USER MOD reduce.3.24.130724 H: found=0, std=0, add=638, rem=0, adj=14 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 186 GLN : amide:sc= -0.284 K(o=0.09,f=-0.7) USER MOD Set 1.2: B 190 GLN : amide:sc= 0.374 X(o=0.09,f=-0.28) USER MOD Single : B 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 119 GLN : amide:sc= -1.57! C(o=-1.6!,f=-8.2!) USER MOD Single : B 121 GLN :FLIP amide:sc= 0 F(o=-0.67,f=0) USER MOD Single : B 134 GLN : amide:sc= -0.49 K(o=-0.49,f=-1.3) USER MOD Single : B 137 SER OG : rot -35:sc= 0.0439 USER MOD Single : B 138 SER OG : rot 110:sc= -1.71 USER MOD Single : B 140 ASN : amide:sc= -2.15 K(o=-2.1,f=-11!) USER MOD Single : B 142 GLN : amide:sc= -0.0294 X(o=-0.029,f=-0.029) USER MOD Single : B 145 GLN : amide:sc=-0.00667 K(o=-0.0067,f=-0.6) USER MOD Single : B 152 SER OG : rot 38:sc= 1.18 USER MOD Single : B 153 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 156 SER OG : rot 180:sc= 0 USER MOD Single : B 159 ASN : amide:sc= -0.0521 K(o=-0.052,f=-0.57) USER MOD Single : B 161 GLN : amide:sc= -0.0905 K(o=-0.09,f=-1.3) USER MOD Single : B 162 LYS NZ :NH3+ 139:sc= 1.19 (180deg=0.63) USER MOD Single : B 163 GLN : amide:sc= -1.33 K(o=-1.3,f=-2.3) USER MOD Single : B 166 LYS NZ :NH3+ -151:sc= -0.118 (180deg=-0.788) USER MOD Single : B 173 LYS NZ :NH3+ -164:sc= 2.27 (180deg=1.98) USER MOD Single : B 176 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 178 GLN : amide:sc= -1.96! C(o=-2!,f=-7.1!) USER MOD Single : B 179 SER OG : rot 180:sc= 0 USER MOD Single : B 180 HIS : no HE2:sc= 1.14 K(o=1.1,f=-3.6!) USER MOD Single : B 182 ASN : amide:sc= 0.564 K(o=0.56,f=-9.4!) USER MOD Single : B 184 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0136) USER MOD Single : B 187 LYS NZ :NH3+ -126:sc= 0.681 (180deg=-0.0972) USER MOD Single : B 195 LYS NZ :NH3+ -170:sc= 2.35 (180deg=2.03) USER MOD Single : B 197 GLN : amide:sc= -0.0538 K(o=-0.054,f=-0.91) 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 -15.119 -9.281 -2.843 1.00 43.50 N ATOM 2 CA GLY B 116 -15.394 -7.956 -3.385 1.00 51.03 C ATOM 3 C GLY B 116 -16.007 -8.035 -4.758 1.00 55.12 C ATOM 4 O GLY B 116 -16.937 -8.810 -4.978 1.00 71.11 O ATOM 0 HA2 GLY B 116 -16.068 -7.421 -2.715 1.00 51.03 H new ATOM 0 HA3 GLY B 116 -14.469 -7.382 -3.432 1.00 51.03 H new ATOM 10 N ASN B 117 -15.490 -7.245 -5.687 1.00 42.41 N ATOM 11 CA ASN B 117 -16.007 -7.195 -7.056 1.00 13.23 C ATOM 12 C ASN B 117 -14.862 -7.141 -8.040 1.00 52.13 C ATOM 13 O ASN B 117 -13.730 -6.856 -7.649 1.00 15.13 O ATOM 14 CB ASN B 117 -16.913 -5.961 -7.281 1.00 73.32 C ATOM 15 CG ASN B 117 -18.276 -6.048 -6.615 1.00 54.21 C ATOM 16 OD1 ASN B 117 -18.460 -5.614 -5.473 1.00 63.23 O ATOM 17 ND2 ASN B 117 -19.240 -6.587 -7.320 1.00 10.35 N ATOM 0 H ASN B 117 -14.702 -6.620 -5.519 1.00 42.41 H new ATOM 0 HA ASN B 117 -16.600 -8.096 -7.212 1.00 13.23 H new ATOM 0 HB2 ASN B 117 -16.397 -5.075 -6.910 1.00 73.32 H new ATOM 0 HB3 ASN B 117 -17.055 -5.821 -8.353 1.00 73.32 H new ATOM 0 HD21 ASN B 117 -20.179 -6.659 -6.929 1.00 10.35 H new ATOM 0 HD22 ASN B 117 -19.051 -6.935 -8.260 1.00 10.35 H new ATOM 24 N GLU B 118 -15.155 -7.404 -9.296 1.00 24.14 N ATOM 25 CA GLU B 118 -14.182 -7.345 -10.377 1.00 20.43 C ATOM 26 C GLU B 118 -14.796 -6.647 -11.584 1.00 64.51 C ATOM 27 O GLU B 118 -15.929 -6.964 -11.991 1.00 4.54 O ATOM 28 CB GLU B 118 -13.656 -8.735 -10.735 1.00 44.13 C ATOM 29 CG GLU B 118 -14.736 -9.766 -10.986 1.00 15.24 C ATOM 30 CD GLU B 118 -14.167 -11.100 -11.352 1.00 74.53 C ATOM 31 OE1 GLU B 118 -13.366 -11.658 -10.557 1.00 52.43 O1- ATOM 32 OE2 GLU B 118 -14.489 -11.618 -12.439 1.00 53.31 O ATOM 0 H GLU B 118 -16.090 -7.670 -9.604 1.00 24.14 H new ATOM 0 HA GLU B 118 -13.323 -6.764 -10.042 1.00 20.43 H new ATOM 0 HB2 GLU B 118 -13.032 -8.656 -11.625 1.00 44.13 H new ATOM 0 HB3 GLU B 118 -13.015 -9.087 -9.927 1.00 44.13 H new ATOM 0 HG2 GLU B 118 -15.353 -9.868 -10.093 1.00 15.24 H new ATOM 0 HG3 GLU B 118 -15.389 -9.419 -11.787 1.00 15.24 H new ATOM 39 N GLN B 119 -14.060 -5.696 -12.132 1.00 61.40 N ATOM 40 CA GLN B 119 -14.492 -4.819 -13.209 1.00 31.52 C ATOM 41 C GLN B 119 -13.286 -3.872 -13.388 1.00 32.23 C ATOM 42 O GLN B 119 -12.371 -3.950 -12.567 1.00 54.13 O ATOM 43 CB GLN B 119 -15.756 -4.062 -12.693 1.00 41.20 C ATOM 44 CG GLN B 119 -16.747 -3.542 -13.727 1.00 1.52 C ATOM 45 CD GLN B 119 -16.304 -2.306 -14.438 1.00 61.52 C ATOM 46 OE1 GLN B 119 -15.694 -2.377 -15.487 1.00 24.42 O ATOM 47 NE2 GLN B 119 -16.570 -1.161 -13.856 1.00 12.13 N ATOM 0 H GLN B 119 -13.106 -5.505 -11.827 1.00 61.40 H new ATOM 0 HA GLN B 119 -14.756 -5.306 -14.148 1.00 31.52 H new ATOM 0 HB2 GLN B 119 -16.294 -4.730 -12.020 1.00 41.20 H new ATOM 0 HB3 GLN B 119 -15.418 -3.214 -12.098 1.00 41.20 H new ATOM 0 HG2 GLN B 119 -16.929 -4.325 -14.463 1.00 1.52 H new ATOM 0 HG3 GLN B 119 -17.698 -3.341 -13.233 1.00 1.52 H new ATOM 0 HE21 GLN B 119 -17.085 -1.144 -12.976 1.00 12.13 H new ATOM 0 HE22 GLN B 119 -16.262 -0.288 -14.284 1.00 12.13 H new ATOM 56 N ILE B 120 -13.238 -3.019 -14.412 1.00 13.15 N ATOM 57 CA ILE B 120 -12.105 -2.067 -14.538 1.00 72.34 C ATOM 58 C ILE B 120 -12.107 -1.051 -13.386 1.00 63.42 C ATOM 59 O ILE B 120 -11.083 -0.460 -13.024 1.00 15.52 O ATOM 60 CB ILE B 120 -11.973 -1.405 -15.961 1.00 14.33 C ATOM 61 CG1 ILE B 120 -13.279 -0.753 -16.483 1.00 2.13 C ATOM 62 CG2 ILE B 120 -11.475 -2.428 -16.964 1.00 74.13 C ATOM 63 CD1 ILE B 120 -13.713 0.520 -15.786 1.00 15.40 C ATOM 0 H ILE B 120 -13.939 -2.957 -15.150 1.00 13.15 H new ATOM 0 HA ILE B 120 -11.193 -2.658 -14.446 1.00 72.34 H new ATOM 0 HB ILE B 120 -11.254 -0.594 -15.847 1.00 14.33 H new ATOM 0 HG12 ILE B 120 -13.155 -0.538 -17.544 1.00 2.13 H new ATOM 0 HG13 ILE B 120 -14.084 -1.482 -16.398 1.00 2.13 H new ATOM 0 HG21 ILE B 120 -11.387 -1.962 -17.945 1.00 74.13 H new ATOM 0 HG22 ILE B 120 -10.500 -2.801 -16.650 1.00 74.13 H new ATOM 0 HG23 ILE B 120 -12.180 -3.257 -17.018 1.00 74.13 H new ATOM 0 HD11 ILE B 120 -14.637 0.884 -16.235 1.00 15.40 H new ATOM 0 HD12 ILE B 120 -13.879 0.317 -14.728 1.00 15.40 H new ATOM 0 HD13 ILE B 120 -12.935 1.276 -15.892 1.00 15.40 H new ATOM 75 N GLN B 121 -13.282 -0.866 -12.839 1.00 31.15 N ATOM 76 CA GLN B 121 -13.489 -0.169 -11.610 1.00 74.41 C ATOM 77 C GLN B 121 -14.177 -1.162 -10.715 1.00 73.22 C ATOM 78 O GLN B 121 -15.402 -1.181 -10.600 1.00 63.31 O ATOM 79 CB GLN B 121 -14.340 1.099 -11.787 1.00 50.23 C ATOM 80 CG GLN B 121 -13.644 2.226 -12.534 1.00 22.34 C ATOM 81 CD GLN B 121 -14.561 3.404 -12.793 1.00 14.12 C ATOM 82 OE1 GLN B 121 -14.613 4.335 -11.874 1.00 73.01 O flip ATOM 83 NE2 GLN B 121 -15.231 3.466 -13.825 1.00 74.34 N flip ATOM 0 H GLN B 121 -14.146 -1.211 -13.257 1.00 31.15 H new ATOM 0 HA GLN B 121 -12.545 0.184 -11.195 1.00 74.41 H new ATOM 0 HB2 GLN B 121 -15.254 0.837 -12.320 1.00 50.23 H new ATOM 0 HB3 GLN B 121 -14.638 1.462 -10.803 1.00 50.23 H new ATOM 0 HG2 GLN B 121 -12.781 2.561 -11.958 1.00 22.34 H new ATOM 0 HG3 GLN B 121 -13.266 1.849 -13.484 1.00 22.34 H new ATOM 0 HE21 GLN B 121 -15.166 2.723 -14.521 1.00 74.34 H new ATOM 0 HE22 GLN B 121 -15.850 4.261 -13.984 1.00 74.34 H new ATOM 92 N ALA B 122 -13.390 -2.089 -10.219 1.00 41.21 N ATOM 93 CA ALA B 122 -13.893 -3.175 -9.421 1.00 24.13 C ATOM 94 C ALA B 122 -14.292 -2.688 -8.067 1.00 2.40 C ATOM 95 O ALA B 122 -15.454 -2.770 -7.676 1.00 73.44 O ATOM 96 CB ALA B 122 -12.833 -4.255 -9.287 1.00 72.12 C ATOM 0 H ALA B 122 -12.380 -2.108 -10.360 1.00 41.21 H new ATOM 0 HA ALA B 122 -14.770 -3.591 -9.916 1.00 24.13 H new ATOM 0 HB1 ALA B 122 -13.222 -5.073 -8.681 1.00 72.12 H new ATOM 0 HB2 ALA B 122 -12.568 -4.629 -10.276 1.00 72.12 H new ATOM 0 HB3 ALA B 122 -11.947 -3.838 -8.808 1.00 72.12 H new ATOM 102 N VAL B 123 -13.329 -2.171 -7.381 1.00 32.32 N ATOM 103 CA VAL B 123 -13.477 -1.698 -6.052 1.00 1.33 C ATOM 104 C VAL B 123 -12.286 -0.788 -5.748 1.00 40.25 C ATOM 105 O VAL B 123 -11.204 -1.233 -5.369 1.00 2.34 O ATOM 106 CB VAL B 123 -13.640 -2.908 -5.043 1.00 22.10 C ATOM 107 CG1 VAL B 123 -12.525 -3.951 -5.187 1.00 31.50 C ATOM 108 CG2 VAL B 123 -13.738 -2.436 -3.619 1.00 61.11 C ATOM 0 H VAL B 123 -12.383 -2.064 -7.747 1.00 32.32 H new ATOM 0 HA VAL B 123 -14.388 -1.111 -5.934 1.00 1.33 H new ATOM 0 HB VAL B 123 -14.578 -3.396 -5.308 1.00 22.10 H new ATOM 0 HG11 VAL B 123 -12.687 -4.757 -4.472 1.00 31.50 H new ATOM 0 HG12 VAL B 123 -12.534 -4.356 -6.199 1.00 31.50 H new ATOM 0 HG13 VAL B 123 -11.561 -3.482 -4.993 1.00 31.50 H new ATOM 0 HG21 VAL B 123 -13.849 -3.295 -2.958 1.00 61.11 H new ATOM 0 HG22 VAL B 123 -12.833 -1.889 -3.354 1.00 61.11 H new ATOM 0 HG23 VAL B 123 -14.603 -1.781 -3.511 1.00 61.11 H new ATOM 118 N ILE B 124 -12.465 0.484 -6.011 1.00 62.51 N ATOM 119 CA ILE B 124 -11.375 1.428 -5.919 1.00 71.11 C ATOM 120 C ILE B 124 -11.662 2.548 -4.937 1.00 0.30 C ATOM 121 O ILE B 124 -12.815 2.743 -4.506 1.00 33.21 O ATOM 122 CB ILE B 124 -11.015 2.038 -7.308 1.00 52.55 C ATOM 123 CG1 ILE B 124 -12.240 2.739 -7.933 1.00 73.02 C ATOM 124 CG2 ILE B 124 -10.464 0.959 -8.246 1.00 35.02 C ATOM 125 CD1 ILE B 124 -11.957 3.428 -9.252 1.00 64.21 C ATOM 0 H ILE B 124 -13.357 0.891 -6.291 1.00 62.51 H new ATOM 0 HA ILE B 124 -10.522 0.858 -5.551 1.00 71.11 H new ATOM 0 HB ILE B 124 -10.238 2.788 -7.160 1.00 52.55 H new ATOM 0 HG12 ILE B 124 -13.029 