.168 1.00 12.34 C ATOM 818 C GLU B 172 0.569 -8.734 -2.947 1.00 12.03 C ATOM 819 O GLU B 172 1.337 -8.618 -3.906 1.00 11.21 O ATOM 820 CB GLU B 172 -0.748 -10.858 -2.606 1.00 22.42 C ATOM 821 CG GLU B 172 -0.928 -11.031 -4.089 1.00 4.33 C ATOM 822 CD GLU B 172 -2.033 -11.990 -4.377 1.00 14.33 C ATOM 823 OE1 GLU B 172 -3.214 -11.633 -4.196 1.00 61.51 O ATOM 824 OE2 GLU B 172 -1.744 -13.137 -4.752 1.00 71.05 O1- ATOM 0 H GLU B 172 -0.545 -10.139 -0.356 1.00 61.41 H new ATOM 0 HA GLU B 172 1.381 -10.596 -2.377 1.00 12.34 H new ATOM 0 HB2 GLU B 172 -0.681 -11.846 -2.151 1.00 22.42 H new ATOM 0 HB3 GLU B 172 -1.643 -10.383 -2.205 1.00 22.42 H new ATOM 0 HG2 GLU B 172 -1.147 -10.067 -4.549 1.00 4.33 H new ATOM 0 HG3 GLU B 172 -0.001 -11.393 -4.533 1.00 4.33 H new ATOM 831 N LYS B 173 -0.191 -7.755 -2.516 1.00 75.52 N ATOM 832 CA LYS B 173 -0.220 -6.449 -3.131 1.00 52.14 C ATOM 833 C LYS B 173 1.096 -5.703 -2.876 1.00 13.42 C ATOM 834 O LYS B 173 1.589 -4.975 -3.736 1.00 22.05 O ATOM 835 CB LYS B 173 -1.394 -5.680 -2.540 1.00 52.11 C ATOM 836 CG LYS B 173 -2.745 -6.341 -2.790 1.00 23.24 C ATOM 837 CD LYS B 173 -3.244 -6.135 -4.200 1.00 32.34 C ATOM 838 CE LYS B 173 -4.417 -7.037 -4.510 1.00 65.44 C ATOM 839 NZ LYS B 173 -4.917 -6.865 -5.893 1.00 43.00 N1+ ATOM 0 H LYS B 173 -0.817 -7.845 -1.715 1.00 75.52 H new ATOM 0 HA LYS B 173 -0.338 -6.545 -4.210 1.00 52.14 H new ATOM 0 HB2 LYS B 173 -1.244 -5.574 -1.466 1.00 52.11 H new ATOM 0 HB3 LYS B 173 -1.408 -4.675 -2.961 1.00 52.11 H new ATOM 0 HG2 LYS B 173 -2.664 -7.410 -2.590 1.00 23.24 H new ATOM 0 HG3 LYS B 173 -3.476 -5.940 -2.088 1.00 23.24 H new ATOM 0 HD2 LYS B 173 -3.539 -5.094 -4.334 1.00 32.34 H new ATOM 0 HD3 LYS B 173 -2.436 -6.331 -4.905 1.00 32.34 H new ATOM 0 HE2 LYS B 173 -4.121 -8.076 -4.361 1.00 65.44 H new ATOM 0 HE3 LYS B 173 -5.225 -6.831 -3.807 1.00 65.44 H new ATOM 0 HZ1 LYS B 173 -5.628 -7.596 -6.099 1.00 43.00 H new ATOM 0 HZ2 LYS B 173 -5.349 -5.924 -5.991 1.00 43.00 H new ATOM 0 HZ3 LYS B 173 -4.126 -6.954 -6.562 1.00 43.00 H new ATOM 853 N LEU B 174 1.665 -5.935 -1.712 1.00 32.33 N ATOM 854 CA LEU B 174 2.894 -5.288 -1.275 1.00 44.15 C ATOM 855 C LEU B 174 4.054 -5.742 -2.165 1.00 4.04 C ATOM 856 O LEU B 174 4.871 -4.926 -2.586 1.00 43.44 O ATOM 857 CB LEU B 174 3.142 -5.656 0.208 1.00 22.15 C ATOM 858 CG LEU B 174 3.998 -4.729 1.089 1.00 32.13 C ATOM 859 CD1 LEU B 174 3.908 -5.184 2.528 1.00 13.11 C ATOM 860 CD2 LEU B 174 5.445 -4.718 0.662 1.00 43.15 C ATOM 0 H LEU B 174 1.284 -6.589 -1.028 1.00 32.33 H new ATOM 0 HA LEU B 174 2.812 -4.204 -1.360 1.00 44.15 H new ATOM 0 HB2 LEU B 174 2.168 -5.753 0.687 1.00 22.15 H new ATOM 0 HB3 LEU B 174 3.606 -6.642 0.226 1.00 22.15 H new ATOM 0 HG LEU B 174 3.610 -3.716 0.980 1.00 32.13 H new ATOM 0 HD11 LEU B 174 4.513 -4.529 3.155 1.00 13.11 H new ATOM 0 HD12 LEU B 174 2.870 -5.144 2.858 1.00 13.11 H new ATOM 0 HD13 LEU B 174 4.276 -6.207 2.610 1.00 13.11 H new ATOM 0 HD21 LEU B 174 6.011 -4.050 1.312 1.00 43.15 H new ATOM 0 HD22 LEU B 174 5.853 -5.726 0.733 1.00 43.15 H new ATOM 0 HD23 LEU B 174 5.518 -4.369 -0.368 1.00 43.15 H new ATOM 872 N GLU B 175 4.080 -7.041 -2.501 1.00 64.22 N ATOM 873 CA GLU B 175 5.100 -7.635 -3.304 1.00 34.22 C ATOM 874 C GLU B 175 5.190 -6.993 -4.689 1.00 30.54 C ATOM 875 O GLU B 175 6.259 -6.963 -5.305 1.00 40.22 O ATOM 876 CB GLU B 175 4.782 -9.092 -3.459 1.00 31.20 C ATOM 877 CG GLU B 175 4.743 -9.877 -2.171 1.00 63.55 C ATOM 878 CD GLU B 175 4.532 -11.342 -2.414 1.00 72.13 C ATOM 879 OE1 GLU B 175 3.398 -11.760 -2.713 1.00 5.21 O ATOM 880 OE2 GLU B 175 5.501 -12.120 -2.292 1.00 12.05 O1- ATOM 0 H GLU B 175 3.364 -7.703 -2.202 1.00 64.22 H new ATOM 0 HA GLU B 175 6.060 -7.485 -2.810 1.00 34.22 H new ATOM 0 HB2 GLU B 175 3.816 -9.187 -3.954 1.00 31.20 H new ATOM 0 HB3 GLU B 175 5.524 -9.542 -4.119 1.00 31.20 H new ATOM 0 HG2 GLU B 175 5.677 -9.730 -1.628 1.00 63.55 H new ATOM 0 HG3 GLU B 175 3.942 -9.495 -1.537 1.00 63.55 H new ATOM 887 N GLN B 176 4.074 -6.476 -5.158 1.00 53.05 N ATOM 888 CA GLN B 176 3.993 -5.857 -6.458 1.00 51.12 C ATOM 889 C GLN B 176 4.707 -4.526 -6.411 1.00 15.23 C ATOM 890 O GLN B 176 5.549 -4.211 -7.257 1.00 25.45 O ATOM 891 CB GLN B 176 2.534 -5.643 -6.817 1.00 22.05 C ATOM 892 CG GLN B 176 1.669 -6.865 -6.581 1.00 3.54 C ATOM 893 CD GLN B 176 2.142 -8.105 -7.317 1.00 35.11 C ATOM 894 OE1 GLN B 176 2.700 -8.034 -8.422 1.00 25.33 O ATOM 895 NE2 GLN B 176 2.002 -9.229 -6.680 1.00 12.14 N ATOM 0 H GLN B 176 3.194 -6.475 -4.643 1.00 53.05 H new ATOM 0 HA GLN B 176 4.459 -6.496 -7.208 1.00 51.12 H new ATOM 0 HB2 GLN B 176 2.142 -4.811 -6.232 1.00 22.05 H new ATOM 0 HB3 GLN B 176 2.464 -5.355 -7.866 1.00 22.05 H new ATOM 0 HG2 GLN B 176 1.641 -7.077 -5.512 1.00 3.54 H new ATOM 0 HG3 GLN B 176 0.648 -6.640 -6.888 1.00 3.54 H new ATOM 0 HE21 GLN B 176 1.537 -9.246 -5.772 1.00 12.14 H new ATOM 0 HE22 GLN B 176 2.357 -10.094 -7.088 1.00 12.14 H new ATOM 904 N LEU B 177 4.386 -3.769 -5.388 1.00 55.23 N ATOM 905 CA LEU B 177 4.975 -2.464 -5.146 1.00 50.03 C ATOM 906 C LEU B 177 6.442 -2.581 -4.751 1.00 2.24 C ATOM 907 O LEU B 177 7.213 -1.650 -4.901 1.00 11.31 O ATOM 908 CB LEU B 177 4.191 -1.761 -4.069 1.00 4.33 C ATOM 909 CG LEU B 177 4.625 -0.363 -3.724 1.00 13.40 C ATOM 910 CD1 LEU B 177 4.353 0.555 -4.900 1.00 11.02 C ATOM 911 CD2 LEU B 177 3.930 0.121 -2.469 1.00 54.44 C ATOM 0 H LEU B 177 3.698 -4.043 -4.687 1.00 55.23 H new ATOM 0 HA LEU B 177 4.933 -1.883 -6.068 1.00 50.03 H new ATOM 0 HB2 LEU B 177 3.146 -1.727 -4.376 1.00 4.33 H new ATOM 0 HB3 LEU B 177 4.238 -2.366 -3.163 1.00 4.33 H new ATOM 0 HG LEU B 177 5.696 -0.358 -3.521 1.00 13.40 H new ATOM 0 HD11 LEU B 177 4.667 1.569 -4.651 1.00 11.02 H new ATOM 0 HD12 LEU B 177 4.909 0.206 -5.770 1.00 11.02 H new ATOM 0 HD13 LEU B 177 3.287 0.551 -5.126 1.00 11.02 H new ATOM 0 HD21 LEU B 177 4.259 1.134 -2.239 1.00 54.44 H new ATOM 0 HD22 LEU B 177 2.851 0.117 -2.626 1.00 54.44 H new ATOM 0 HD23 LEU B 177 4.178 -0.539 -1.638 1.00 54.44 H new ATOM 923 N GLN B 178 6.809 -3.715 -4.229 1.00 31.43 N ATOM 924 CA GLN B 178 8.214 -4.018 -3.905 1.00 34.22 C ATOM 925 C GLN B 178 9.155 -3.925 -5.106 1.00 43.53 C ATOM 926 O GLN B 178 10.351 -3.736 -4.940 1.00 33.40 O ATOM 927 CB GLN B 178 8.361 -5.355 -3.214 1.00 22.20 C ATOM 928 CG GLN B 178 8.020 -5.300 -1.744 1.00 63.12 C ATOM 929 CD GLN B 178 8.950 -4.368 -0.948 1.00 52.34 C ATOM 930 OE1 GLN B 178 8.540 -3.756 0.034 1.00 3.53 O ATOM 931 NE2 GLN B 178 10.205 -4.279 -1.334 1.00 12.22 N ATOM 0 H GLN B 