2.002 -8.083 1.00 73.02 H new ATOM 0 HG13 ILE B 124 -12.623 3.475 -7.226 1.00 73.02 H new ATOM 0 HG21 ILE B 124 -10.219 1.405 -9.210 1.00 35.02 H new ATOM 0 HG22 ILE B 124 -9.566 0.522 -7.810 1.00 35.02 H new ATOM 0 HG23 ILE B 124 -11.215 0.181 -8.387 1.00 35.02 H new ATOM 0 HD11 ILE B 124 -12.870 3.895 -9.622 1.00 64.21 H new ATOM 0 HD12 ILE B 124 -11.192 4.191 -9.107 1.00 64.21 H new ATOM 0 HD13 ILE B 124 -11.605 2.695 -9.977 1.00 64.21 H new ATOM 137 N ASP B 125 -10.601 3.259 -4.594 1.00 72.44 N ATOM 138 CA ASP B 125 -10.596 4.410 -3.687 1.00 72.14 C ATOM 139 C ASP B 125 -10.912 4.004 -2.252 1.00 42.52 C ATOM 140 O ASP B 125 -10.009 3.703 -1.480 1.00 35.22 O ATOM 141 CB ASP B 125 -11.512 5.552 -4.185 1.00 54.42 C ATOM 142 CG ASP B 125 -11.402 6.835 -3.374 1.00 62.03 C ATOM 143 OD1 ASP B 125 -10.501 7.660 -3.654 1.00 52.23 O1- ATOM 144 OD2 ASP B 125 -12.247 7.074 -2.482 1.00 71.31 O ATOM 0 H ASP B 125 -9.671 3.044 -4.954 1.00 72.44 H new ATOM 0 HA ASP B 125 -9.581 4.806 -3.687 1.00 72.14 H new ATOM 0 HB2 ASP B 125 -11.270 5.770 -5.225 1.00 54.42 H new ATOM 0 HB3 ASP B 125 -12.546 5.209 -4.164 1.00 54.42 H new ATOM 149 N ALA B 126 -12.180 3.910 -1.929 1.00 42.32 N ATOM 150 CA ALA B 126 -12.614 3.584 -0.593 1.00 24.12 C ATOM 151 C ALA B 126 -14.045 3.099 -0.640 1.00 75.33 C ATOM 152 O ALA B 126 -14.649 3.050 -1.719 1.00 30.15 O ATOM 153 CB ALA B 126 -12.506 4.806 0.318 1.00 5.20 C ATOM 0 H ALA B 126 -12.943 4.058 -2.590 1.00 42.32 H new ATOM 0 HA ALA B 126 -11.974 2.799 -0.191 1.00 24.12 H new ATOM 0 HB1 ALA B 126 -12.838 4.542 1.322 1.00 5.20 H new ATOM 0 HB2 ALA B 126 -11.470 5.142 0.355 1.00 5.20 H new ATOM 0 HB3 ALA B 126 -13.134 5.607 -0.072 1.00 5.20 H new ATOM 159 N GLY B 127 -14.575 2.727 0.497 1.00 40.01 N ATOM 160 CA GLY B 127 -15.949 2.291 0.584 1.00 12.24 C ATOM 161 C GLY B 127 -16.053 0.815 0.844 1.00 34.14 C ATOM 162 O GLY B 127 -17.097 0.313 1.274 1.00 44.31 O ATOM 0 H GLY B 127 -14.072 2.717 1.384 1.00 40.01 H new ATOM 0 HA2 GLY B 127 -16.453 2.837 1.382 1.00 12.24 H new ATOM 0 HA3 GLY B 127 -16.466 2.533 -0.344 1.00 12.24 H new ATOM 166 N ALA B 128 -14.974 0.123 0.616 1.00 63.14 N ATOM 167 CA ALA B 128 -14.923 -1.302 0.778 1.00 40.55 C ATOM 168 C ALA B 128 -13.540 -1.689 1.223 1.00 61.14 C ATOM 169 O ALA B 128 -12.595 -0.904 1.051 1.00 12.21 O ATOM 170 CB ALA B 128 -15.279 -1.990 -0.523 1.00 63.33 C ATOM 0 H ALA B 128 -14.094 0.537 0.309 1.00 63.14 H new ATOM 0 HA ALA B 128 -15.646 -1.615 1.531 1.00 40.55 H new ATOM 0 HB1 ALA B 128 -15.237 -3.071 -0.387 1.00 63.33 H new ATOM 0 HB2 ALA B 128 -16.286 -1.701 -0.823 1.00 63.33 H new ATOM 0 HB3 ALA B 128 -14.571 -1.694 -1.297 1.00 63.33 H new ATOM 176 N LEU B 129 -13.406 -2.875 1.764 1.00 55.53 N ATOM 177 CA LEU B 129 -12.132 -3.339 2.300 1.00 45.21 C ATOM 178 C LEU B 129 -11.011 -3.477 1.226 1.00 33.52 C ATOM 179 O LEU B 129 -9.931 -2.955 1.427 1.00 22.43 O ATOM 180 CB LEU B 129 -12.297 -4.620 3.143 1.00 71.14 C ATOM 181 CG LEU B 129 -13.308 -4.545 4.304 1.00 72.10 C ATOM 182 CD1 LEU B 129 -13.306 -5.838 5.092 1.00 71.02 C ATOM 183 CD2 LEU B 129 -13.030 -3.358 5.225 1.00 45.41 C ATOM 0 H LEU B 129 -14.167 -3.549 1.849 1.00 55.53 H new ATOM 0 HA LEU B 129 -11.789 -2.550 2.970 1.00 45.21 H new ATOM 0 HB2 LEU B 129 -12.597 -5.431 2.479 1.00 71.14 H new ATOM 0 HB3 LEU B 129 -11.323 -4.888 3.553 1.00 71.14 H new ATOM 0 HG LEU B 129 -14.296 -4.397 3.868 1.00 72.10 H new ATOM 0 HD11 LEU B 129 -14.025 -5.768 5.908 1.00 71.02 H new ATOM 0 HD12 LEU B 129 -13.580 -6.664 4.436 1.00 71.02 H new ATOM 0 HD13 LEU B 129 -12.311 -6.014 5.500 1.00 71.02 H new ATOM 0 HD21 LEU B 129 -13.765 -3.342 6.030 1.00 45.41 H new ATOM 0 HD22 LEU B 129 -12.030 -3.453 5.649 1.00 45.41 H new ATOM 0 HD23 LEU B 129 -13.096 -2.432 4.655 1.00 45.41 H new ATOM 195 N PRO B 130 -11.225 -4.173 0.071 1.00 0.32 N ATOM 196 CA PRO B 130 -10.193 -4.269 -0.972 1.00 63.11 C ATOM 197 C PRO B 130 -9.820 -2.918 -1.573 1.00 21.50 C ATOM 198 O PRO B 130 -8.700 -2.732 -1.975 1.00 1.14 O ATOM 199 CB PRO B 130 -10.847 -5.112 -2.062 1.00 74.52 C ATOM 200 CG PRO B 130 -11.908 -5.870 -1.368 1.00 3.43 C ATOM 201 CD PRO B 130 -12.419 -4.949 -0.306 1.00 14.32 C ATOM 0 HA PRO B 130 -9.274 -4.683 -0.558 1.00 63.11 H new ATOM 0 HB2 PRO B 130 -11.261 -4.485 -2.852 1.00 74.52 H new ATOM 0 HB3 PRO B 130 -10.125 -5.781 -2.531 1.00 74.52 H new ATOM 0 HG2 PRO B 130 -12.703 -6.155 -2.057 1.00 3.43 H new ATOM 0 HG3 PRO B 130 -11.516 -6.790 -0.935 1.00 3.43 H new ATOM 0 HD2 PRO B 130 -13.215 -4.306 -0.680 1.00 14.32 H new ATOM 0 HD3 PRO B 130 -12.826 -5.499 0.542 1.00 14.32 H new ATOM 209 N ALA B 131 -10.754 -1.976 -1.589 1.00 12.31 N ATOM 210 CA ALA B 131 -10.548 -0.676 -2.260 1.00 41.31 C ATOM 211 C ALA B 131 -9.330 0.048 -1.748 1.00 3.12 C ATOM 212 O ALA B 131 -8.544 0.591 -2.529 1.00 52.45 O ATOM 213 CB ALA B 131 -11.767 0.213 -2.126 1.00 12.14 C ATOM 0 H ALA B 131 -11.668 -2.078 -1.147 1.00 12.31 H new ATOM 0 HA ALA B 131 -10.386 -0.900 -3.314 1.00 41.31 H new ATOM 0 HB1 ALA B 131 -11.583 1.162 -2.630 1.00 12.14 H new ATOM 0 HB2 ALA B 131 -12.627 -0.278 -2.580 1.00 12.14 H new ATOM 0 HB3 ALA B 131 -11.969 0.396 -1.071 1.00 12.14 H new ATOM 219 N LEU B 132 -9.156 0.003 -0.462 1.00 31.23 N ATOM 220 CA LEU B 132 -8.068 0.679 0.189 1.00 71.30 C ATOM 221 C LEU B 132 -6.731 -0.031 -0.088 1.00 32.55 C ATOM 222 O LEU B 132 -5.678 0.588 -0.098 1.00 34.51 O ATOM 223 CB LEU B 132 -8.392 0.795 1.692 1.00 34.00 C ATOM 224 CG LEU B 132 -8.580 -0.528 2.468 1.00 41.21 C ATOM 225 CD1 LEU B 132 -7.268 -1.084 3.028 1.00 25.22 C ATOM 226 CD2 LEU B 132 -9.660 -0.408 3.541 1.00 65.03 C ATOM 0 H LEU B 132 -9.769 -0.508 0.173 1.00 31.23 H new ATOM 0 HA LEU B 132 -7.952 1.686 -0.213 1.00 71.30 H new ATOM 0 HB2 LEU B 132 -7.590 1.358 2.170 1.00 34.00 H new ATOM 0 HB3 LEU B 132 -9.303 1.384 1.799 1.00 34.00 H new ATOM 0 HG LEU B 132 -8.928 -1.262 1.741 1.00 41.21 H new ATOM 0 HD11 LEU B 132 -7.465 -2.013 3.562 1.00 25.22 H new ATOM 0 HD12 LEU B 132 -6.575 -1.276 2.209 1.00 25.22 H new ATOM 0 HD13 LEU B 132 -6.828 -0.359 3.712 1.00 25.22 H new ATOM 0 HD21 LEU B 132 -9.761 -1.359 4.063 1.00 65.03 H new ATOM 0 HD22 LEU B 132 -9.381 0.369 4.253 1.00 65.03 H new ATOM 0 HD23 LEU B 132 -10.610 -0.148 3.074 1.00 65.03 H new ATOM 238 N VAL B 133 -6.782 -1.335 -0.296 1.00 20.30 N ATOM 239 CA VAL B 133 -5.581 -2.086 -0.583 1.00 2.44 C ATOM 240 C VAL B 133 -5.233 -2.047 -2.056 1.00 41.43 C ATOM 241 O VAL B 133 -4.090 -2.118 -2.417 1.00 11.14 O ATOM 242 CB VAL B 133 -5.668 -3.560 -0.109 1.00 33.41 C ATOM 243 CG1 VAL B 133 -6.225 -4.470 -1.133 1.00 1.21 C ATOM 244 CG2 VAL B 133 -4.357 -4.072 0.367 1.00 60.04 C ATOM 0 H VAL B 133 -7.638 -1.889 -0.271 1.00 20.30 H new ATOM 0 HA VAL B 133 -4.788 -1.597 -0.017 1.00 2.44 H new ATOM 0 HB VAL B 133 -6.364 -3.548 0.730 1.00 33.41 H new ATOM 0 HG11 VAL B 133 -6.259 -5.485 -0.738 1.00 1.21 H new ATOM 0 HG12 VAL B 133 -7.233 -4.149 -1.395 1.00 1.21 H new ATOM 0 HG13 VAL B 133 -5.594 -4.447 -2.022 1.00 1.21 H new ATOM 0 HG21 VAL B 133 -4.466 -5.108 0.689 1.00 60.04 H new ATOM 0 HG22 VAL B 133 -3.630 -4.018 -0.443 1.00 60.04 H new ATOM 0 HG23 VAL B 133 -4.012 -3.466 1.205 1.00 60.04 H new ATOM 254 N GLN B 134 -6.246 -1.946 -2.885 1.00 51.03 N ATOM 255 CA GLN B 134 -6.105 -2.087 -4.335 1.00 1.43 C ATOM 256 C GLN B 134 -5.017 -1.239 -4.965 1.00 10.22 C ATOM 257 O GLN B 134 -4.294 -1.694 -5.866 1.00 3.33 O ATOM 258 CB GLN B 134 -7.419 -1.915 -5.087 1.00 62.21 C ATOM 259 CG GLN B 134 -8.322 -3.120 -5.016 1.00 72.32 C ATOM 260 CD GLN B 134 -7.640 -4.370 -5.544 1.00 12.24 C ATOM 261 OE1 GLN B 134 -7.020 -5.119 -4.789 1.00 42.42 O ATOM 262 NE2 GLN B 134 -7.714 -4.586 -6.829 1.00 42.35 N ATOM 0 H GLN B 134 -7.202 -1.763 -2.581 1.00 51.03 H new ATOM 0 HA GLN B 134 -5.780 -3.122 -4.445 1.00 1.43 H new ATOM 0 HB2 GLN B 134 -7.948 -1.052 -4.683 1.00 62.21 H new ATOM 0 HB3 GLN B 134 -7.203 -1.696 -6.133 1.00 62.21 H new ATOM 0 HG2 GLN B 134 -8.630 -3.283 -3.983 1.00 72.32 H new ATOM 0 HG3 GLN B 134 -9.228 -2.930 -5.592 1.00 72.32 H new ATOM 0 HE21 GLN B 134 -8.237 -3.944 -7.425 1.00 42.35 H new ATOM 0 HE22 GLN B 134 -7.249 -5.397 -7.237 1.00 42.35 H new ATOM 271 N LEU B 135 -4.881 -0.048 -4.480 1.00 31.00 N ATOM 272 CA LEU B 135 -3.898 0.878 -4.996 1.00 53.40 C ATOM 273 C LEU B 135 -2.472 0.463 -4.648 1.00 44.52 C ATOM 274 O LEU B 135 -1.557 0.852 -5.324 1.00 61.22 O ATOM 275 CB LEU B 135 -4.155 2.328 -4.551 1.00 12.34 C ATOM 276 CG LEU B 135 -4.324 2.576 -3.046 1.00 11.04 C ATOM 277 CD1 LEU B 135 -3.900 3.992 -2.719 1.00 24.03 C ATOM 278 CD2 LEU B 135 -5.784 2.389 -2.635 1.00 52.53 C ATOM 0 H LEU B 135 -5.444 0.321 -3.714 1.00 31.00 H new ATOM 0 HA LEU B 135 -4.007 0.841 -6.080 1.00 53.40 H new ATOM 0 HB2 LEU B 135 -3.327 2.942 -4.905 1.00 12.34 H new ATOM 0 HB3 LEU B 135 -5.054 2.683 -5.056 1.00 12.34 H new ATOM 0 HG LEU B 135 -3.705 1.862 -2.503 1.00 11.04 H new ATOM 0 HD11 LEU B 135 -4.019 4.170 -1.650 1.00 24.03 H new ATOM 0 HD12 LEU B 135 -2.855 4.132 -2.996 1.00 24.03 H new ATOM 0 HD13 LEU B 135 -4.520 4.695 -3.275 1.00 24.03 H new ATOM 0 HD21 LEU B 135 -5.887 2.568 -1.565 1.00 52.53 H new ATOM 0 HD22 LEU B 135 -6.409 3.094 -3.183 1.00 52.53 H new ATOM 0 HD23 LEU B 135 -6.099 1.371 -2.864 1.00 52.53 H new ATOM 290 N LEU B 136 -2.315 -0.398 -3.641 1.00 21.22 N ATOM 291 CA LEU B 136 -1.026 -0.857 -3.153 1.00 44.41 C ATOM 292 C LEU B 136 -0.331 -1.773 -4.154 1.00 40.11 C ATOM 293 O LEU B 136 0.845 -2.064 -4.037 1.00 61.31 O ATOM 294 CB LEU B 136 -1.257 -1.577 -1.833 1.00 1.14 C ATOM 295 CG LEU B 136 -1.136 -0.770 -0.520 1.00 52.41 C ATOM 296 CD1 LEU B 136 0.250 -0.157 -0.374 1.00 41.23 C ATOM 297 CD2 LEU B 136 -2.209 0.311 -0.426 1.00 34.05 C ATOM 0 H LEU B 136 -3.103 -0.801 -3.134 1.00 21.22 H new ATOM 0 HA LEU B 136 -0.367 -0.000 -3.012 1.00 44.41 H new ATOM 0 HB2 LEU B 136 -2.256 -2.012 -1.863 1.00 1.14 H new ATOM 0 HB3 LEU B 136 -0.550 -2.405 -1.779 1.00 1.14 H new ATOM 0 HG LEU B 136 -1.289 -1.470 0.302 1.00 52.41 H new ATOM 0 HD11 LEU B 136 0.303 0.404 0.559 1.00 41.23 H new ATOM 0 HD12 LEU B 136 0.999 -0.949 -0.365 1.00 41.23 H new ATOM 0 HD13 LEU B 136 0.441 0.513 -1.212 1.00 41.23 H new ATOM 0 HD21 LEU B 136 -2.093 0.858 0.510 1.00 34.05 H new ATOM 0 HD22 LEU B 136 -2.106 1.000 -1.264 1.00 34.05 H new ATOM 0 HD23 LEU B 136 -3.195 -0.152 -0.456 1.00 34.05 H new ATOM 309 N SER B 137 -1.071 -2.201 -5.133 1.00 11.45 N ATOM 310 CA SER B 137 -0.562 -3.045 -6.174 1.00 2.00 C ATOM 311 C SER B 137 -0.421 -2.223 -7.466 1.00 23.45 C ATOM 312 O SER B 137 -0.435 -2.777 -8.565 1.00 1.12 O ATOM 313 CB SER B 137 -1.485 -4.284 -6.358 1.00 70.13 C ATOM 314 OG SER B 137 -1.113 -5.114 -7.450 1.00 44.15 O ATOM 0 H SER B 137 -2.060 -1.971 -5.233 1.00 11.45 H new ATOM 0 HA SER B 137 0.425 -3.422 -5.906 1.00 2.00 H new ATOM 0 HB2 SER B 137 -1.472 -4.875 -5.442 1.00 70.13 H new ATOM 0 HB3 SER B 137 -2.510 -3.944 -6.504 1.00 70.13 H new ATOM 0 HG SER B 137 -0.763 -4.559 -8.178 1.00 44.15 H new ATOM 320 N SER B 138 -0.276 -0.899 -7.307 1.00 30.13 N ATOM 321 CA SER B 138 -0.253 0.056 -8.394 1.00 70.24 C ATOM 322 C SER B 138 0.642 -0.343 -9.602 1.00 64.22 C ATOM 323 O SER B 138 1.700 -0.984 -9.442 1.00 31.04 O ATOM 324 CB SER B 138 0.236 1.366 -7.827 1.00 65.30 C ATOM 325 OG SER B 138 1.493 1.189 -7.210 1.00 2.10 O ATOM 0 H SER B 138 -0.170 -0.465 -6.390 1.00 30.13 H new ATOM 0 HA SER B 138 -1.265 0.111 -8.795 1.00 70.24 H new ATOM 0 HB2 SER B 138 0.314 2.108 -8.621 1.00 65.30 H new ATOM 0 HB3 SER B 138 -0.483 1.748 -7.102 1.00 65.30 H new ATOM 0 HG SER B 138 2.185 1.632 -7.744 1.00 2.10 H new ATOM 331 N PRO B 139 0.236 0.105 -10.810 1.00 3.54 N ATOM 332 CA PRO B 139 0.983 -0.111 -12.080 1.00 24.41 C ATOM 333 C PRO B 139 2.177 0.839 -12.109 1.00 3.55 C ATOM 334 O PRO B 139 3.207 0.608 -12.749 1.00 33.11 O ATOM 335 CB PRO B 139 -0.009 0.460 -13.128 1.00 51.14 C ATOM 336 CG PRO B 139 -0.696 1.508 -12.333 1.00 12.24 C ATOM 337 CD PRO B 139 -1.005 0.854 -11.058 1.00 64.24 C ATOM 0 HA PRO B 139 1.308 -1.141 -12.224 1.00 24.41 H new ATOM 0 HB2 PRO B 139 0.503 0.872 -13.997 1.00 51.14 H new ATOM 0 HB3 PRO B 139 -0.701 -0.298 -13.495 1.00 51.14 H new ATOM 0 HG2 PRO B 139 -0.057 2.379 -12.188 1.00 12.24 H new ATOM 0 HG3 PRO B 139 -1.601 1.855 -12.831 1.00 12.24 H new ATOM 0 HD2 PRO B 139 -1.216 1.574 -10.267 1.00 64.24 H new ATOM 0 HD3 PRO B 139 -1.873 0.199 -11.132 1.00 64.24 H new ATOM 345 N ASN B 140 1.993 1.902 -11.369 1.00 23.02 N ATOM 346 CA ASN B 140 2.786 3.036 -11.398 1.00 20.23 C ATOM 347 C ASN B 140 3.076 3.416 -9.976 1.00 43.12 C ATOM 348 O ASN B 140 2.133 3.644 -9.201 1.00 34.53 O ATOM 349 CB ASN B 140 1.974 4.221 -12.004 1.00 62.14 C ATOM 350 CG ASN B 140 2.857 5.376 -12.399 1.00 24.03 C ATOM 351 OD1 ASN B 140 3.930 5.540 -11.856 1.00 54.34 O ATOM 352 ND2 ASN B 140 2.416 6.189 -13.324 1.00 42.30 N ATOM 0 H ASN B 140 1.228 1.971 -10.698 1.00 23.02 H new ATOM 0 HA ASN B 140 3.688 2.842 -11.979 1.00 20.23 H new ATOM 0 HB2 ASN B 140 1.423 3.872 -12.878 1.00 62.14 H new ATOM 0 HB3 ASN B 140 1.236 4.562 -11.278 1.00 62.14 H new ATOM 0 HD21 ASN B 140 2.979 6.990 -13.609 1.00 42.30 H new ATOM 0 HD22 ASN B 140 1.509 6.022 -13.760 1.00 42.30 H new ATOM 359 N GLU B 141 4.333 3.511 -9.636 1.00 73.15 N ATOM 360 CA GLU B 141 4.753 3.977 -8.322 1.00 45.35 C ATOM 361 C GLU B 141 4.207 5.399 -8.052 1.00 73.44 C ATOM 362 O GLU B 141 3.934 5.777 -6.924 1.00 64.43 O ATOM 363 CB GLU B 141 6.277 3.959 -8.238 1.00 72.42 C ATOM 364 CG GLU B 141 6.882 2.563 -8.265 1.00 31.50 C ATOM 365 CD GLU B 141 8.391 2.573 -8.237 1.00 2.21 C ATOM 366 OE1 GLU B 141 8.981 2.735 -7.167 1.00 2.24 O1- ATOM 367 OE2 GLU B 141 9.024 2.402 -9.295 1.00 72.31 O ATOM 0 H GLU B 141 5.105 3.269 -10.257 1.00 73.15 H new ATOM 0 HA GLU B 141 4.348 3.311 -7.560 1.00 45.35 H new ATOM 0 HB2 GLU B 141 6.683 4.536 -9.069 1.00 72.42 H new ATOM 0 HB3 GLU B 141 6.586 4.460 -7.321 1.00 72.42 H new ATOM 0 HG2 GLU B 141 6.512 1.996 -7.411 1.00 31.50 H new ATOM 0 HG3 GLU B 141 6.544 2.044 -9.162 1.00 31.50 H new ATOM 374 N GLN B 142 4.018 6.150 -9.112 1.00 51.13 N ATOM 375 CA GLN B 142 3.477 7.508 -9.054 1.00 31.54 C ATOM 376 C GLN B 142 2.016 7.500 -8.643 1.00 51.24 C ATOM 377 O GLN B 142 1.621 8.186 -7.702 1.00 5.41 O ATOM 378 CB GLN B 142 3.555 8.137 -10.435 1.00 3.13 C ATOM 379 CG GLN B 142 4.965 8.424 -10.953 1.00 43.42 C ATOM 380 CD GLN B 142 5.734 9.401 -10.097 1.00 72.43 C ATOM 381 OE1 GLN B 142 5.645 10.612 -10.289 1.00 44.11 O ATOM 382 NE2 GLN B 142 6.560 8.901 -9.222 1.00 63.34 N ATOM 0 H GLN B 142 4.236 5.839 -10.059 1.00 51.13 H new ATOM 0 HA GLN B 142 4.061 8.068 -8.323 1.00 31.54 H new ATOM 0 HB2 GLN B 142 3.055 7.477 -11.144 1.00 3.13 H new ATOM 0 HB3 GLN B 142 2.995 9.072 -10.420 1.00 3.13 H new ATOM 0 HG2 GLN B 142 5.520 7.488 -11.010 1.00 43.42 H new ATOM 0 HG3 GLN B 142 4.898 8.817 -11.968 1.00 43.42 H new ATOM 0 HE21 GLN B 142 6.610 7.891 -9.087 1.00 63.34 H new ATOM 0 HE22 GLN B 142 7.157 9.519 -8.673 1.00 63.34 H new ATOM 391 N ILE B 143 1.218 6.699 -9.346 1.00 34.31 N ATOM 392 CA ILE B 143 -0.220 6.692 -9.146 1.00 21.53 C ATOM 393 C ILE B 143 -0.564 6.179 -7.760 1.00 1.45 C ATOM 394 O ILE B 143 -1.605 6.532 -7.195 1.00 53.35 O ATOM 395 CB ILE B 143 -0.964 5.922 -10.278 1.00 14.02 C ATOM 396 CG1 ILE B 143 -0.849 4.415 -10.169 1.00 73.10 C ATOM 397 CG2 ILE B 143 -0.561 6.428 -11.619 1.00 44.30 C ATOM 398 CD1 ILE B 143 -2.001 3.809 -9.392 1.00 51.44 C ATOM 0 H ILE B 143 1.548 6.048 -10.058 1.00 34.31 H new ATOM 0 HA ILE B 143 -0.576 7.720 -9.207 1.00 21.53 H new ATOM 0 HB ILE B 143 -2.026 6.129 -10.146 1.00 14.02 H new ATOM 0 HG12 ILE B 143 -0.819 3.981 -11.168 1.00 73.10 H new ATOM 0 HG13 ILE B 143 0.091 4.158 -9.681 1.00 73.10 H new ATOM 0 HG21 ILE B 143 -1.094 5.875 -12.392 1.00 44.30 H new ATOM 0 HG22 ILE B 143 -0.806 7.487 -11.697 1.00 44.30 H new ATOM 0 HG23 ILE B 143 0.513 6.293 -11.751 1.00 44.30 H new ATOM 0 HD11 ILE B 143 -1.876 2.727 -9.340 1.00 51.44 H new ATOM 0 HD12 ILE B 143 -2.016 4.222 -8.383 1.00 51.44 H new ATOM 0 HD13 ILE B 143 -2.940 4.042 -9.893 1.00 51.44 H new ATOM 410 N LEU B 144 0.329 5.344 -7.235 1.00 55.31 N ATOM 411 CA LEU B 144 0.249 4.848 -5.882 1.00 51.23 C ATOM 412 C LEU B 144 0.278 6.047 -4.938 1.00 35.13 C ATOM 413 O LEU B 144 -0.682 6.311 -4.227 1.00 44.33 O ATOM 414 CB LEU B 144 1.478 3.976 -5.593 1.00 3.21 C ATOM 415 CG LEU B 144 1.552 3.342 -4.204 1.00 52.24 C ATOM 416 CD1 LEU B 144 0.965 1.966 -4.158 1.00 13.41 C ATOM 417 CD2 LEU B 144 2.946 3.379 -3.647 1.00 24.12 C ATOM 0 H LEU B 144 1.136 4.994 -7.752 1.00 55.31 H new ATOM 0 HA LEU B 144 -0.662 4.265 -5.746 1.00 51.23 H new ATOM 0 HB2 LEU B 144 1.512 3.178 -6.335 1.00 3.21 H new ATOM 0 HB3 LEU B 144 2.370 4.585 -5.738 1.00 3.21 H new ATOM 0 HG LEU B 144 0.928 3.956 -3.555 1.00 52.24 H new ATOM 0 HD11 LEU B 144 1.047 1.569 -3.146 1.00 13.41 H new ATOM 0 HD12 LEU B 144 -0.085 2.009 -4.447 1.00 13.41 H new ATOM 0 HD13 LEU B 144 1.505 1.317 -4.847 1.00 13.41 H new ATOM 0 HD21 LEU B 144 2.955 2.919 -2.659 1.00 24.12 H new ATOM 0 HD22 LEU B 144 3.617 2.831 -4.309 1.00 24.12 H new ATOM 0 HD23 LEU B 144 3.279 4.414 -3.568 1.00 24.12 H new ATOM 429 N GLN B 145 1.381 6.793 -5.020 1.00 62.02 N ATOM 430 CA GLN B 145 1.668 7.964 -4.198 1.00 14.14 C ATOM 431 C GLN B 145 0.548 8.976 -4.186 1.00 53.32 C ATOM 432 O GLN B 145 0.009 9.285 -3.116 1.00 13.44 O ATOM 433 CB GLN B 145 2.946 8.612 -4.683 1.00 31.14 C ATOM 434 CG GLN B 145 4.139 7.729 -4.495 1.00 35.44 C ATOM 435 CD GLN B 145 5.430 8.325 -5.005 1.00 5.04 C ATOM 436 OE1 GLN B 145 6.134 9.017 -4.285 1.00 4.41 O ATOM 437 NE2 GLN B 145 5.768 8.032 -6.225 1.00 60.40 N ATOM 0 H GLN B 145 2.125 6.588 -5.687 1.00 62.02 H new ATOM 0 HA GLN B 145 1.778 7.617 -3.171 1.00 14.14 H new ATOM 0 HB2 GLN B 145 2.845 8.862 -5.739 1.00 31.14 H new ATOM 0 HB3 GLN B 145 3.102 9.548 -4.147 1.00 31.14 H new ATOM 0 HG2 GLN B 145 4.249 7.504 -3.434 1.00 35.44 H new ATOM 0 HG3 GLN B 145 3.961 6.782 -5.005 1.00 35.44 H new ATOM 0 HE21 GLN B 145 5.156 7.451 -6.798 1.00 60.40 H new ATOM 0 HE22 GLN B 145 6.645 8.383 -6.609 1.00 60.40 H new ATOM 446 N GLU B 146 0.183 9.470 -5.365 1.00 55.14 N ATOM 447 CA GLU B 146 -0.854 10.477 -5.496 1.00 32.43 C ATOM 448 C GLU B 146 -2.179 10.034 -4.866 1.00 61.02 C ATOM 449 O GLU B 146 -2.850 10.828 -4.196 1.00 62.21 O ATOM 450 CB GLU B 146 -1.071 10.870 -6.954 1.00 61.15 C ATOM 451 CG GLU B 146 -1.339 9.699 -7.860 1.00 73.43 C ATOM 452 CD GLU B 146 -2.025 10.069 -9.139 1.00 74.32 C ATOM 453 OE1 GLU B 146 -1.355 10.379 -10.131 1.00 22.34 O1- ATOM 454 OE2 GLU B 146 -3.267 10.026 -9.176 1.00 3.34 O ATOM 0 H GLU B 146 0.598 9.182 -6.251 1.00 55.14 H new ATOM 0 HA GLU B 146 -0.502 