178 6.160 -4.470 -4.008 1.00 31.43 H new ATOM 0 HA GLN B 178 8.519 -3.236 -3.210 1.00 34.22 H new ATOM 0 HB2 GLN B 178 7.716 -6.084 -3.704 1.00 22.20 H new ATOM 0 HB3 GLN B 178 9.386 -5.707 -3.331 1.00 22.20 H new ATOM 0 HG2 GLN B 178 6.990 -4.963 -1.628 1.00 63.12 H new ATOM 0 HG3 GLN B 178 8.076 -6.305 -1.325 1.00 63.12 H new ATOM 0 HE21 GLN B 178 10.525 -4.796 -2.153 1.00 12.22 H new ATOM 0 HE22 GLN B 178 10.858 -3.693 -0.814 1.00 12.22 H new ATOM 940 N SER B 179 8.617 -3.997 -6.300 1.00 11.02 N ATOM 941 CA SER B 179 9.418 -3.878 -7.503 1.00 25.41 C ATOM 942 C SER B 179 9.586 -2.391 -7.887 1.00 10.24 C ATOM 943 O SER B 179 10.068 -2.061 -8.967 1.00 40.01 O ATOM 944 CB SER B 179 8.729 -4.645 -8.604 1.00 32.12 C ATOM 945 OG SER B 179 8.414 -5.960 -8.156 1.00 64.32 O ATOM 0 H SER B 179 7.621 -4.138 -6.469 1.00 11.02 H new ATOM 0 HA SER B 179 10.414 -4.289 -7.338 1.00 25.41 H new ATOM 0 HB2 SER B 179 7.819 -4.127 -8.906 1.00 32.12 H new ATOM 0 HB3 SER B 179 9.373 -4.695 -9.482 1.00 32.12 H new ATOM 0 HG SER B 179 7.965 -6.452 -8.875 1.00 64.32 H new ATOM 951 N HIS B 180 9.192 -1.527 -6.954 1.00 24.01 N ATOM 952 CA HIS B 180 9.238 -0.067 -7.074 1.00 14.12 C ATOM 953 C HIS B 180 10.528 0.457 -7.640 1.00 13.51 C ATOM 954 O HIS B 180 11.615 0.013 -7.276 1.00 60.24 O ATOM 955 CB HIS B 180 8.965 0.627 -5.722 1.00 1.42 C ATOM 956 CG HIS B 180 9.940 0.319 -4.591 1.00 74.51 C ATOM 957 ND1 HIS B 180 10.955 1.164 -4.210 1.00 63.40 N ATOM 958 CD2 HIS B 180 10.003 -0.725 -3.737 1.00 44.44 C ATOM 959 CE1 HIS B 180 11.590 0.649 -3.176 1.00 71.54 C ATOM 960 NE2 HIS B 180 11.032 -0.491 -2.872 1.00 34.33 N ATOM 0 H HIS B 180 8.817 -1.835 -6.057 1.00 24.01 H new ATOM 0 HA HIS B 180 8.445 0.174 -7.782 1.00 14.12 H new ATOM 0 HB2 HIS B 180 8.962 1.705 -5.886 1.00 1.42 H new ATOM 0 HB3 HIS B 180 7.963 0.352 -5.393 1.00 1.42 H new ATOM 0 HD1 HIS B 180 11.182 2.052 -4.658 1.00 63.40 H new ATOM 0 HD2 HIS B 180 9.356 -1.589 -3.738 1.00 44.44 H new ATOM 0 HE1 HIS B 180 12.431 1.095 -2.666 1.00 71.54 H new ATOM 969 N GLU B 181 10.396 1.398 -8.505 1.00 2.23 N ATOM 970 CA GLU B 181 11.506 2.060 -9.107 1.00 3.54 C ATOM 971 C GLU B 181 11.807 3.290 -8.279 1.00 21.45 C ATOM 972 O GLU B 181 12.958 3.671 -8.089 1.00 41.00 O ATOM 973 CB GLU B 181 11.145 2.469 -10.526 1.00 22.41 C ATOM 974 CG GLU B 181 10.627 1.331 -11.379 1.00 21.45 C ATOM 975 CD GLU B 181 10.336 1.766 -12.783 1.00 4.11 C ATOM 976 OE1 GLU B 181 11.254 1.748 -13.623 1.00 21.44 O ATOM 977 OE2 GLU B 181 9.181 2.149 -13.085 1.00 34.25 O1- ATOM 0 H GLU B 181 9.490 1.741 -8.825 1.00 2.23 H new ATOM 0 HA GLU B 181 12.375 1.403 -9.145 1.00 3.54 H new ATOM 0 HB2 GLU B 181 10.389 3.254 -10.486 1.00 22.41 H new ATOM 0 HB3 GLU B 181 12.025 2.898 -11.005 1.00 22.41 H new ATOM 0 HG2 GLU B 181 11.362 0.526 -11.394 1.00 21.45 H new ATOM 0 HG3 GLU B 181 9.720 0.926 -10.930 1.00 21.45 H new ATOM 984 N ASN B 182 10.745 3.884 -7.762 1.00 1.10 N ATOM 985 CA ASN B 182 10.839 5.086 -6.939 1.00 51.53 C ATOM 986 C ASN B 182 11.390 4.766 -5.597 1.00 31.02 C ATOM 987 O ASN B 182 11.039 3.762 -4.960 1.00 72.11 O ATOM 988 CB ASN B 182 9.501 5.800 -6.829 1.00 70.24 C ATOM 989 CG ASN B 182 9.600 7.151 -6.143 1.00 71.13 C ATOM 990 OD1 ASN B 182 9.505 7.237 -4.932 1.00 53.24 O ATOM 