11.351 -4.948 1.00 32.43 H new ATOM 0 HB2 GLU B 146 -1.909 11.564 -7.014 1.00 61.15 H new ATOM 0 HB3 GLU B 146 -0.190 11.402 -7.313 1.00 61.15 H new ATOM 0 HG2 GLU B 146 -0.394 9.209 -8.094 1.00 73.43 H new ATOM 0 HG3 GLU B 146 -1.952 8.972 -7.327 1.00 73.43 H new ATOM 461 N ALA B 147 -2.559 8.775 -5.070 1.00 15.44 N ATOM 462 CA ALA B 147 -3.792 8.279 -4.478 1.00 72.45 C ATOM 463 C ALA B 147 -3.633 8.093 -2.980 1.00 11.52 C ATOM 464 O ALA B 147 -4.536 8.414 -2.201 1.00 71.22 O ATOM 465 CB ALA B 147 -4.242 6.990 -5.127 1.00 4.23 C ATOM 0 H ALA B 147 -2.042 8.095 -5.628 1.00 15.44 H new ATOM 0 HA ALA B 147 -4.564 9.027 -4.656 1.00 72.45 H new ATOM 0 HB1 ALA B 147 -5.166 6.650 -4.659 1.00 4.23 H new ATOM 0 HB2 ALA B 147 -4.415 7.159 -6.190 1.00 4.23 H new ATOM 0 HB3 ALA B 147 -3.470 6.230 -5.001 1.00 4.23 H new ATOM 471 N LEU B 148 -2.468 7.611 -2.581 1.00 50.13 N ATOM 472 CA LEU B 148 -2.141 7.367 -1.187 1.00 10.21 C ATOM 473 C LEU B 148 -2.206 8.614 -0.354 1.00 72.25 C ATOM 474 O LEU B 148 -2.451 8.533 0.801 1.00 11.01 O ATOM 475 CB LEU B 148 -0.767 6.763 -1.038 1.00 24.22 C ATOM 476 CG LEU B 148 -0.623 5.267 -1.258 1.00 12.12 C ATOM 477 CD1 LEU B 148 0.838 4.904 -1.234 1.00 75.04 C ATOM 478 CD2 LEU B 148 -1.364 4.489 -0.176 1.00 53.12 C ATOM 0 H LEU B 148 -1.713 7.375 -3.225 1.00 50.13 H new ATOM 0 HA LEU B 148 -2.894 6.666 -0.828 1.00 10.21 H new ATOM 0 HB2 LEU B 148 -0.101 7.270 -1.736 1.00 24.22 H new ATOM 0 HB3 LEU B 148 -0.409 6.990 -0.034 1.00 24.22 H new ATOM 0 HG LEU B 148 -1.056 5.008 -2.224 1.00 12.12 H new ATOM 0 HD11 LEU B 148 0.949 3.831 -1.391 1.00 75.04 H new ATOM 0 HD12 LEU B 148 1.360 5.443 -2.025 1.00 75.04 H new ATOM 0 HD13 LEU B 148 1.264 5.175 -0.268 1.00 75.04 H new ATOM 0 HD21 LEU B 148 -1.248 3.420 -0.353 1.00 53.12 H new ATOM 0 HD22 LEU B 148 -0.952 4.742 0.801 1.00 53.12 H new ATOM 0 HD23 LEU B 148 -2.422 4.748 -0.202 1.00 53.12 H new ATOM 490 N TRP B 149 -1.984 9.749 -0.935 1.00 72.11 N ATOM 491 CA TRP B 149 -2.091 11.001 -0.193 1.00 73.33 C ATOM 492 C TRP B 149 -3.422 11.094 0.547 1.00 33.51 C ATOM 493 O TRP B 149 -3.471 11.458 1.730 1.00 12.44 O ATOM 494 CB TRP B 149 -1.926 12.190 -1.103 1.00 5.20 C ATOM 495 CG TRP B 149 -0.533 12.682 -1.284 1.00 21.45 C ATOM 496 CD1 TRP B 149 0.496 12.065 -1.924 1.00 14.14 C ATOM 497 CD2 TRP B 149 -0.036 13.942 -0.844 1.00 64.10 C ATOM 498 NE1 TRP B 149 1.612 12.856 -1.885 1.00 44.31 N ATOM 499 CE2 TRP B 149 1.309 14.021 -1.229 1.00 41.22 C ATOM 500 CE3 TRP B 149 -0.605 15.014 -0.148 1.00 50.34 C ATOM 501 CZ2 TRP B 149 2.096 15.131 -0.948 1.00 11.41 C ATOM 502 CZ3 TRP B 149 0.176 16.113 0.128 1.00 0.00 C ATOM 503 CH2 TRP B 149 1.513 16.162 -0.271 1.00 21.30 C ATOM 0 H TRP B 149 -1.727 9.853 -1.917 1.00 72.11 H new ATOM 0 HA TRP B 149 -1.285 11.010 0.541 1.00 73.33 H new ATOM 0 HB2 TRP B 149 -2.330 11.932 -2.082 1.00 5.20 H new ATOM 0 HB3 TRP B 149 -2.532 13.008 -0.713 1.00 5.20 H new ATOM 0 HD1 TRP B 149 0.441 11.094 -2.394 1.00 14.14 H new ATOM 0 HE1 TRP B 149 2.522 12.617 -2.280 1.00 44.31 H new ATOM 0 HE3 TRP B 149 -1.638 14.980 0.167 1.00 50.34 H new ATOM 0 HZ2 TRP B 149 3.131 15.176 -1.254 1.00 11.41 H new ATOM 0 HZ3 TRP B 149 -0.251 16.950 0.661 1.00 0.00 H new ATOM 0 HH2 TRP B 149 2.100 17.038 -0.038 1.00 21.30 H new ATOM 514 N ALA B 150 -4.479 10.762 -0.137 1.00 4.41 N ATOM 515 CA ALA B 150 -5.770 10.725 0.473 1.00 55.10 C ATOM 516 C ALA B 150 -6.022 9.360 1.126 1.00 74.03 C ATOM 517 O ALA B 150 -6.535 9.264 2.246 1.00 33.30 O ATOM 518 CB ALA B 150 -6.848 11.032 -0.548 1.00 15.21 C ATOM 0 H ALA B 150 -4.468 10.512 -1.126 1.00 4.41 H new ATOM 0 HA ALA B 150 -5.803 11.488 1.251 1.00 55.10 H new ATOM 0 HB1 ALA B 150 -7.825 11.000 -0.066 1.00 15.21 H new ATOM 0 HB2 ALA B 150 -6.682 12.025 -0.965 1.00 15.21 H new ATOM 0 HB3 ALA B 150 -6.813 10.292 -1.348 1.00 15.21 H new ATOM 524 N LEU B 151 -5.620 8.319 0.433 1.00 70.43 N ATOM 525 CA LEU B 151 -5.941 6.949 0.805 1.00 60.43 C ATOM 526 C LEU B 151 -5.062 6.318 1.901 1.00 0.01 C ATOM 527 O LEU B 151 -5.468 5.373 2.525 1.00 1.42 O ATOM 528 CB LEU B 151 -6.031 6.097 -0.451 1.00 30.21 C ATOM 529 CG LEU B 151 -7.147 6.535 -1.425 1.00 35.52 C ATOM 530 CD1 LEU B 151 -7.186 5.673 -2.662 1.00 33.34 C ATOM 531 CD2 LEU B 151 -8.505 6.543 -0.741 1.00 54.11 C ATOM 0 H LEU B 151 -5.056 8.394 -0.413 1.00 70.43 H new ATOM 0 HA LEU B 151 -6.913 6.987 1.296 1.00 60.43 H new ATOM 0 HB2 LEU B 151 -5.074 6.132 -0.971 1.00 30.21 H new ATOM 0 HB3 LEU B 151 -6.200 5.059 -0.163 1.00 30.21 H new ATOM 0 HG LEU B 151 -6.912 7.553 -1.737 1.00 35.52 H new ATOM 0 HD11 LEU B 151 -7.985 6.016 -3.319 1.00 33.34 H new ATOM 0 HD12 LEU B 151 -6.232 5.742 -3.184 1.00 33.34 H new ATOM 0 HD13 LEU B 151 -7.369 4.637 -2.378 1.00 33.34 H new ATOM 0 HD21 LEU B 151 -9.269 6.856 -1.453 1.00 54.11 H new ATOM 0 HD22 LEU B 151 -8.735 5.541 -0.378 1.00 54.11 H new ATOM 0 HD23 LEU B 151 -8.485 7.238 0.099 1.00 54.11 H new ATOM 543 N SER B 152 -3.895 6.856 2.149 1.00 60.31 N ATOM 544 CA SER B 152 -2.991 6.337 3.180 1.00 74.51 C ATOM 545 C SER B 152 -3.606 6.539 4.579 1.00 11.20 C ATOM 546 O SER B 152 -3.241 5.878 5.552 1.00 33.33 O ATOM 547 CB SER B 152 -1.590 6.987 3.059 1.00 21.44 C ATOM 548 OG SER B 152 -0.635 6.409 3.944 1.00 22.11 O ATOM 0 H SER B 152 -3.532 7.667 1.649 1.00 60.31 H new ATOM 0 HA SER B 152 -2.859 5.265 3.030 1.00 74.51 H new ATOM 0 HB2 SER B 152 -1.235 6.887 2.033 1.00 21.44 H new ATOM 0 HB3 SER B 152 -1.671 8.054 3.265 1.00 21.44 H new ATOM 0 HG SER B 152 -0.783 5.442 3.998 1.00 22.11 H new ATOM 554 N ASN B 153 -4.546 7.473 4.657 1.00 64.24 N ATOM 555 CA ASN B 153 -5.272 7.794 5.887 1.00 44.31 C ATOM 556 C ASN B 153 -6.054 6.578 6.394 1.00 64.55 C ATOM 557 O ASN B 153 -6.372 6.478 7.574 1.00 64.23 O ATOM 558 CB ASN B 153 -6.245 8.928 5.599 1.00 63.41 C ATOM 559 CG ASN B 153 -6.887 9.512 6.850 1.00 23.31 C ATOM 560 OD1 ASN B 153 -6.327 10.409 7.485 1.00 40.43 O ATOM 561 ND2 ASN B 153 -8.062 9.051 7.199 1.00 50.30 N ATOM 0 H ASN B 153 -4.832 8.039 3.858 1.00 64.24 H new ATOM 0 HA ASN B 153 -4.555 8.088 6.653 1.00 44.31 H new ATOM 0 HB2 ASN B 153 -5.719 9.721 5.067 1.00 63.41 H new ATOM 0 HB3 ASN B 153 -7.029 8.563 4.935 1.00 63.41 H new ATOM 0 HD21 ASN B 153 -8.538 9.434 8.015 1.00 50.30 H new ATOM 0 HD22 ASN B 153 -8.501 8.308 6.654 1.00 50.30 H new ATOM 568 N ILE B 154 -6.362 5.678 5.485 1.00 75.13 N ATOM 569 CA ILE B 154 -7.102 4.450 5.795 1.00 55.41 C ATOM 570 C ILE B 154 -6.392 3.621 6.876 1.00 43.23 C ATOM 571 O ILE B 154 -6.942 3.388 7.949 1.00 31.12 O ATOM 572 CB ILE B 154 -7.283 3.557 4.542 1.00 3.11 C ATOM 573 CG1 ILE B 154 -8.137 4.247 3.452 1.00 50.30 C ATOM 574 CG2 ILE B 154 -7.889 2.223 4.936 1.00 43.33 C ATOM 575 CD1 ILE B 154 -9.591 4.447 3.810 1.00 21.43 C ATOM 0 H ILE B 154 -6.109 5.768 4.501 1.00 75.13 H new ATOM 0 HA ILE B 154 -8.078 4.770 6.159 1.00 55.41 H new ATOM 0 HB ILE B 154 -6.296 3.388 4.112 1.00 3.11 H new ATOM 0 HG12 ILE B 154 -7.697 5.219 3.228 1.00 50.30 H new ATOM 0 HG13 ILE B 154 -8.082 3.654 2.539 1.00 50.30 H new ATOM 0 HG21 ILE B 154 -8.012 1.603 4.048 1.00 43.33 H new ATOM 0 HG22 ILE B 154 -7.230 1.718 5.643 1.00 43.33 H new ATOM 0 HG23 ILE B 154 -8.861 2.388 5.401 1.00 43.33 H new ATOM 0 HD11 ILE B 154 -10.105 4.937 2.983 1.00 21.43 H new ATOM 0 HD12 ILE B 154 -10.055 3.480 4.003 1.00 21.43 H new ATOM 0 HD13 ILE B 154 -9.664 5.069 4.702 1.00 21.43 H new ATOM 587 N ALA B 155 -5.160 3.222 6.599 1.00 10.31 N ATOM 588 CA ALA B 155 -4.392 2.360 7.494 1.00 14.12 C ATOM 589 C ALA B 155 -4.123 2.991 8.861 1.00 64.41 C ATOM 590 O ALA B 155 -3.696 2.309 9.797 1.00 71.04 O ATOM 591 CB ALA B 155 -3.132 1.854 6.840 1.00 41.11 C ATOM 0 H ALA B 155 -4.662 3.485 5.749 1.00 10.31 H new ATOM 0 HA ALA B 155 -5.023 1.494 7.692 1.00 14.12 H new ATOM 0 HB1 ALA B 155 -2.590 1.217 7.539 1.00 41.11 H new ATOM 0 HB2 ALA B 155 -3.389 1.280 5.950 1.00 41.11 H new ATOM 0 HB3 ALA B 155 -2.504 2.699 6.557 1.00 41.11 H new ATOM 597 N SER B 156 -4.314 4.297 8.961 1.00 4.52 N ATOM 598 CA SER B 156 -4.186 4.992 10.222 1.00 54.22 C ATOM 599 C SER B 156 -5.296 4.528 11.199 1.00 33.11 C ATOM 600 O SER B 156 -5.123 4.560 12.421 1.00 31.14 O ATOM 601 CB SER B 156 -4.308 6.500 9.993 1.00 51.15 C ATOM 602 OG SER B 156 -3.411 6.946 8.981 1.00 71.21 O ATOM 0 H SER B 156 -4.560 4.897 8.174 1.00 4.52 H new ATOM 0 HA SER B 156 -3.211 4.766 10.654 1.00 54.22 H new ATOM 0 HB2 SER B 156 -5.331 6.745 9.708 1.00 51.15 H new ATOM 0 HB3 SER B 156 -4.101 7.029 10.923 1.00 51.15 H new ATOM 0 HG SER B 156 -3.513 7.913 8.856 1.00 71.21 H new ATOM 608 N GLY B 157 -6.412 4.071 10.646 1.00 64.35 N ATOM 609 CA GLY B 157 -7.526 3.653 11.447 1.00 65.32 C ATOM 610 C GLY B 157 -7.440 2.196 11.817 1.00 30.23 C ATOM 611 O GLY B 157 -6.815 1.395 11.105 1.00 41.22 O ATOM 0 H GLY B 157 -6.558 3.985 9.640 1.00 64.35 H new ATOM 0 HA2 GLY B 157 -7.566 4.256 12.354 1.00 65.32 H new ATOM 0 HA3 GLY B 157 -8.453 3.835 10.902 1.00 65.32 H new ATOM 615 N GLY B 158 -8.038 1.840 12.924 1.00 4.51 N ATOM 616 CA GLY B 158 -8.000 0.473 13.356 1.00 1.13 C ATOM 617 C GLY B 158 -9.277 -0.271 13.033 1.00 32.24 C ATOM 618 O GLY B 158 -10.072 0.166 12.188 1.00 23.13 O ATOM 0 H GLY B 158 -8.552 2.473 13.536 1.00 4.51 H new ATOM 0 HA2 GLY B 158 -7.159 -0.032 12.881 1.00 1.13 H new ATOM 0 HA3 GLY B 158 -7.826 0.440 14.431 1.00 1.13 H new ATOM 622 N ASN B 159 -9.452 -1.391 13.703 1.00 23.14 N ATOM 623 CA ASN B 159 -10.602 -2.298 13.567 1.00 4.32 C ATOM 624 C ASN B 159 -10.793 -2.817 12.132 1.00 43.12 C ATOM 625 O ASN B 159 -10.075 -3.721 11.699 1.00 73.44 O ATOM 626 CB ASN B 159 -11.912 -1.708 14.135 1.00 41.53 C ATOM 627 CG ASN B 159 -13.061 -2.719 14.159 1.00 73.54 C ATOM 628 OD1 ASN B 159 -12.852 -3.921 14.338 1.00 53.51 O ATOM 629 ND2 ASN B 159 -14.267 -2.250 13.986 1.00 13.35 N ATOM 0 H ASN B 159 -8.774 -1.720 14.391 1.00 23.14 H new ATOM 0 HA ASN B 159 -10.354 -3.161 14.185 1.00 4.32 H new ATOM 0 HB2 ASN B 159 -11.732 -1.346 15.147 1.00 41.53 H new ATOM 0 HB3 ASN B 159 -12.206 -0.846 13.536 1.00 41.53 H new ATOM 0 HD21 ASN B 159 -15.067 -2.883 13.997 1.00 13.35 H new ATOM 0 HD22 ASN B 159 -14.409 -1.251 13.840 1.00 13.35 H new ATOM 636 N GLU B 160 -11.673 -2.192 11.366 1.00 61.13 N ATOM 637 CA GLU B 160 -12.004 -2.693 10.052 1.00 44.33 C ATOM 638 C GLU B 160 -11.122 -2.151 8.949 1.00 21.45 C ATOM 639 O GLU B 160 -10.796 -2.879 8.016 1.00 55.12 O ATOM 640 CB GLU B 160 -13.518 -2.629 9.724 1.00 21.44 C ATOM 641 CG GLU B 160 -14.290 -1.450 10.315 1.00 75.15 C ATOM 642 CD GLU B 160 -13.723 -0.112 9.961 1.00 34.45 C ATOM 643 OE1 GLU B 160 -14.113 0.472 8.932 1.00 51.14 O1- ATOM 644 OE2 GLU B 160 -12.884 0.390 10.730 1.00 5.33 O ATOM 0 H GLU B 160 -12.166 -1.341 11.635 1.00 61.13 H new ATOM 0 HA GLU B 160 -11.770 -3.757 10.096 1.00 44.33 H new ATOM 0 HB2 GLU B 160 -13.632 -2.604 8.640 1.00 21.44 H new ATOM 0 HB3 GLU B 160 -13.983 -3.551 10.072 1.00 21.44 H new ATOM 0 HG2 GLU B 160 -15.324 -1.497 9.972 1.00 75.15 H new ATOM 0 HG3 GLU B 160 -14.309 -1.549 11.400 1.00 75.15 H new ATOM 651 N GLN B 161 -10.683 -0.906 9.077 1.00 55.22 N ATOM 652 CA GLN B 161 -9.789 -0.320 8.068 1.00 4.24 C ATOM 653 C GLN B 161 -8.431 -1.034 8.126 1.00 2.21 C ATOM 654 O GLN B 161 -7.722 -1.161 7.138 1.00 4.14 O ATOM 655 CB GLN B 161 -9.594 1.194 8.305 1.00 73.31 C ATOM 656 CG GLN B 161 -10.889 2.000 8.390 1.00 74.15 C ATOM 657 CD GLN B 161 -10.667 3.513 8.429 1.00 63.34 C ATOM 658 OE1 GLN B 161 -9.731 4.039 7.842 1.00 30.32 O ATOM 659 NE2 GLN B 161 -11.513 4.216 9.128 1.00 71.32 N ATOM 0 H GLN B 161 -10.921 -0.286 9.851 1.00 55.22 H new ATOM 0 HA GLN B 161 -10.240 -0.450 7.084 1.00 4.24 H new ATOM 0 HB2 GLN B 161 -9.034 1.334 9.230 1.00 73.31 H new ATOM 0 HB3 GLN B 161 -8.983 1.598 7.498 1.00 73.31 H new ATOM 0 HG2 GLN B 161 -11.516 1.755 7.533 1.00 74.15 H new ATOM 0 HG3 GLN B 161 -11.437 1.698 9.283 1.00 74.15 H new ATOM 0 HE21 GLN B 161 -12.285 3.754 9.608 1.00 71.32 H new ATOM 0 HE22 GLN B 161 -11.403 5.228 9.195 1.00 71.32 H new ATOM 668 N LYS B 162 -8.135 -1.543 9.297 1.00 0.01 N ATOM 669 CA LYS B 162 -6.881 -2.193 9.591 1.00 53.04 C ATOM 670 C LYS B 162 -6.886 -3.681 9.199 1.00 54.42 C ATOM 671 O LYS B 162 -5.888 -4.197 8.746 1.00 41.24 O ATOM 672 CB LYS B 162 -6.617 -2.017 11.073 1.00 52.24 C ATOM 673 CG LYS B 162 -5.272 -2.468 11.598 1.00 72.31 C ATOM 674 CD LYS B 162 -5.205 -2.156 13.083 1.00 53.42 C ATOM 675 CE LYS B 162 -3.838 -2.373 13.684 1.00 52.21 C ATOM 676 NZ LYS B 162 -2.804 -1.557 13.015 1.00 22.01 N1+ ATOM 0 H LYS B 162 -8.775 -1.516 10.091 1.00 0.01 H new ATOM 0 HA LYS B 162 -6.086 -1.737 9.000 1.00 53.04 H new ATOM 0 HB2 LYS B 162 -6.735 -0.960 11.313 1.00 52.24 H new ATOM 0 HB3 LYS B 162 -7.390 -2.557 11.620 1.00 52.24 H new ATOM 0 HG2 LYS B 162 -5.138 -3.537 11.429 1.00 72.31 H new ATOM 0 HG3 LYS B 162 -4.468 -1.958 11.067 1.00 72.31 H new ATOM 0 HD2 LYS B 162 -5.502 -1.119 13.242 1.00 53.42 H new ATOM 0 HD3 LYS B 162 -5.928 -2.779 13.610 1.00 53.42 H new ATOM 0 HE2 LYS B 162 -3.865 -2.125 14.745 1.00 52.21 H new ATOM 0 HE3 LYS B 162 -3.572 -3.427 13.609 1.00 52.21 H new ATOM 0 HZ1 LYS B 162 -2.155 -1.167 13.728 1.00 22.01 H new ATOM 0 HZ2 LYS B 162 -2.270 -2.151 12.349 1.00 22.01 H new ATOM 0 HZ3 LYS B 162 -3.258 -0.778 12.497 1.00 22.01 H new ATOM 690 N GLN B 163 -8.017 -4.359 9.368 1.00 45.04 N ATOM 691 CA GLN B 163 -8.103 -5.811 9.080 1.00 54.43 C ATOM 692 C GLN B 163 -8.236 -6.059 7.576 1.00 43.34 C ATOM 693 O GLN B 163 -7.853 -7.116 7.051 1.00 51.54 O ATOM 694 CB GLN B 163 -9.307 -6.400 9.795 1.00 0.44 C ATOM 695 CG GLN B 163 -10.618 -5.943 9.208 1.00 12.45 C ATOM 696 CD GLN B 163 -11.805 -6.236 10.093 1.00 32.52 C ATOM 697 OE1 GLN B 163 -11.702 -6.247 11.321 1.00 71.21 O ATOM 698 NE2 GLN B 163 -12.925 -6.507 9.486 1.00 35.45 N ATOM 0 H GLN B 163 -8.887 -3.942 9.700 1.00 45.04 H new ATOM 0 HA GLN B 163 -7.189 -6.289 9.434 1.00 54.43 H new ATOM 0 HB2 GLN B 163 -9.254 -7.488 9.750 1.00 0.44 H new ATOM 0 HB3 GLN B 163 -9.270 -6.122 10.848 1.00 0.44 H new ATOM 0 HG2 GLN B 163 -10.570 -4.870 9.021 1.00 12.45 H new ATOM 0 HG3 GLN B 163 -10.765 -6.429 8.243 1.00 12.45 H new ATOM 0 HE21 GLN B 163 -12.971 -6.488 8.467 1.00 35.45 H new ATOM 0 HE22 GLN B 163 -13.757 -6.739 10.029 1.00 35.45 H new ATOM 707 N ALA B 164 -8.766 -5.051 6.909 1.00 52.32 N ATOM 708 CA ALA B 164 -9.054 -5.021 5.481 1.00 30.11 C ATOM 709 C ALA B 164 -7.880 -5.456 4.679 1.00 13.35 C ATOM 710 O ALA B 164 -7.974 -6.269 3.755 1.00 74.41 O ATOM 711 CB ALA B 164 -9.287 -3.599 5.134 1.00 12.31 C ATOM 0 H ALA B 164 -9.023 -4.180 7.373 1.00 52.32 H new ATOM 0 HA ALA B 164 -9.898 -5.678 5.271 1.00 30.11 H new ATOM 0 HB1 ALA B 164 -9.509 -3.516 4.070 1.00 12.31 H new ATOM 0 HB2 ALA B 164 -10.129 -3.217 5.711 1.00 12.31 H new ATOM 0 HB3 ALA B 164 -8.395 -3.017 5.365 1.00 12.31 H new ATOM 717 N VAL B 165 -6.779 -4.924 5.076 1.00 3.02 N ATOM 718 CA VAL B 165 -5.550 -5.050 4.392 1.00 13.21 C ATOM 719 C VAL B 165 -5.073 -6.512 4.402 1.00 2.43 C ATOM 720 O VAL B 165 -4.455 -6.969 3.470 1.00 61.00 O ATOM 721 CB VAL B 165 -4.500 -4.092 5.033 1.00 33.10 C ATOM 722 CG1 VAL B 165 -5.128 -2.765 5.314 1.00 41.13 C ATOM 723 CG2 VAL B 165 -4.025 -4.600 6.317 1.00 41.10 C ATOM 0 H VAL B 165 -6.712 -4.364 5.926 1.00 3.02 H new ATOM 0 HA VAL B 165 -5.681 -4.764 3.348 1.00 13.21 H new ATOM 0 HB VAL B 165 -3.673 -4.012 4.327 1.00 33.10 H new ATOM 0 HG11 VAL B 165 -4.389 -2.100 5.762 1.00 41.13 H new ATOM 0 HG12 VAL B 165 -5.491 -2.330 4.383 1.00 41.13 H new ATOM 0 HG13 VAL B 165 -5.963 -2.896 6.003 1.00 41.13 H new ATOM 0 HG21 VAL B 165 -3.295 -3.907 6.735 1.00 41.10 H new ATOM 0 HG22 VAL B 165 -4.866 -4.698 7.003 1.00 41.10 H new ATOM 0 HG23 VAL B 165 -3.559 -5.575 6.173 1.00 41.10 H new ATOM 733 N LYS B 166 -5.421 -7.257 5.430 1.00 72.33 N ATOM 734 CA LYS B 166 -4.996 -8.632 5.501 1.00 62.53 C ATOM 735 C LYS B 166 -5.948 -9.482 4.699 1.00 61.12 C ATOM 736 O LYS B 166 -5.527 -10.402 4.004 1.00 13.14 O ATOM 737 CB LYS B 166 -4.937 -9.184 6.932 1.00 64.02 C ATOM 738 CG LYS B 166 -4.092 -8.422 7.953 1.00 21.20 C ATOM 739 CD LYS B 166 -4.799 -7.178 8.466 1.00 51.32 C ATOM 740 CE LYS B 166 -4.306 -6.795 9.847 1.00 50.03 C ATOM 741 NZ LYS B 166 -4.613 -7.847 10.845 1.00 65.44 N1+ ATOM 0 H LYS B 166 -5.988 -6.937 6.215 1.00 72.33 H new ATOM 0 HA LYS B 166 -3.983 -8.667 5.101 1.00 62.53 H new ATOM 0 HB2 LYS B 166 -5.957 -9.237 7.313 1.00 64.02 H new ATOM 0 HB3 LYS B 166 -4.562 -10.206 6.882 1.00 64.02 H new ATOM 0 HG2 LYS B 166 -3.859 -9.078 8.792 1.00 21.20 H new ATOM 0 HG3 LYS B 166 -3.143 -8.138 7.498 1.00 21.20 H new ATOM 0 HD2 LYS B 166 -4.632 -6.351 7.776 1.00 51.32 H new ATOM 0 HD3 LYS B 166 -5.874 -7.355 8.497 1.00 51.32 H new ATOM 0 HE2 LYS B 166 -3.230 -6.625 9.816 1.00 50.03 H new ATOM 0 HE3 LYS B 166 -4.769 -5.856 10.152 1.00 50.03 H new ATOM 0 HZ1 LYS B 166 -4.733 -7.412 11.782 1.00 65.44 H new ATOM 0 HZ2 LYS B 166 -5.491 -8.336 10.576 1.00 65.44 H new ATOM 0 HZ3 LYS B 166 -3.832 -8.532 10.879 1.00 65.44 H new ATOM 755 N GLU B 167 -7.234 -9.157 4.796 1.00 75.44 N ATOM 756 CA GLU B 167 -8.272 -9.871 4.114 1.00 33.13 C ATOM 757 C GLU B 167 -8.063 -9.819 2.605 1.00 4.33 C ATOM 758 O GLU B 167 -8.040 -10.853 1.927 1.00 61.22 O ATOM 759 CB GLU B 167 -9.579 -9.207 4.451 1.00 35.41 C ATOM 760 CG GLU B 167 -10.682 -10.180 4.731 1.00 14.32 C ATOM 761 CD GLU B 167 -10.962 -11.170 3.614 1.00 71.10 C ATOM 762 OE1 GLU B 167 -11.723 -10.845 2.676 1.00 51.30 O1- ATOM 763 OE2 GLU B 167 -10.438 -12.298 3.670 1.00 34.35 O ATOM 0 H GLU B 167 -7.573 -8.379 5.361 1.00 75.44 H new ATOM 0 HA GLU B 167 -8.264 -10.916 4.425 1.00 33.13 H new ATOM 0 HB2 GLU B 167 -9.439 -8.566 5.322 1.00 35.41 H new ATOM 0 HB3 GLU B 167 -9.875 -8.561 3.624 1.00 35.41 H new ATOM 0 HG2 GLU B 167 -10.435 -10.736 5.636 1.00 14.32 H new ATOM 0 HG3 GLU B 167 -11.595 -9.622 4.939 1.00 14.32 H new ATOM 770 N ALA B 168 -7.835 -8.627 2.100 1.00 51.34 N ATOM 771 CA ALA B 168 -7.679 -8.423 0.675 1.00 12.43 C ATOM 772 C ALA B 168 -6.266 -8.781 0.201 1.00 34.44 C ATOM 773 O ALA B 168 -6.001 -8.888 -1.007 1.00 25.22 O ATOM 774 CB ALA B 168 -8.043 -7.003 0.321 1.00 40.11 C ATOM 0 H ALA B 168 -7.753 -7.778 2.659 1.00 51.34 H new ATOM 0 HA ALA B 168 -8.359 -9.096 0.153 1.00 12.43 H new ATOM 0 HB1 ALA B 168 -7.924 -6.854 -0.752 1.00 40.11 H new ATOM 0 HB2 ALA B 168 -9.079 -6.812 0.601 1.00 40.11 H new ATOM 0 HB3 ALA B 168 -7.389 -6.315 0.858 1.00 40.11 H new ATOM 780 N GLY B 169 -5.370 -8.963 1.138 1.00 34.33 N ATOM 781 CA GLY B 169 -4.036 -9.376 0.806 1.00 34.02 C ATOM 782 C GLY B 169 -3.135 -8.220 0.450 1.00 4.54 C ATOM 783 O GLY B 169 -2.737 -8.067 -0.705 1.00 31.44 O ATOM 0 H GLY B 169 -5.543 -8.831 2.135 1.00 34.33 