991 ND2 ASN B 182 9.781 8.196 -6.903 1.00 41.44 N ATOM 0 H ASN B 182 9.791 3.549 -7.899 1.00 1.10 H new ATOM 0 HA ASN B 182 11.528 5.770 -7.434 1.00 51.53 H new ATOM 0 HB2 ASN B 182 9.086 5.936 -7.828 1.00 70.24 H new ATOM 0 HB3 ASN B 182 8.804 5.169 -6.277 1.00 70.24 H new ATOM 0 HD21 ASN B 182 9.848 9.124 -6.486 1.00 41.44 H new ATOM 0 HD22 ASN B 182 9.856 8.084 -7.914 1.00 41.44 H new ATOM 998 N GLU B 183 12.228 5.642 -5.183 1.00 21.41 N ATOM 999 CA GLU B 183 13.015 5.507 -4.034 1.00 75.53 C ATOM 1000 C GLU B 183 12.234 5.820 -2.738 1.00 53.13 C ATOM 1001 O GLU B 183 12.528 5.267 -1.683 1.00 62.23 O ATOM 1002 CB GLU B 183 14.181 6.439 -4.229 1.00 4.41 C ATOM 1003 CG GLU B 183 13.913 7.903 -3.893 1.00 71.12 C ATOM 1004 CD GLU B 183 15.044 8.807 -4.310 1.00 70.35 C ATOM 1005 OE1 GLU B 183 15.182 9.089 -5.518 1.00 74.32 O ATOM 1006 OE2 GLU B 183 15.813 9.259 -3.443 1.00 10.34 O1- ATOM 0 H GLU B 183 12.386 6.523 -5.673 1.00 21.41 H new ATOM 0 HA GLU B 183 13.345 4.476 -3.908 1.00 75.53 H new ATOM 0 HB2 GLU B 183 15.011 6.089 -3.615 1.00 4.41 H new ATOM 0 HB3 GLU B 183 14.505 6.376 -5.268 1.00 4.41 H new ATOM 0 HG2 GLU B 183 12.995 8.223 -4.386 1.00 71.12 H new ATOM 0 HG3 GLU B 183 13.750 8.002 -2.820 1.00 71.12 H new ATOM 1013 N LYS B 184 11.225 6.676 -2.835 1.00 31.52 N ATOM 1014 CA LYS B 184 10.453 7.094 -1.666 1.00 55.01 C ATOM 1015 C LYS B 184 9.487 6.000 -1.288 1.00 72.22 C ATOM 1016 O LYS B 184 9.251 5.716 -0.117 1.00 13.24 O ATOM 1017 CB LYS B 184 9.639 8.334 -1.989 1.00 13.15 C ATOM 1018 CG LYS B 184 10.441 9.553 -2.393 1.00 23.11 C ATOM 1019 CD LYS B 184 9.527 10.643 -2.941 1.00 51.20 C ATOM 1020 CE LYS B 184 8.473 11.071 -1.937 1.00 41.21 C ATOM 1021 NZ LYS B 184 7.539 12.043 -2.520 1.00 13.42 N1+ ATOM 0 H LYS B 184 10.919 7.097 -3.712 1.00 31.52 H new ATOM 0 HA LYS B 184 11.147 7.302 -0.852 1.00 55.01 H new ATOM 0 HB2 LYS B 184 8.946 8.093 -2.795 1.00 13.15 H new ATOM 0 HB3 LYS B 184 9.037 8.589 -1.117 1.00 13.15 H new ATOM 0 HG2 LYS B 184 10.993 9.933 -1.533 1.00 23.11 H new ATOM 0 HG3 LYS B 184 11.178 9.276 -3.147 1.00 23.11 H new ATOM 0 HD2 LYS B 184 10.127 11.508 -3.225 1.00 51.20 H new ATOM 0 HD3 LYS B 184 9.038 10.283 -3.846 1.00 51.20 H new ATOM 0 HE2 LYS B 184 7.921 10.197 -1.592 1.00 41.21 H new ATOM 0 HE3 LYS B 184 8.957 11.508 -1.064 1.00 41.21 H new ATOM 0 HZ1 LYS B 184 6.832 12.315 -1.808 1.00 13.42 H new ATOM 0 HZ2 LYS B 184 8.063 12.887 -2.827 1.00 13.42 H new ATOM 0 HZ3 LYS B 184 7.060 11.616 -3.339 1.00 13.42 H new ATOM 1035 N ILE B 185 8.992 5.361 -2.328 1.00 60.21 N ATOM 1036 CA ILE B 185 7.966 4.323 -2.298 1.00 75.21 C ATOM 1037 C ILE B 185 8.205 3.200 -1.277 1.00 0.43 C ATOM 1038 O ILE B 185 7.254 2.559 -0.811 1.00 60.43 O ATOM 1039 CB ILE B 185 7.789 3.753 -3.711 1.00 72.20 C ATOM 1040 CG1 ILE B 185 7.169 4.823 -4.585 1.00 53.13 C ATOM 1041 CG2 ILE B 185 6.960 2.473 -3.720 1.00 64.03 C ATOM 1042 CD1 ILE B 185 5.810 5.270 -4.150 1.00 52.31 C ATOM 0 H ILE B 185 9.310 5.560 -3.276 1.00 60.21 H new ATOM 0 HA ILE B 185 7.050 4.805 -1.956 1.00 75.21 H new ATOM 0 HB ILE B 185 8.766 3.474 -4.105 1.00 72.20 H new ATOM 0 HG12 ILE B 185 7.833 5.687 -4.605 1.00 53.13 H new ATOM 0 HG13 ILE B 185 7.104 4.447 -5.606 1.00 53.13 H new ATOM 0 HG21 ILE B 185 6.864 