H new ATOM 0 HA2 GLY B 169 -3.608 -9.917 1.650 1.00 34.02 H new ATOM 0 HA3 GLY B 169 -4.074 -10.072 -0.032 1.00 34.02 H new ATOM 787 N ALA B 170 -2.836 -7.393 1.431 1.00 35.41 N ATOM 788 CA ALA B 170 -1.918 -6.280 1.272 1.00 34.41 C ATOM 789 C ALA B 170 -0.549 -6.769 0.897 1.00 73.04 C ATOM 790 O ALA B 170 0.107 -6.147 0.115 1.00 1.24 O ATOM 791 CB ALA B 170 -1.869 -5.428 2.530 1.00 13.24 C ATOM 0 H ALA B 170 -3.226 -7.474 2.370 1.00 35.41 H new ATOM 0 HA ALA B 170 -2.286 -5.652 0.461 1.00 34.41 H new ATOM 0 HB1 ALA B 170 -1.174 -4.602 2.383 1.00 13.24 H new ATOM 0 HB2 ALA B 170 -2.863 -5.033 2.741 1.00 13.24 H new ATOM 0 HB3 ALA B 170 -1.535 -6.038 3.370 1.00 13.24 H new ATOM 797 N LEU B 171 -0.155 -7.925 1.426 1.00 61.22 N ATOM 798 CA LEU B 171 1.113 -8.538 1.119 1.00 71.22 C ATOM 799 C LEU B 171 1.165 -8.886 -0.379 1.00 54.15 C ATOM 800 O LEU B 171 2.161 -8.655 -1.062 1.00 23.24 O ATOM 801 CB LEU B 171 1.268 -9.817 1.946 1.00 35.44 C ATOM 802 CG LEU B 171 1.246 -9.696 3.488 1.00 71.12 C ATOM 803 CD1 LEU B 171 2.302 -8.745 4.001 1.00 70.51 C ATOM 804 CD2 LEU B 171 -0.139 -9.365 4.070 1.00 11.20 C ATOM 0 H LEU B 171 -0.721 -8.459 2.085 1.00 61.22 H new ATOM 0 HA LEU B 171 1.921 -7.847 1.358 1.00 71.22 H new ATOM 0 HB2 LEU B 171 0.471 -10.501 1.654 1.00 35.44 H new ATOM 0 HB3 LEU B 171 2.210 -10.285 1.662 1.00 35.44 H new ATOM 0 HG LEU B 171 1.490 -10.694 3.851 1.00 71.12 H new ATOM 0 HD11 LEU B 171 2.248 -8.693 5.088 1.00 70.51 H new ATOM 0 HD12 LEU B 171 3.288 -9.102 3.704 1.00 70.51 H new ATOM 0 HD13 LEU B 171 2.133 -7.753 3.581 1.00 70.51 H new ATOM 0 HD21 LEU B 171 -0.071 -9.297 5.156 1.00 11.20 H new ATOM 0 HD22 LEU B 171 -0.484 -8.413 3.668 1.00 11.20 H new ATOM 0 HD23 LEU B 171 -0.845 -10.150 3.799 1.00 11.20 H new ATOM 816 N GLU B 172 0.066 -9.433 -0.870 1.00 61.41 N ATOM 817 CA GLU B 172 -0.093 -9.780 -2.269 1.00 12.34 C ATOM 818 C GLU B 172 -0.037 -8.519 -3.139 1.00 12.03 C ATOM 819 O GLU B 172 0.581 -8.514 -4.202 1.00 11.21 O ATOM 820 CB GLU B 172 -1.427 -10.487 -2.452 1.00 22.42 C ATOM 821 CG GLU B 172 -1.744 -10.900 -3.857 1.00 4.33 C ATOM 822 CD GLU B 172 -3.114 -11.487 -3.952 1.00 14.33 C ATOM 823 OE1 GLU B 172 -3.289 -12.692 -3.687 1.00 71.05 O1- ATOM 824 OE2 GLU B 172 -4.048 -10.755 -4.260 1.00 61.51 O ATOM 0 H GLU B 172 -0.751 -9.651 -0.299 1.00 61.41 H new ATOM 0 HA GLU B 172 0.717 -10.442 -2.576 1.00 12.34 H new ATOM 0 HB2 GLU B 172 -1.440 -11.374 -1.818 1.00 22.42 H new ATOM 0 HB3 GLU B 172 -2.220 -9.829 -2.096 1.00 22.42 H new ATOM 0 HG2 GLU B 172 -1.669 -10.037 -4.518 1.00 4.33 H new ATOM 0 HG3 GLU B 172 -1.009 -11.628 -4.199 1.00 4.33 H new ATOM 831 N LYS B 173 -0.689 -7.457 -2.682 1.00 75.52 N ATOM 832 CA LYS B 173 -0.666 -6.195 -3.390 1.00 52.14 C ATOM 833 C LYS B 173 0.747 -5.605 -3.391 1.00 13.42 C ATOM 834 O LYS B 173 1.292 -5.247 -4.440 1.00 22.05 O ATOM 835 CB LYS B 173 -1.622 -5.173 -2.743 1.00 52.11 C ATOM 836 CG LYS B 173 -3.028 -4.981 -3.360 1.00 23.24 C ATOM 837 CD LYS B 173 -4.041 -6.071 -3.072 1.00 32.34 C ATOM 838 CE LYS B 173 -3.717 -7.362 -3.722 1.00 65.44 C ATOM 839 NZ LYS B 173 -4.751 -8.376 -3.454 1.00 43.00 N1+ ATOM 0 H LYS B 173 -1.239 -7.450 -1.823 1.00 75.52 H new ATOM 0 HA LYS B 173 -0.989 -6.393 -4.412 1.00 52.14 H new ATOM 0 HB2 LYS B 173 -1.755 -5.458 -1.699 1.00 52.11 H new ATOM 0 HB3 LYS B 173 -1.123 -4.204 -2.748 1.00 52.11 H new ATOM 0 HG2 LYS B 173 -3.433 -4.034 -3.002 1.00 23.24 H new ATOM 0 HG3 LYS B 173 -2.918 -4.892 -4.441 1.00 23.24 H new ATOM 0 HD2 LYS B 173 -4.105 -6.221 -1.994 1.00 32.34 H new ATOM 0 HD3 LYS B 173 -5.024 -5.741 -3.407 1.00 32.34 H new ATOM 0 HE2 LYS B 173 -3.621 -7.215 -4.798 1.00 65.44 H new ATOM 0 HE3 LYS B 173 -2.753 -7.720 -3.362 1.00 65.44 H new ATOM 0 HZ1 LYS B 173 -4.379 -9.320 -3.681 1.00 43.00 H new ATOM 0 HZ2 LYS B 173 -5.019 -8.342 -2.450 1.00 43.00 H new ATOM 0 HZ3 LYS B 173 -5.587 -8.183 -4.042 1.00 43.00 H new ATOM 853 N LEU B 174 1.325 -5.568 -2.204 1.00 32.33 N ATOM 854 CA LEU B 174 2.617 -4.957 -1.916 1.00 44.15 C ATOM 855 C LEU B 174 3.711 -5.592 -2.762 1.00 4.04 C ATOM 856 O LEU B 174 4.614 -4.913 -3.191 1.00 43.44 O ATOM 857 CB LEU B 174 2.922 -5.147 -0.410 1.00 22.15 C ATOM 858 CG LEU B 174 3.682 -4.036 0.340 1.00 32.13 C ATOM 859 CD1 LEU B 174 5.089 -3.838 -0.178 1.00 13.11 C ATOM 860 CD2 LEU B 174 2.902 -2.733 0.289 1.00 43.15 C ATOM 0 H LEU B 174 0.891 -5.979 -1.377 1.00 32.33 H new ATOM 0 HA LEU B 174 2.584 -3.895 -2.159 1.00 44.15 H new ATOM 0 HB2 LEU B 174 1.972 -5.301 0.102 1.00 22.15 H new ATOM 0 HB3 LEU B 174 3.494 -6.068 -0.303 1.00 22.15 H new ATOM 0 HG LEU B 174 3.774 -4.358 1.377 1.00 32.13 H new ATOM 0 HD11 LEU B 174 5.576 -3.043 0.387 1.00 13.11 H new ATOM 0 HD12 LEU B 174 5.653 -4.764 -0.063 1.00 13.11 H new ATOM 0 HD13 LEU B 174 5.053 -3.564 -1.232 1.00 13.11 H new ATOM 0 HD21 LEU B 174 3.452 -1.958 0.823 1.00 43.15 H new ATOM 0 HD22 LEU B 174 2.766 -2.431 -0.749 1.00 43.15 H new ATOM 0 HD23 LEU B 174 1.927 -2.874 0.757 1.00 43.15 H new ATOM 872 N GLU B 175 3.585 -6.887 -3.014 1.00 64.22 N ATOM 873 CA GLU B 175 4.530 -7.680 -3.778 1.00 34.22 C ATOM 874 C GLU B 175 4.911 -7.023 -5.117 1.00 30.54 C ATOM 875 O GLU B 175 6.080 -7.050 -5.531 1.00 40.22 O ATOM 876 CB GLU B 175 3.892 -9.007 -4.047 1.00 31.20 C ATOM 877 CG GLU B 175 4.869 -10.070 -4.385 1.00 63.55 C ATOM 878 CD GLU B 175 4.199 -11.359 -4.702 1.00 72.13 C ATOM 879 OE1 GLU B 175 3.876 -12.115 -3.778 1.00 5.21 O ATOM 880 OE2 GLU B 175 3.966 -11.641 -5.890 1.00 12.05 O1- ATOM 0 H GLU B 175 2.791 -7.432 -2.678 1.00 64.22 H new ATOM 0 HA GLU B 175 5.449 -7.776 -3.199 1.00 34.22 H new ATOM 0 HB2 GLU B 175 3.322 -9.313 -3.170 1.00 31.20 H new ATOM 0 HB3 GLU B 175 3.182 -8.901 -4.867 1.00 31.20 H new ATOM 0 HG2 GLU B 175 5.469 -9.753 -5.238 1.00 63.55 H new ATOM 0 HG3 GLU B 175 5.554 -10.213 -3.549 1.00 63.55 H new ATOM 887 N GLN B 176 3.927 -6.432 -5.768 1.00 53.05 N ATOM 888 CA GLN B 176 4.117 -5.773 -7.047 1.00 51.12 C ATOM 889 C GLN B 176 4.935 -4.516 -6.840 1.00 15.23 C ATOM 890 O GLN B 176 5.886 -4.221 -7.566 1.00 25.45 O ATOM 891 CB GLN B 176 2.766 -5.382 -7.605 1.00 22.05 C ATOM 892 CG GLN B 176 1.772 -6.517 -7.692 1.00 3.54 C ATOM 893 CD GLN B 176 2.198 -7.623 -8.633 1.00 35.11 C ATOM 894 OE1 GLN B 176 2.874 -8.571 -8.226 1.00 25.33 O ATOM 895 NE2 GLN B 176 1.803 -7.528 -9.873 1.00 12.14 N ATOM 0 H GLN B 176 2.968 -6.395 -5.423 1.00 53.05 H new ATOM 0 HA GLN B 176 4.629 -6.446 -7.735 1.00 51.12 H new ATOM 0 HB2 GLN B 176 2.344 -4.593 -6.982 1.00 22.05 H new ATOM 0 HB3 GLN B 176 2.906 -4.961 -8.601 1.00 22.05 H new ATOM 0 HG2 GLN B 176 1.623 -6.935 -6.697 1.00 3.54 H new ATOM 0 HG3 GLN B 176 0.810 -6.123 -8.020 1.00 3.54 H new ATOM 0 HE21 GLN B 176 1.245 -6.728 -10.171 1.00 12.14 H new ATOM 0 HE22 GLN B 176 2.052 -8.254 -10.545 1.00 12.14 H new ATOM 904 N LEU B 177 4.565 -3.803 -5.812 1.00 55.23 N ATOM 905 CA LEU B 177 5.186 -2.543 -5.429 1.00 50.03 C ATOM 906 C LEU B 177 6.582 -2.767 -4.857 1.00 2.24 C ATOM 907 O LEU B 177 7.395 -1.858 -4.774 1.00 11.31 O ATOM 908 CB LEU B 177 4.305 -1.861 -4.410 1.00 4.33 C ATOM 909 CG LEU B 177 4.719 -0.477 -3.975 1.00 13.40 C ATOM 910 CD1 LEU B 177 4.606 0.492 -5.150 1.00 11.02 C ATOM 911 CD2 LEU B 177 3.880 -0.021 -2.796 1.00 54.44 C ATOM 0 H LEU B 177 3.803 -4.081 -5.194 1.00 55.23 H new ATOM 0 HA LEU B 177 5.292 -1.914 -6.313 1.00 50.03 H new ATOM 0 HB2 LEU B 177 3.296 -1.802 -4.818 1.00 4.33 H new ATOM 0 HB3 LEU B 177 4.255 -2.495 -3.525 1.00 4.33 H new ATOM 0 HG LEU B 177 5.760 -0.497 -3.651 1.00 13.40 H new ATOM 0 HD11 LEU B 177 4.906 1.489 -4.829 1.00 11.02 H new ATOM 0 HD12 LEU B 177 5.256 0.160 -5.959 1.00 11.02 H new ATOM 0 HD13 LEU B 177 3.575 0.519 -5.501 1.00 11.02 H new ATOM 0 HD21 LEU B 177 4.191 0.979 -2.494 1.00 54.44 H new ATOM 0 HD22 LEU B 177 2.829 -0.003 -3.083 1.00 54.44 H new ATOM 0 HD23 LEU B 177 4.017 -0.711 -1.963 1.00 54.44 H new ATOM 923 N GLN B 178 6.841 -3.974 -4.450 1.00 31.43 N ATOM 924 CA GLN B 178 8.170 -4.361 -3.980 1.00 34.22 C ATOM 925 C GLN B 178 9.205 -4.279 -5.109 1.00 43.53 C ATOM 926 O GLN B 178 10.396 -4.197 -4.859 1.00 33.40 O ATOM 927 CB GLN B 178 8.187 -5.743 -3.316 1.00 22.20 C ATOM 928 CG GLN B 178 7.369 -5.820 -2.037 1.00 63.12 C ATOM 929 CD GLN B 178 7.481 -7.151 -1.320 1.00 52.34 C ATOM 930 OE1 GLN B 178 6.716 -8.082 -1.570 1.00 3.53 O ATOM 931 NE2 GLN B 178 8.406 -7.239 -0.407 1.00 12.22 N ATOM 0 H GLN B 178 6.152 -4.726 -4.428 1.00 31.43 H new ATOM 0 HA GLN B 178 8.446 -3.641 -3.209 1.00 34.22 H new ATOM 0 HB2 GLN B 178 7.808 -6.480 -4.024 1.00 22.20 H new ATOM 0 HB3 GLN B 178 9.219 -6.016 -3.093 1.00 22.20 H new ATOM 0 HG2 GLN B 178 7.690 -5.026 -1.363 1.00 63.12 H new ATOM 0 HG3 GLN B 178 6.322 -5.632 -2.274 1.00 63.12 H new ATOM 0 HE21 GLN B 178 9.022 -6.446 -0.227 1.00 12.22 H new ATOM 0 HE22 GLN B 178 8.514 -8.101 0.128 1.00 12.22 H new ATOM 940 N SER B 179 8.733 -4.239 -6.348 1.00 11.02 N ATOM 941 CA SER B 179 9.595 -4.069 -7.507 1.00 25.41 C ATOM 942 C SER B 179 9.841 -2.555 -7.762 1.00 10.24 C ATOM 943 O SER B 179 10.231 -2.146 -8.851 1.00 40.01 O ATOM 944 CB SER B 179 8.922 -4.717 -8.722 1.00 32.12 C ATOM 945 OG SER B 179 8.550 -6.066 -8.432 1.00 64.32 O ATOM 0 H SER B 179 7.742 -4.324 -6.576 1.00 11.02 H new ATOM 0 HA SER B 179 10.558 -4.548 -7.331 1.00 25.41 H new ATOM 0 HB2 SER B 179 8.039 -4.143 -9.004 1.00 32.12 H new ATOM 0 HB3 SER B 179 9.601 -4.697 -9.574 1.00 32.12 H new ATOM 0 HG SER B 179 8.120 -6.463 -9.218 1.00 64.32 H new ATOM 951 N HIS B 180 9.599 -1.758 -6.731 1.00 24.01 N ATOM 952 CA HIS B 180 9.738 -0.293 -6.763 1.00 14.12 C ATOM 953 C HIS B 180 11.159 0.146 -7.115 1.00 13.51 C ATOM 954 O HIS B 180 12.137 -0.456 -6.665 1.00 60.24 O ATOM 955 CB HIS B 180 9.352 0.325 -5.389 1.00 1.42 C ATOM 956 CG HIS B 180 10.310 0.047 -4.269 1.00 74.51 C ATOM 957 ND1 HIS B 180 11.193 0.993 -3.793 1.00 63.40 N ATOM 958 CD2 HIS B 180 10.541 -1.072 -3.553 1.00 44.44 C ATOM 959 CE1 HIS B 180 11.922 0.461 -2.847 1.00 71.54 C ATOM 960 NE2 HIS B 180 11.545 -0.787 -2.680 1.00 34.33 N ATOM 0 H HIS B 180 9.293 -2.111 -5.824 1.00 24.01 H new ATOM 0 HA HIS B 180 9.062 0.065 -7.540 1.00 14.12 H new ATOM 0 HB2 HIS B 180 9.261 1.405 -5.508 1.00 1.42 H new ATOM 0 HB3 HIS B 180 8.368 -0.049 -5.105 1.00 1.42 H new ATOM 0 HD1 HIS B 180 11.266 1.954 -4.126 1.00 63.40 H new ATOM 0 HD2 HIS B 180 10.026 -2.016 -3.653 1.00 44.44 H new ATOM 0 HE1 HIS B 180 12.703 0.963 -2.295 1.00 71.54 H new ATOM 969 N GLU B 181 11.262 1.194 -7.873 1.00 2.23 N ATOM 970 CA GLU B 181 12.537 1.772 -8.203 1.00 3.54 C ATOM 971 C GLU B 181 12.665 3.137 -7.546 1.00 21.45 C ATOM 972 O GLU B 181 13.759 3.721 -7.489 1.00 41.00 O ATOM 973 CB GLU B 181 12.710 1.888 -9.706 1.00 22.41 C ATOM 974 CG GLU B 181 12.694 0.554 -10.416 1.00 21.45 C ATOM 975 CD GLU B 181 12.954 0.677 -11.888 1.00 4.11 C ATOM 976 OE1 GLU B 181 14.128 0.783 -12.292 1.00 34.25 O1- ATOM 977 OE2 GLU B 181 11.991 0.666 -12.675 1.00 21.44 O ATOM 0 H GLU B 181 10.463 1.678 -8.284 1.00 2.23 H new ATOM 0 HA GLU B 181 13.324 1.118 -7.827 1.00 3.54 H new ATOM 0 HB2 GLU B 181 11.915 2.515 -10.109 1.00 22.41 H new ATOM 0 HB3 GLU B 181 13.652 2.393 -9.918 1.00 22.41 H new ATOM 0 HG2 GLU B 181 13.446 -0.098 -9.972 1.00 21.45 H new ATOM 0 HG3 GLU B 181 11.727 0.076 -10.261 1.00 21.45 H new ATOM 984 N ASN B 182 11.558 3.632 -7.037 1.00 1.10 N ATOM 985 CA ASN B 182 11.503 4.926 -6.379 1.00 51.53 C ATOM 986 C ASN B 182 11.747 4.746 -4.932 1.00 31.02 C ATOM 987 O ASN B 182 11.338 3.748 -4.295 1.00 72.11 O ATOM 988 CB ASN B 182 10.155 5.602 -6.651 1.00 70.24 C ATOM 989 CG ASN B 182 10.080 7.102 -6.340 1.00 71.13 C ATOM 990 OD1 ASN B 182 10.700 7.607 -5.406 1.00 53.24 O ATOM 991 ND2 ASN B 182 9.350 7.819 -7.153 1.00 41.44 N ATOM 0 H ASN B 182 10.662 3.146 -7.067 1.00 1.10 H new ATOM 0 HA ASN B 182 12.278 5.580 -6.778 1.00 51.53 H new ATOM 0 HB2 ASN B 182 9.903 5.456 -7.701 1.00 70.24 H new ATOM 0 HB3 ASN B 182 9.390 5.091 -6.066 1.00 70.24 H new ATOM 0 HD21 ASN B 182 9.283 8.828 -7.022 1.00 41.44 H new ATOM 0 HD22 ASN B 182 8.848 7.369 -7.918 1.00 41.44 H new ATOM 998 N GLU B 183 12.429 5.695 -4.441 1.00 21.41 N ATOM 999 CA GLU B 183 12.904 5.748 -3.141 1.00 75.53 C ATOM 1000 C GLU B 183 11.793 6.177 -2.174 1.00 53.13 C ATOM 1001 O GLU B 183 11.712 5.678 -1.056 1.00 62.23 O ATOM 1002 CB GLU B 183 14.049 6.722 -3.172 1.00 4.41 C ATOM 1003 CG GLU B 183 13.647 8.192 -3.230 1.00 71.12 C ATOM 1004 CD GLU B 183 14.800 9.095 -3.523 1.00 70.35 C ATOM 1005 OE1 GLU B 183 15.259 9.134 -4.675 1.00 10.34 O1- ATOM 1006 OE2 GLU B 183 15.281 9.785 -2.599 1.00 74.32 O ATOM 0 H GLU B 183 12.686 6.517 -4.988 1.00 21.41 H new ATOM 0 HA GLU B 183 13.238 4.775 -2.781 1.00 75.53 H new ATOM 0 HB2 GLU B 183 14.664 6.564 -2.286 1.00 4.41 H new ATOM 0 HB3 GLU B 183 14.673 6.498 -4.037 1.00 4.41 H new ATOM 0 HG2 GLU B 183 12.883 8.325 -3.996 1.00 71.12 H new ATOM 0 HG3 GLU B 183 13.199 8.479 -2.279 1.00 71.12 H new ATOM 1013 N LYS B 184 10.886 7.048 -2.656 1.00 31.52 N ATOM 1014 CA LYS B 184 9.789 7.563 -1.844 1.00 55.01 C ATOM 1015 C LYS B 184 8.838 6.434 -1.509 1.00 72.22 C ATOM 1016 O LYS B 184 8.186 6.420 -0.451 1.00 13.24 O ATOM 1017 CB LYS B 184 9.011 8.648 -2.592 1.00 13.15 C ATOM 1018 CG LYS B 184 9.773 9.930 -2.895 1.00 23.11 C ATOM 1019 CD LYS B 184 8.897 10.875 -3.710 1.00 51.20 C ATOM 1020 CE LYS B 184 9.571 12.208 -4.003 1.00 41.21 C ATOM 1021 NZ LYS B 184 9.759 13.031 -2.786 1.00 13.42 N1+ ATOM 0 H LYS B 184 10.900 7.406 -3.611 1.00 31.52 H new ATOM 0 HA LYS B 184 10.213 7.993 -0.936 1.00 55.01 H new ATOM 0 HB2 LYS B 184 8.657 8.229 -3.534 1.00 13.15 H new ATOM 0 HB3 LYS B 184 8.129 8.904 -2.005 1.00 13.15 H new ATOM 0 HG2 LYS B 184 10.075 10.412 -1.965 1.00 23.11 H new ATOM 0 HG3 LYS B 184 10.685 9.700 -3.446 1.00 23.11 H new ATOM 0 HD2 LYS B 184 8.631 10.394 -4.651 1.00 51.20 H new ATOM 0 HD3 LYS B 184 7.967 11.055 -3.171 1.00 51.20 H new ATOM 0 HE2 LYS B 184 10.540 12.026 -4.468 1.00 41.21 H new ATOM 0 HE3 LYS B 184 8.971 12.764 -4.724 1.00 41.21 H new ATOM 0 HZ1 LYS B 184 10.159 13.954 -3.050 1.00 13.42 H new ATOM 0 HZ2 LYS B 184 8.841 13.172 -2.317 1.00 13.42 H new ATOM 0 HZ3 LYS B 184 10.409 12.545 -2.135 1.00 13.42 H new ATOM 1035 N ILE B 185 8.799 5.477 -2.419 1.00 60.21 N ATOM 1036 CA ILE B 185 7.942 4.329 -2.337 1.00 75.21 C ATOM 1037 C ILE B 185 8.249 3.461 -1.109 1.00 0.43 C ATOM 1038 O ILE B 185 7.365 2.810 -0.595 1.00 60.43 O ATOM 1039 CB ILE B 185 7.986 3.510 -3.655 1.00 72.20 C ATOM 1040 CG1 ILE B 185 7.438 4.368 -4.792 1.00 53.13 C ATOM 1041 CG2 ILE B 185 7.192 2.205 -3.547 1.00 64.03 C ATOM 1042 CD1 ILE B 185 5.998 4.754 -4.651 1.00 52.31 C ATOM 0 H ILE B 185 9.383 5.486 -3.255 1.00 60.21 H new ATOM 0 HA ILE B 185 6.922 4.691 -2.206 1.00 75.21 H new ATOM 0 HB ILE B 185 9.022 3.238 -3.855 1.00 72.20 H new ATOM 0 HG12 ILE B 185 8.037 5.276 -4.865 1.00 53.13 H new ATOM 0 HG13 ILE B 185 7.564 3.827 -5.730 1.00 53.13 H new ATOM 0 HG21 ILE B 185 7.250 1.664 -4.492 1.00 64.03 H new ATOM 0 HG22 ILE B 185 7.610 1.590 -2.750 1.00 64.03 H new ATOM 0 HG23 ILE B 185 6.150 2.431 -3.322 1.00 64.03 H new ATOM 0 HD11 ILE B 185 5.699 5.362 -5.505 1.00 52.31 H new ATOM 0 HD12 ILE B 185 5.383 3.855 -4.612 1.00 52.31 H new ATOM 0 HD13 ILE B 185 5.863 5.326 -3.733 1.00 52.31 H new ATOM 1054 N GLN B 186 9.495 3.481 -0.624 1.00 51.04 N ATOM 1055 CA GLN B 186 9.841 2.746 0.617 1.00 13.34 C ATOM 1056 C GLN B 186 8.917 3.106 1.778 1.00 43.21 C ATOM 1057 O GLN B 186 8.498 2.231 2.526 1.00 14.42 O ATOM 1058 CB GLN B 186 11.278 2.979 1.062 1.00 3.31 C ATOM 1059 CG GLN B 186 12.297 1.946 0.604 1.00 30.13 C ATOM 1060 CD GLN B 186 11.940 0.518 1.009 1.00 33.34 C ATOM 1061 OE1 GLN B 186 11.236 0.280 1.987 1.00 41.14 O ATOM 1062 NE2 GLN B 186 12.504 -0.428 0.327 1.00 12.44 N ATOM 0 H GLN B 186 10.272 3.983 -1.054 1.00 51.04 H new ATOM 0 HA GLN B 186 9.715 1.694 0.360 1.00 13.34 H new ATOM 0 HB2 GLN B 186 11.595 3.957 0.700 1.00 3.31 H new ATOM 0 HB3 GLN B 186 11.297 3.020 2.151 1.00 3.31 H new ATOM 0 HG2 GLN B 186 12.390 1.995 -0.481 1.00 30.13 H new ATOM 0 HG3 GLN B 186 13.272 2.200 1.019 1.00 30.13 H new ATOM 0 HE21 GLN B 186 13.083 -0.199 -0.481 1.00 12.44 H new ATOM 0 HE22 GLN B 186 12.369 -1.402 0.598 1.00 12.44 H new ATOM 1071 N LYS B 187 8.580 4.385 1.909 1.00 22.52 N ATOM 1072 CA LYS B 187 7.706 4.827 2.992 1.00 74.33 C ATOM 1073 C LYS B 187 6.326 4.230 2.755 1.00 72.42 C ATOM 1074 O LYS B 187 5.734 3.638 3.652 1.00 44.24 O ATOM 1075 CB LYS B 187 7.588 6.372 2.995 1.00 51.52 C ATOM 1076 CG LYS B 187 7.255 7.048 4.360 1.00 61.53 C ATOM 1077 CD LYS B 187 5.956 6.572 5.037 1.00 22.21 C ATOM 1078 CE LYS B 187 4.689 6.841 4.217 1.00 31.44 C ATOM 1079 NZ LYS B 187 4.473 8.273 3.922 1.00 31.33 N1+ ATOM 0 H LYS B 187 8.895 5.128 1.285 1.00 22.52 H new ATOM 0 HA LYS B 187 8.116 4.504 3.949 1.00 74.33 H new ATOM 0 HB2 LYS B 187 8.529 6.785 2.632 1.00 51.52 H new ATOM 0 HB3 LYS B 187 6.817 6.655 2.278 1.00 51.52 H new ATOM 0 HG2 LYS B 187 8.085 6.873 5.044 1.00 61.53 H new ATOM 0 HG3 LYS B 187 7.190 8.125 4.206 1.00 61.53 H new ATOM 0 HD2 LYS B 187 6.031 5.502 5.230 1.00 22.21 H new ATOM 0 HD3 LYS B 187 5.861 7.065 6.005 1.00 22.21 H new ATOM 0 HE2 LYS B 187 4.749 6.289 3.279 1.00 31.44 H new ATOM 0 HE3 LYS B 187 3.826 6.455 4.759 1.00 31.44 H new ATOM 0 HZ1 LYS B 187 3.522 8.553 4.237 1.00 31.33 H new ATOM 0 HZ2 LYS B 187 5.185 8.842 4.423 1.00 31.33 H new ATOM 0 HZ3 LYS B 187 4.560 8.433 2.898 1.00 31.33 H new ATOM 1093 N GLU B 188 5.857 4.373 1.527 1.00 1.40 N ATOM 1094 CA GLU B 188 4.514 3.972 1.126 1.00 41.11 C ATOM 1095 C GLU B 188 4.331 2.443 1.209 1.00 55.30 C ATOM 1096 O GLU B 188 3.296 1.955 1.649 1.00 1.32 O ATOM 1097 CB GLU B 188 4.231 4.451 -0.303 1.00 0.21 C ATOM 1098 CG GLU B 188 4.534 5.933 -0.577 1.00 71.14 C ATOM 1099 CD GLU B 188 3.869 6.903 0.389 1.00 11.41 C ATOM 1100 OE1 GLU B 188 2.635 7.050 0.375 1.00 31.44 O ATOM 1101 OE2 GLU B 188 4.595 7.579 1.153 1.00 62.41 O1- ATOM 0 H GLU B 188 6.405 4.777 0.767 1.00 1.40 H new ATOM 0 HA GLU B 188 3.807 4.434 1.815 1.00 41.11 H new ATOM 0 HB2 GLU B 188 4.817 3.845 -0.993 1.00 0.21 H new ATOM 0 HB3 GLU B 188 3.181 4.265 -0.528 1.00 0.21 H new ATOM 0 HG2 GLU B 188 5.613 6.083 -0.538 1.00 71.14 H new ATOM 0 HG3 GLU B 188 4.215 6.174 -1.591 1.00 71.14 H new ATOM 1108 N ALA B 189 5.351 1.709 0.798 1.00 22.15 N ATOM 1109 CA ALA B 189 5.336 0.250 0.826 1.00 34.34 C ATOM 1110 C ALA B 189 5.267 -0.250 2.263 1.00 10.01 C ATOM 1111 O ALA B 189 4.459 -1.111 2.606 1.00 70.11 O ATOM 1112 CB ALA B 189 6.580 -0.300 0.123 1.00 52.44 C ATOM 0 H ALA B 189 6.217 2.106 0.434 1.00 22.15 H new ATOM 0 HA ALA B 189 4.452 -0.105 0.297 1.00 34.34 H new ATOM 