2.109 -4.743 1.00 64.03 H new ATOM 0 HG22 ILE B 185 7.453 1.716 -3.111 1.00 64.03 H new ATOM 0 HG23 ILE B 185 5.970 2.678 -3.313 1.00 64.03 H new ATOM 0 HD11 ILE B 185 5.443 6.037 -4.833 1.00 52.31 H new ATOM 0 HD12 ILE B 185 5.127 4.420 -4.158 1.00 52.31 H new ATOM 0 HD13 ILE B 185 5.867 5.679 -3.141 1.00 52.31 H new ATOM 1054 N GLN B 186 9.445 2.986 -0.916 1.00 51.04 N ATOM 1055 CA GLN B 186 9.802 1.973 0.058 1.00 13.34 C ATOM 1056 C GLN B 186 9.003 2.175 1.359 1.00 43.21 C ATOM 1057 O GLN B 186 8.433 1.242 1.912 1.00 14.42 O ATOM 1058 CB GLN B 186 11.297 2.040 0.316 1.00 3.31 C ATOM 1059 CG GLN B 186 11.795 3.343 0.947 1.00 30.13 C ATOM 1060 CD GLN B 186 13.295 3.417 1.076 1.00 33.34 C ATOM 1061 OE1 GLN B 186 14.035 2.861 0.261 1.00 41.14 O ATOM 1062 NE2 GLN B 186 13.754 4.073 2.102 1.00 12.44 N ATOM 0 H GLN B 186 10.240 3.507 -1.287 1.00 51.04 H new ATOM 0 HA GLN B 186 9.554 0.985 -0.330 1.00 13.34 H new ATOM 0 HB2 GLN B 186 11.574 1.211 0.968 1.00 3.31 H new ATOM 0 HB3 GLN B 186 11.819 1.891 -0.629 1.00 3.31 H new ATOM 0 HG2 GLN B 186 11.449 4.184 0.346 1.00 30.13 H new ATOM 0 HG3 GLN B 186 11.348 3.452 1.935 1.00 30.13 H new ATOM 0 HE21 GLN B 186 13.108 4.519 2.753 1.00 12.44 H new ATOM 0 HE22 GLN B 186 14.760 4.141 2.255 1.00 12.44 H new ATOM 1071 N LYS B 187 8.892 3.428 1.739 1.00 22.52 N ATOM 1072 CA LYS B 187 8.184 3.877 2.927 1.00 74.33 C ATOM 1073 C LYS B 187 6.679 3.576 2.813 1.00 72.42 C ATOM 1074 O LYS B 187 6.001 3.291 3.814 1.00 44.24 O ATOM 1075 CB LYS B 187 8.381 5.392 3.051 1.00 51.52 C ATOM 1076 CG LYS B 187 7.770 6.022 4.291 1.00 61.53 C ATOM 1077 CD LYS B 187 8.541 5.681 5.559 1.00 22.21 C ATOM 1078 CE LYS B 187 9.903 6.360 5.583 1.00 31.44 C ATOM 1079 NZ LYS B 187 9.783 7.838 5.523 1.00 31.33 N1+ ATOM 0 H LYS B 187 9.307 4.196 1.211 1.00 22.52 H new ATOM 0 HA LYS B 187 8.575 3.355 3.801 1.00 74.33 H new ATOM 0 HB2 LYS B 187 9.450 5.606 3.043 1.00 51.52 H new ATOM 0 HB3 LYS B 187 7.953 5.872 2.170 1.00 51.52 H new ATOM 0 HG2 LYS B 187 7.741 7.105 4.168 1.00 61.53 H new ATOM 0 HG3 LYS B 187 6.739 5.685 4.395 1.00 61.53 H new ATOM 0 HD2 LYS B 187 7.964 5.989 6.431 1.00 22.21 H new ATOM 0 HD3 LYS B 187 8.670 4.601 5.628 1.00 22.21 H new ATOM 0 HE2 LYS B 187 10.435 6.075 6.491 1.00 31.44 H new ATOM 0 HE3 LYS B 187 10.499 6.009 4.740 1.00 31.44 H new ATOM 0 HZ1 LYS B 187 10.667 8.272 5.858 1.00 31.33 H new ATOM 0 HZ2 LYS B 187 9.604 8.132 4.542 1.00 31.33 H new ATOM 0 HZ3 LYS B 187 8.995 8.147 6.127 1.00 31.33 H new ATOM 1093 N GLU B 188 6.176 3.628 1.597 1.00 1.40 N ATOM 1094 CA GLU B 188 4.760 3.439 1.324 1.00 41.11 C ATOM 1095 C GLU B 188 4.422 1.950 1.400 1.00 55.30 C ATOM 1096 O GLU B 188 3.348 1.566 1.847 1.00 1.32 O ATOM 1097 CB GLU B 188 4.409 3.987 -0.068 1.00 0.21 C ATOM 1098 CG GLU B 188 5.006 5.365 -0.400 1.00 71.14 C ATOM 1099 CD GLU B 188 4.570 6.502 0.506 1.00 11.41 C ATOM 1100 OE1 GLU B 188 5.176 6.697 1.574 1.00 31.44 O ATOM 1101 OE2 GLU B 188 3.676 7.275 0.126 1.00 62.41 O1- ATOM 0 H GLU B 188 6.738 3.803 0.764 1.00 1.40 H new ATOM 0 HA GLU B 188 4.177 3.981 2.068 1.00 41.11 H new ATOM 0 HB2 GLU B 188 4.747 3.272 -0.818 1.00 0.21 H new ATOM 0 HB3 GLU B 188 3.324 4.049 -0.153 1.00 0.21 H new ATOM 0 HG2 GLU B 188 6.093 5.289 -0.362 1.00 71.14 H new ATOM 0 HG3 GLU B 188 4.740 5.619 -1.426 1.00 71.14 H new ATOM 1108 N ALA B 189 5.365 1.119 0.983 1.00 22.15 N ATOM 1109 CA ALA B 189 5.202 -0.331 1.040 1.00 34.34 C ATOM 1110 C ALA B 189 5.220 -0.792 2.494 1.00 10.01 C ATOM 1111 O ALA B 189 4.381 -1.594 2.931 1.00 70.11 O ATOM 1112 CB ALA B 189 6.309 -1.015 0.247 1.00 52.44 C ATOM 0 H ALA B 189 6.259 1.424 0.598 1.00 22.15 H new ATOM 0 HA ALA B 189 4.244 -0.604 0.596 1.00 34.34 H new ATOM 0 HB1 ALA B 189 6.177 -2.096 0.296 1.00 52.44 H new ATOM 0 HB2 ALA B 189 6.265 -0.691 -0.793 1.00 52.44 H new ATOM 0 HB3 ALA B 189 7.278 -0.748 0.669 1.00 52.44 H new ATOM 1118 N GLN B 190 6.165 -0.240 3.247 1.00 64.45 N ATOM 1119 CA GLN B 190 6.327 -0.532 4.665 1.00 73.23 C ATOM 1120 C GLN B 190 5.104 -0.115 5.473 1.00 61.30 C ATOM 1121 O GLN B 190 4.840 -0.693 6.504 1.00 21.21 O ATOM 1122 CB GLN B 190 7.556 0.183 5.212 1.00 2.33 C ATOM 1123 CG GLN B 190 8.848 -0.237 4.565 1.00 20.12 C ATOM 1124 CD GLN B 190 10.037 0.557 5.066 1.00 2.31 C ATOM 1125 OE1 GLN B 190 10.378 1.606 4.520 1.00 32.22 O ATOM 1126 NE2 GLN B 190 10.682 0.075 6.087 1.00 62.14 N ATOM 0 H GLN B 190 6.846 0.429 2.886 1.00 64.45 H new ATOM 0 HA GLN B 190 6.449 -1.611 4.761 1.00 73.23 H new ATOM 0 HB2 GLN B 190 7.428 1.257 5.079 1.00 2.33 H new ATOM 0 HB3 GLN B 190 7.623 0.000 6.284 1.00 2.33 H new ATOM 0 HG2 GLN B 190 9.017 -1.297 4.756 1.00 20.12 H new ATOM 0 HG3 GLN B 190 8.765 -0.117 3.485 1.00 20.12 H new ATOM 0 HE21 GLN B 190 10.375 -0.797 6.519 1.00 62.14 H new ATOM 0 HE22 GLN B 190 11.495 0.569 6.456 1.00 62.14 H new ATOM 1135 N GLU B 191 4.350 0.855 4.960 1.00 20.43 N ATOM 1136 CA GLU B 191 3.180 1.422 5.642 1.00 21.04 C ATOM 1137 C GLU B 191 2.176 0.330 6.067 1.00 11.53 C ATOM 1138 O GLU B 191 1.793 0.234 7.244 1.00 43.14 O ATOM 1139 CB GLU B 191 2.481 2.429 4.716 1.00 13.23 C ATOM 1140 CG GLU B 191 1.328 3.188 5.352 1.00 73.14 C ATOM 1141 CD GLU B 191 1.780 4.205 6.369 1.00 25.30 C ATOM 1142 OE1 GLU B 191 2.477 3.842 7.338 1.00 63.00 O ATOM 1143 OE2 GLU B 191 1.410 5.386 6.232 1.00 14.54 O1- ATOM 0 H GLU B 191 4.533 1.277 4.049 1.00 20.43 H new ATOM 0 HA GLU B 191 3.532 1.922 6.545 1.00 21.04 H new ATOM 0 HB2 GLU B 191 3.219 3.148 4.362 1.00 13.23 H new ATOM 0 HB3 GLU B 191 2.108 1.898 3.840 1.00 13.23 H new ATOM 0 HG2 GLU B 191 0.758 3.692 4.572 1.00 73.14 H new ATOM 0 HG3 GLU B 191 0.654 2.478 5.831 1.00 73.14 H new ATOM 1150 N ALA B 192 1.776 -0.501 5.118 1.00 12.05 N ATOM 1151 CA ALA B 192 0.799 -1.553 5.395 1.00 52.44 C ATOM 1152 C ALA B 192 1.462 -2.725 6.082 1.00 63.31 C ATOM 1153 O ALA B 192 0.853 -3.341 6.940 1.00 62.12 O ATOM 1154 CB ALA B 192 0.080 -2.006 4.112 1.00 12.11 C ATOM 0 H ALA B 192 2.107 -0.472 4.154 1.00 12.05 H new ATOM 0 HA ALA B 192 0.045 -1.140 6.065 1.00 52.44 H new ATOM 0 HB1 ALA B 192 -0.639 -2.789 4.355 1.00 12.11 H new ATOM 0 HB2 ALA B 192 -0.442 -1.158 3.669 1.00 12.11 H new ATOM 0 HB3 ALA B 192 0.811 -2.393 3.402 1.00 12.11 H new ATOM 1160 N LEU B 193 2.733 -2.976 5.727 1.00 21.32 N ATOM 1161 CA LEU B 193 3.547 -4.076 6.253 1.00 65.15 C ATOM 1162 C LEU B 193 3.486 -4.042 7.761 1.00 0.51 C ATOM 1163 O LEU B 193 2.998 -4.957 8.423 1.00 31.01 O ATOM 1164 CB LEU B 193 4.997 -3.804 5.788 1.00 24.10 C ATOM 1165 CG LEU B 193 6.077 -4.868 