0 HB1 ALA B 189 6.561 -1.390 0.149 1.00 52.44 H new ATOM 0 HB2 ALA B 189 6.592 0.038 -0.913 1.00 52.44 H new ATOM 0 HB3 ALA B 189 7.474 0.059 0.632 1.00 52.44 H new ATOM 1118 N GLN B 190 6.097 0.323 3.104 1.00 64.45 N ATOM 1119 CA GLN B 190 6.134 -0.022 4.504 1.00 73.23 C ATOM 1120 C GLN B 190 4.887 0.433 5.251 1.00 61.30 C ATOM 1121 O GLN B 190 4.609 -0.073 6.317 1.00 21.21 O ATOM 1122 CB GLN B 190 7.389 0.508 5.167 1.00 2.33 C ATOM 1123 CG GLN B 190 8.654 -0.071 4.589 1.00 20.12 C ATOM 1124 CD GLN B 190 9.891 0.457 5.266 1.00 2.31 C ATOM 1125 OE1 GLN B 190 10.373 -0.107 6.254 1.00 32.22 O ATOM 1126 NE2 GLN B 190 10.423 1.518 4.741 1.00 62.14 N ATOM 0 H GLN B 190 6.767 1.043 2.834 1.00 64.45 H new ATOM 0 HA GLN B 190 6.154 -1.111 4.556 1.00 73.23 H new ATOM 0 HB2 GLN B 190 7.415 1.593 5.067 1.00 2.33 H new ATOM 0 HB3 GLN B 190 7.350 0.287 6.234 1.00 2.33 H new ATOM 0 HG2 GLN B 190 8.628 -1.157 4.682 1.00 20.12 H new ATOM 0 HG3 GLN B 190 8.701 0.157 3.524 1.00 20.12 H new ATOM 0 HE21 GLN B 190 9.993 1.953 3.925 1.00 62.14 H new ATOM 0 HE22 GLN B 190 11.271 1.916 5.145 1.00 62.14 H new ATOM 1135 N GLU B 191 4.156 1.386 4.684 1.00 20.43 N ATOM 1136 CA GLU B 191 2.984 1.978 5.328 1.00 21.04 C ATOM 1137 C GLU B 191 1.947 0.895 5.674 1.00 11.53 C ATOM 1138 O GLU B 191 1.691 0.644 6.846 1.00 43.14 O ATOM 1139 CB GLU B 191 2.398 3.077 4.411 1.00 13.23 C ATOM 1140 CG GLU B 191 1.530 4.130 5.094 1.00 73.14 C ATOM 1141 CD GLU B 191 0.159 3.688 5.514 1.00 25.30 C ATOM 1142 OE1 GLU B 191 -0.791 3.799 4.705 1.00 63.00 O ATOM 1143 OE2 GLU B 191 -0.005 3.311 6.693 1.00 14.54 O1- ATOM 0 H GLU B 191 4.358 1.773 3.762 1.00 20.43 H new ATOM 0 HA GLU B 191 3.277 2.442 6.270 1.00 21.04 H new ATOM 0 HB2 GLU B 191 3.224 3.584 3.913 1.00 13.23 H new ATOM 0 HB3 GLU B 191 1.805 2.595 3.634 1.00 13.23 H new ATOM 0 HG2 GLU B 191 2.059 4.490 5.976 1.00 73.14 H new ATOM 0 HG3 GLU B 191 1.424 4.978 4.417 1.00 73.14 H new ATOM 1150 N ALA B 192 1.435 0.193 4.673 1.00 12.05 N ATOM 1151 CA ALA B 192 0.419 -0.845 4.933 1.00 52.44 C ATOM 1152 C ALA B 192 1.054 -2.062 5.614 1.00 63.31 C ATOM 1153 O ALA B 192 0.385 -2.783 6.360 1.00 62.12 O ATOM 1154 CB ALA B 192 -0.298 -1.269 3.642 1.00 12.11 C ATOM 0 H ALA B 192 1.691 0.310 3.693 1.00 12.05 H new ATOM 0 HA ALA B 192 -0.326 -0.416 5.603 1.00 52.44 H new ATOM 0 HB1 ALA B 192 -1.039 -2.035 3.872 1.00 12.11 H new ATOM 0 HB2 ALA B 192 -0.794 -0.405 3.201 1.00 12.11 H new ATOM 0 HB3 ALA B 192 0.430 -1.669 2.936 1.00 12.11 H new ATOM 1160 N LEU B 193 2.355 -2.245 5.365 1.00 21.32 N ATOM 1161 CA LEU B 193 3.162 -3.328 5.916 1.00 65.15 C ATOM 1162 C LEU B 193 3.040 -3.287 7.418 1.00 0.51 C ATOM 1163 O LEU B 193 2.585 -4.228 8.061 1.00 31.01 O ATOM 1164 CB LEU B 193 4.615 -3.034 5.518 1.00 24.10 C ATOM 1165 CG LEU B 193 5.698 -4.077 5.793 1.00 35.55 C ATOM 1166 CD1 LEU B 193 6.844 -3.893 4.807 1.00 41.22 C ATOM 1167 CD2 LEU B 193 6.237 -3.866 7.189 1.00 3.03 C ATOM 0 H LEU B 193 2.887 -1.623 4.756 1.00 21.32 H new ATOM 0 HA LEU B 193 2.845 -4.305 5.551 1.00 65.15 H new ATOM 0 HB2 LEU B 193 4.625 -2.828 4.448 1.00 24.10 H new ATOM 0 HB3 LEU B 193 4.912 -2.115 6.022 1.00 24.10 H new ATOM 0 HG LEU B 193 5.274 -5.076 5.691 1.00 35.55 H new ATOM 0 HD11 LEU B 193 7.616 -4.637 5.004 1.00 41.22 H new ATOM 0 HD12 LEU B 193 6.472 -4.016 3.790 1.00 41.22 H new ATOM 0 HD13 LEU B 193 7.265 -2.894 4.921 1.00 41.22 H new ATOM 0 HD21 LEU B 193 7.011 -4.605 7.396 1.00 3.03 H new ATOM 0 HD22 LEU B 193 6.661 -2.865 7.268 1.00 3.03 H new ATOM 0 HD23 LEU B 193 5.428 -3.975 7.912 1.00 3.03 H new ATOM 1179 N GLU B 194 3.418 -2.157 7.921 1.00 32.42 N ATOM 1180 CA GLU B 194 3.430 -1.793 9.229 1.00 1.13 C ATOM 1181 C GLU B 194 2.090 -1.996 9.903 1.00 25.31 C ATOM 1182 O GLU B 194 1.968 -2.664 10.925 1.00 45.10 O ATOM 1183 CB GLU B 194 3.717 -0.337 9.148 1.00 42.50 C ATOM 1184 CG GLU B 194 3.576 0.281 10.441 1.00 61.52 C ATOM 1185 CD GLU B 194 4.029 1.699 10.540 1.00 43.35 C ATOM 1186 OE1 GLU B 194 3.297 2.595 10.102 1.00 73.13 O ATOM 1187 OE2 GLU B 194 5.110 1.955 11.110 1.00 14.30 O1- ATOM 0 H GLU B 194 3.759 -1.406 7.321 1.00 32.42 H new ATOM 0 HA GLU B 194 4.142 -2.379 9.810 1.00 1.13 H new ATOM 0 HB2 GLU B 194 4.728 -0.181 8.773 1.00 42.50 H new ATOM 0 HB3 GLU B 194 3.037 0.134 8.438 1.00 42.50 H new ATOM 0 HG2 GLU B 194 2.527 0.234 10.732 1.00 61.52 H new ATOM 0 HG3 GLU B 194 4.134 -0.310 11.167 1.00 61.52 H new ATOM 1194 N LYS B 195 1.132 -1.374 9.322 1.00 35.45 N ATOM 1195 CA LYS B 195 -0.184 -1.298 9.801 1.00 0.22 C ATOM 1196 C LYS B 195 -0.891 -2.650 9.943 1.00 34.32 C ATOM 1197 O LYS B 195 -1.780 -2.787 10.795 1.00 24.42 O ATOM 1198 CB LYS B 195 -0.951 -0.369 8.916 1.00 52.22 C ATOM 1199 CG LYS B 195 -0.442 1.065 8.880 1.00 23.11 C ATOM 1200 CD LYS B 195 -0.367 1.721 10.244 1.00 42.32 C ATOM 1201 CE LYS B 195 -0.121 3.217 10.098 1.00 61.10 C ATOM 1202 NZ LYS B 195 0.983 3.515 9.155 1.00 34.23 N1+ ATOM 0 H LYS B 195 1.262 -0.874 8.442 1.00 35.45 H new ATOM 0 HA LYS B 195 -0.140 -0.916 10.821 1.00 0.22 H new ATOM 0 HB2 LYS B 195 -0.938 -0.767 7.901 1.00 52.22 H new ATOM 0 HB3 LYS B 195 -1.991 -0.360 9.242 1.00 52.22 H new ATOM 0 HG2 LYS B 195 0.549 1.078 8.426 1.00 23.11 H new ATOM 0 HG3 LYS B 195 -1.095 1.656 8.238 1.00 23.11 H new ATOM 0 HD2 LYS B 195 -1.295 1.550 10.789 1.00 42.32 H new ATOM 0 HD3 LYS B 195 0.434 1.269 10.829 1.00 42.32 H new ATOM 0 HE2 LYS B 195 -1.034 3.701 9.750 1.00 61.10 H new ATOM 0 HE3 LYS B 195 0.113 3.642 11.074 1.00 61.10 H new ATOM 0 HZ1 LYS B 195 1.227 4.524 9.214 1.00 34.23 H new ATOM 0 HZ2 LYS B 195 1.815 2.942 9.403 1.00 34.23 H new ATOM 0 HZ3 LYS B 195 0.682 3.288 8.186 1.00 34.23 H new ATOM 1216 N LEU B 196 -0.547 -3.632 9.122 1.00 42.45 N ATOM 1217 CA LEU B 196 -1.130 -4.894 9.256 1.00 65.11 C ATOM 1218 C LEU B 196 -0.406 -5.694 10.317 1.00 32.01 C ATOM 1219 O LEU B 196 -1.021 -6.499 11.025 1.00 22.43 O ATOM 1220 CB LEU B 196 -1.116 -5.607 7.918 1.00 75.42 C ATOM 1221 CG LEU B 196 0.200 -6.179 7.376 1.00 24.30 C ATOM 1222 CD1 LEU B 196 0.337 -7.649 7.759 1.00 63.01 C ATOM 1223 CD2 LEU B 196 0.281 -5.984 5.867 1.00 63.35 C ATOM 0 H LEU B 196 0.135 -3.547 8.368 1.00 42.45 H new ATOM 0 HA LEU B 196 -2.167 -4.785 9.574 1.00 65.11 H new ATOM 0 HB2 LEU B 196 -1.828 -6.430 7.980 1.00 75.42 H new ATOM 0 HB3 LEU B 196 -1.499 -4.910 7.173 1.00 75.42 H new ATOM 0 HG LEU B 196 1.033 -5.639 7.826 1.00 24.30 H new ATOM 0 HD11 LEU B 196 1.276 -8.041 7.367 1.00 63.01 H new ATOM 0 HD12 LEU B 196 0.329 -7.744 8.845 1.00 63.01 H new ATOM 0 HD13 LEU B 196 -0.495 -8.214 7.339 1.00 63.01 H new ATOM 0 HD21 LEU B 196 1.220 -6.395 5.497 1.00 63.35 H new ATOM 0 HD22 LEU B 196 -0.553 -6.497 5.389 1.00 63.35 H new ATOM 0 HD23 LEU B 196 0.234 -4.920 5.635 1.00 63.35 H new ATOM 1235 N GLN B 197 0.889 -5.453 10.431 1.00 54.12 N ATOM 1236 CA GLN B 197 1.718 -6.173 11.359 1.00 1.52 C ATOM 1237 C GLN B 197 1.335 -5.875 12.800 1.00 14.31 C ATOM 1238 O GLN B 197 1.040 -4.729 13.156 1.00 23.34 O ATOM 1239 CB GLN B 197 3.203 -5.896 11.145 1.00 12.04 C ATOM 1240 CG GLN B 197 3.759 -6.440 9.847 1.00 14.33 C ATOM 1241 CD GLN B 197 5.231 -6.144 9.673 1.00 33.32 C ATOM 1242 OE1 GLN B 197 5.749 -5.138 10.167 1.00 54.42 O ATOM 1243 NE2 GLN B 197 5.914 -6.994 8.966 1.00 34.25 N ATOM 0 H GLN B 197 1.386 -4.753 9.881 1.00 54.12 H new ATOM 0 HA GLN B 197 1.544 -7.231 11.164 1.00 1.52 H new ATOM 0 HB2 GLN B 197 3.367 -4.819 11.173 1.00 12.04 H new ATOM 0 HB3 GLN B 197 3.764 -6.326 11.975 1.00 12.04 H new ATOM 0 HG2 GLN B 197 3.603 -7.518 9.813 1.00 14.33 H new ATOM 0 HG3 GLN B 197 3.205 -6.012 9.012 1.00 14.33 H new ATOM 0 HE21 GLN B 197 5.455 -7.815 8.572 1.00 34.25 H new ATOM 0 HE22 GLN B 197 6.909 -6.840 8.805 1.00 34.25 H new ATOM 1252 N SER B 198 1.320 -6.895 13.605 1.00 33.54 N ATOM 1253 CA SER B 198 0.984 -6.768 14.992 1.00 12.43 C ATOM 1254 C SER B 198 2.226 -6.404 15.804 1.00 1.54 C ATOM 1255 O SER B 198 3.352 -6.775 15.441 1.00 24.20 O ATOM 1256 CB SER B 198 0.378 -8.082 15.488 1.00 25.00 C ATOM 1257 OG SER B 198 -0.757 -8.448 14.694 1.00 4.45 O ATOM 0 H SER B 198 1.543 -7.847 13.315 1.00 33.54 H new ATOM 0 HA SER B 198 0.252 -5.970 15.118 1.00 12.43 H new ATOM 0 HB2 SER B 198 1.127 -8.872 15.446 1.00 25.00 H new ATOM 0 HB3 SER B 198 0.080 -7.980 16.532 1.00 25.00 H new ATOM 0 HG SER B 198 -1.130 -9.292 15.025 1.00 4.45 H new ATOM 1263 N HIS B 199 2.020 -5.682 16.866 1.00 64.41 N ATOM 1264 CA HIS B 199 3.075 -5.268 17.751 1.00 72.30 C ATOM 1265 C HIS B 199 2.497 -5.146 19.137 1.00 63.44 C ATOM 1266 O HIS B 199 1.848 -4.126 19.430 1.00 64.51 O ATOM 1267 CB HIS B 199 3.700 -3.935 17.309 1.00 55.12 C ATOM 1268 CG HIS B 199 4.809 -3.455 18.211 1.00 44.44 C ATOM 1269 ND1 HIS B 199 4.719 -2.318 18.978 1.00 1.01 N ATOM 1270 CD2 HIS B 199 6.036 -3.965 18.454 1.00 11.40 C ATOM 1271 CE1 HIS B 199 5.836 -2.153 19.646 1.00 1.32 C ATOM 1272 NE2 HIS B 199 6.649 -3.134 19.349 1.00 12.31 N ATOM 0 H HIS B 199 1.096 -5.356 17.149 1.00 64.41 H new ATOM 0 HA HIS B 199 3.873 -6.010 17.732 1.00 72.30 H new ATOM 0 HB2 HIS B 199 4.089 -4.045 16.297 1.00 55.12 H new ATOM 0 HB3 HIS B 199 2.921 -3.174 17.270 1.00 55.12 H new ATOM 0 HD2 HIS B 199 6.454 -4.862 18.022 1.00 11.40 H new ATOM 0 HE1 HIS B 199 6.049 -1.343 20.327 1.00 1.32 H new ATOM 0 HE2 HIS B 199 7.589 -3.259 19.725 1.00 12.31 H new TER 1281 HIS B 199