6.031 1.00 35.55 C ATOM 1166 CD1 LEU B 193 7.216 -4.660 5.044 1.00 41.22 C ATOM 1167 CD2 LEU B 193 6.626 -4.714 7.433 1.00 3.03 C ATOM 0 H LEU B 193 3.233 -2.402 5.048 1.00 21.32 H new ATOM 0 HA LEU B 193 3.197 -5.048 5.905 1.00 65.15 H new ATOM 0 HB2 LEU B 193 4.966 -3.608 4.716 1.00 24.10 H new ATOM 0 HB3 LEU B 193 5.329 -2.885 6.271 1.00 24.10 H new ATOM 0 HG LEU B 193 5.643 -5.860 5.904 1.00 35.55 H new ATOM 0 HD11 LEU B 193 7.986 -5.413 5.213 1.00 41.22 H new ATOM 0 HD12 LEU B 193 6.837 -4.750 4.026 1.00 41.22 H new ATOM 0 HD13 LEU B 193 7.643 -3.667 5.185 1.00 41.22 H new ATOM 0 HD21 LEU B 193 7.393 -5.468 7.608 1.00 3.03 H new ATOM 0 HD22 LEU B 193 7.061 -3.721 7.546 1.00 3.03 H new ATOM 0 HD23 LEU B 193 5.820 -4.842 8.155 1.00 3.03 H new ATOM 1179 N GLU B 194 3.936 -2.933 8.240 1.00 32.42 N ATOM 1180 CA GLU B 194 4.036 -2.544 9.538 1.00 1.13 C ATOM 1181 C GLU B 194 2.752 -2.744 10.314 1.00 25.31 C ATOM 1182 O GLU B 194 2.687 -3.465 11.324 1.00 45.10 O ATOM 1183 CB GLU B 194 4.276 -1.089 9.352 1.00 42.50 C ATOM 1184 CG GLU B 194 4.308 -0.351 10.573 1.00 61.52 C ATOM 1185 CD GLU B 194 4.678 1.088 10.377 1.00 43.35 C ATOM 1186 OE1 GLU B 194 5.879 1.409 10.306 1.00 73.13 O ATOM 1187 OE2 GLU B 194 3.770 1.938 10.286 1.00 14.30 O1- ATOM 0 H GLU B 194 4.280 -2.205 7.613 1.00 32.42 H new ATOM 0 HA GLU B 194 4.788 -3.098 10.099 1.00 1.13 H new ATOM 0 HB2 GLU B 194 5.222 -0.950 8.829 1.00 42.50 H new ATOM 0 HB3 GLU B 194 3.495 -0.680 8.711 1.00 42.50 H new ATOM 0 HG2 GLU B 194 3.330 -0.407 11.051 1.00 61.52 H new ATOM 0 HG3 GLU B 194 5.022 -0.815 11.253 1.00 61.52 H new ATOM 1194 N LYS B 195 1.772 -2.093 9.829 1.00 35.45 N ATOM 1195 CA LYS B 195 0.508 -1.990 10.427 1.00 0.22 C ATOM 1196 C LYS B 195 -0.380 -3.231 10.369 1.00 34.32 C ATOM 1197 O LYS B 195 -1.265 -3.381 11.224 1.00 24.42 O ATOM 1198 CB LYS B 195 -0.168 -0.750 9.913 1.00 52.22 C ATOM 1199 CG LYS B 195 0.136 0.467 10.755 1.00 23.11 C ATOM 1200 CD LYS B 195 -0.604 1.706 10.288 1.00 42.32 C ATOM 1201 CE LYS B 195 0.102 2.390 9.136 1.00 61.10 C ATOM 1202 NZ LYS B 195 1.413 2.952 9.547 1.00 34.23 N1+ ATOM 0 H LYS B 195 1.837 -1.586 8.947 1.00 35.45 H new ATOM 0 HA LYS B 195 0.681 -1.909 11.500 1.00 0.22 H new ATOM 0 HB2 LYS B 195 0.150 -0.566 8.887 1.00 52.22 H new ATOM 0 HB3 LYS B 195 -1.246 -0.911 9.889 1.00 52.22 H new ATOM 0 HG2 LYS B 195 -0.129 0.261 11.792 1.00 23.11 H new ATOM 0 HG3 LYS B 195 1.209 0.660 10.732 1.00 23.11 H new ATOM 0 HD2 LYS B 195 -1.614 1.431 9.982 1.00 42.32 H new ATOM 0 HD3 LYS B 195 -0.702 2.404 11.119 1.00 42.32 H new ATOM 0 HE2 LYS B 195 0.251 1.676 8.326 1.00 61.10 H new ATOM 0 HE3 LYS B 195 -0.529 3.188 8.746 1.00 61.10 H new ATOM 0 HZ1 LYS B 195 1.739 3.632 8.831 1.00 34.23 H new ATOM 0 HZ2 LYS B 195 1.312 3.435 10.463 1.00 34.23 H new ATOM 0 HZ3 LYS B 195 2.108 2.183 9.636 1.00 34.23 H new ATOM 1216 N LEU B 196 -0.196 -4.109 9.396 1.00 42.45 N ATOM 1217 CA LEU B 196 -0.984 -5.269 9.348 1.00 65.11 C ATOM 1218 C LEU B 196 -0.451 -6.305 10.297 1.00 32.01 C ATOM 1219 O LEU B 196 -1.205 -7.119 10.823 1.00 22.43 O ATOM 1220 CB LEU B 196 -1.040 -5.815 7.938 1.00 75.42 C ATOM 1221 CG LEU B 196 0.176 -6.559 7.364 1.00 24.30 C ATOM 1222 CD1 LEU B 196 0.058 -8.062 7.618 1.00 63.01 C ATOM 1223 CD2 LEU B 196 0.326 -6.259 5.885 1.00 63.35 C ATOM 0 H LEU B 196 0.492 -4.017 8.649 1.00 42.45 H new ATOM 0 HA LEU B 196 -1.998 -5.011 9.655 1.00 65.11 H new ATOM 0 HB2 LEU B 196 -1.892 -6.492 7.884 1.00 75.42 H new ATOM 0 HB3 LEU B 196 -1.255 -4.979 7.273 1.00 75.42 H new ATOM 0 HG LEU B 196 1.074 -6.208 7.872 1.00 24.30 H new ATOM 0 HD11 LEU B 196 0.929 -8.570 7.204 1.00 63.01 H new ATOM 0 HD12 LEU B 196 0.006 -8.247 8.691 1.00 63.01 H new ATOM 0 HD13 LEU B 196 -0.845 -8.442 7.140 1.00 63.01 H new ATOM 0 HD21 LEU B 196 1.191 -6.792 5.491 1.00 63.35 H new ATOM 0 HD22 LEU B 196 -0.571 -6.581 5.356 1.00 63.35 H new ATOM 0 HD23 LEU B 196 0.465 -5.187 5.743 1.00 63.35 H new ATOM 1235 N GLN B 197 0.847 -6.293 10.488 1.00 54.12 N ATOM 1236 CA GLN B 197 1.461 -7.243 11.355 1.00 1.52 C ATOM 1237 C GLN B 197 1.057 -6.952 12.793 1.00 14.31 C ATOM 1238 O GLN B 197 1.095 -5.785 13.221 1.00 23.34 O ATOM 1239 CB GLN B 197 2.975 -7.256 11.193 1.00 12.04 C ATOM 1240 CG GLN B 197 3.432 -7.698 9.815 1.00 14.33 C ATOM 1241 CD GLN B 197 4.934 -7.713 9.668 1.00 33.32 C ATOM 1242 OE1 GLN B 197 5.648 -6.941 10.304 1.00 54.42 O ATOM 1243 NE2 GLN B 197 5.426 -8.578 8.831 1.00 34.25 N ATOM 0 H GLN B 197 1.489 -5.632 10.050 1.00 54.12 H new ATOM 0 HA GLN B 197 1.111 -8.239 11.085 1.00 1.52 H new ATOM 0 HB2 GLN B 197 3.363 -6.257 11.393 1.00 12.04 H new ATOM 0 HB3 GLN B 197 3.407 -7.921 11.941 1.00 12.04 H new ATOM 0 HG2 GLN B 197 3.043 -8.696 9.612 1.00 14.33 H new ATOM 0 HG3 GLN B 197 3.006 -7.031 9.066 1.00 14.33 H new ATOM 0 HE21 GLN B 197 4.804 -9.204 8.320 1.00 34.25 H new ATOM 0 HE22 GLN B 197 6.434 -8.631 8.686 1.00 34.25 H new ATOM 1252 N SER B 198 0.656 -7.988 13.513 1.00 33.54 N ATOM 1253 CA SER B 198 0.154 -7.878 14.867 1.00 12.43 C ATOM 1254 C SER B 198 1.114 -7.115 15.788 1.00 1.54 C ATOM 1255 O SER B 198 2.324 -7.403 15.842 1.00 24.20 O ATOM 1256 CB SER B 198 -0.114 -9.278 15.391 1.00 25.00 C ATOM 1257 OG SER B 198 -1.016 -9.957 14.521 1.00 4.45 O ATOM 0 H SER B 198 0.672 -8.946 13.163 1.00 33.54 H new ATOM 0 HA SER B 198 -0.769 -7.298 14.855 1.00 12.43 H new ATOM 0 HB2 SER B 198 0.821 -9.833 15.465 1.00 25.00 H new ATOM 0 HB3 SER B 198 -0.534 -9.226 16.396 1.00 25.00 H new ATOM 0 HG SER B 198 -1.184 -10.860 14.863 1.00 4.45 H new ATOM 1263 N HIS B 199 0.558 -6.146 16.484 1.00 64.41 N ATOM 1264 CA HIS B 199 1.273 -5.262 17.372 1.00 72.30 C ATOM 1265 C HIS B 199 0.246 -4.374 18.048 1.00 63.44 C ATOM 1266 O HIS B 199 -0.267 -4.738 19.113 1.00 64.51 O ATOM 1267 CB HIS B 199 2.289 -4.396 16.578 1.00 55.12 C ATOM 1268 CG HIS B 199 3.011 -3.364 17.397 1.00 44.44 C ATOM 1269 ND1 HIS B 199 2.689 -2.030 17.355 1.00 1.01 N ATOM 1270 CD2 HIS B 199 4.038 -3.468 18.268 1.00 11.40 C ATOM 1271 CE1 HIS B 199 3.475 -1.359 18.156 1.00 1.32 C ATOM 1272 NE2 HIS B 199 4.305 -2.200 18.726 1.00 12.31 N ATOM 0 H HIS B 199 -0.442 -5.947 16.443 1.00 64.41 H new ATOM 0 HA HIS B 199 1.834 -5.836 18.109 1.00 72.30 H new ATOM 0 HB2 HIS B 199 3.025 -5.055 16.118 1.00 55.12 H new ATOM 0 HB3 HIS B 199 1.761 -3.893 15.768 1.00 55.12 H new ATOM 0 HD2 HIS B 199 4.552 -4.375 18.551 1.00 11.40 H new ATOM 0 HE1 HIS B 199 3.446 -0.292 18.321 1.00 1.32 H new ATOM 0 HE2 HIS B 199 5.030 -1.953 19.399 1.00 12.31 H new TER 1281 HIS B 199