USER MOD reduce.3.24.130724 H: found=0, std=0, add=828, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 831 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 91 TYR OH : rot 161:sc= 0.787 USER MOD Set 1.2: A 102 GLN :FLIP amide:sc= -0.275 F(o=-4.6!,f=0.51) USER MOD Set 2.1: A 81 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 82 HIS : no HD1:sc= -2.13! C(o=-2.1!,f=-3.7!) USER MOD Single : A 31 SER OG : rot 180:sc= -0.0335 USER MOD Single : A 32 ASN : amide:sc= -0.0561 X(o=-0.056,f=-0.035) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 170:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 HIS : no HD1:sc= -4.61! C(o=-4.6!,f=-5.4!) USER MOD Single : A 51 THR OG1 : rot -170:sc= -2.72! USER MOD Single : A 63 LYS NZ :NH3+ 161:sc= -1.71! (180deg=-2.47!) USER MOD Single : A 64 GLN : amide:sc= -0.166 X(o=-0.17,f=-0.28) USER MOD Single : A 67 GLN : amide:sc= -0.0231 K(o=-0.023,f=-1.3!) USER MOD Single : A 68 HIS : no HD1:sc= -0.54 K(o=-0.54,f=-1.7) USER MOD Single : A 71 GLN : amide:sc=-0.00685 K(o=-0.0069,f=-1.1) USER MOD Single : A 73 CYS SG : rot 40:sc= 0.486 USER MOD Single : A 76 GLN : amide:sc= -3.44! C(o=-3.4!,f=-4.8!) USER MOD Single : A 89 MET CE :methyl -172:sc= -0.862 (180deg=-1.29) USER MOD Single : A 108 GLN : amide:sc= -0.833 K(o=-0.83,f=-1.9!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 106:sc= 0.524 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 76:sc= 0.272 USER MOD Single : A 120 GLN : amide:sc= -0.0874 K(o=-0.087,f=-0.71) USER MOD Single : A 131 SER OG : rot 29:sc= -1.73 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 30 7.593 10.336 -10.480 1.00 1.00 N ATOM 2 CA GLY A 30 6.517 10.490 -11.501 1.00 1.00 C ATOM 3 C GLY A 30 7.110 10.309 -12.894 1.00 1.00 C ATOM 4 O GLY A 30 6.826 11.087 -13.806 1.00 1.00 O ATOM 0 HA2 GLY A 30 5.731 9.755 -11.330 1.00 1.00 H new ATOM 0 HA3 GLY A 30 6.057 11.474 -11.415 1.00 1.00 H new ATOM 10 N SER A 31 7.936 9.279 -13.052 1.00 1.00 N ATOM 11 CA SER A 31 8.564 9.009 -14.339 1.00 1.00 C ATOM 12 C SER A 31 7.508 8.729 -15.401 1.00 1.00 C ATOM 13 O SER A 31 7.614 9.198 -16.535 1.00 1.00 O ATOM 14 CB SER A 31 9.500 7.807 -14.221 1.00 1.00 C ATOM 15 OG SER A 31 8.755 6.673 -13.793 1.00 1.00 O ATOM 0 H SER A 31 8.184 8.623 -12.311 1.00 1.00 H new ATOM 0 HA SER A 31 9.137 9.888 -14.634 1.00 1.00 H new ATOM 0 HB2 SER A 31 9.974 7.604 -15.182 1.00 1.00 H new ATOM 0 HB3 SER A 31 10.299 8.021 -13.511 1.00 1.00 H new ATOM 0 HG SER A 31 9.352 5.899 -13.718 1.00 1.00 H new ATOM 21 N ASN A 32 6.486 7.958 -15.028 1.00 1.00 N ATOM 22 CA ASN A 32 5.404 7.614 -15.953 1.00 1.00 C ATOM 23 C ASN A 32 4.051 7.740 -15.265 1.00 1.00 C ATOM 24 O ASN A 32 3.849 7.218 -14.168 1.00 1.00 O ATOM 25 CB ASN A 32 5.592 6.184 -16.465 1.00 1.00 C ATOM 26 CG ASN A 32 6.826 6.109 -17.357 1.00 1.00 C ATOM 27 OD1 ASN A 32 7.760 5.363 -17.067 1.00 1.00 O ATOM 28 ND2 ASN A 32 6.885 6.843 -18.436 1.00 1.00 N ATOM 0 H ASN A 32 6.384 7.560 -14.094 1.00 1.00 H new ATOM 0 HA ASN A 32 5.434 8.307 -16.794 1.00 1.00 H new ATOM 0 HB2 ASN A 32 5.698 5.499 -15.624 1.00 1.00 H new ATOM 0 HB3 ASN A 32 4.710 5.869 -17.023 1.00 1.00 H new ATOM 0 HD21 ASN A 32 7.706 6.798 -19.039 1.00 1.00 H new ATOM 0 HD22 ASN A 32 6.110 7.461 -18.675 1.00 1.00 H new ATOM 35 N SER A 33 3.126 8.438 -15.917 1.00 1.00 N ATOM 36 CA SER A 33 1.794 8.628 -15.360 1.00 1.00 C ATOM 37 C SER A 33 0.963 7.361 -15.528 1.00 1.00 C ATOM 38 O SER A 33 1.255 6.525 -16.382 1.00 1.00 O ATOM 39 CB SER A 33 1.097 9.795 -16.059 1.00 1.00 C ATOM 40 OG SER A 33 0.852 9.450 -17.417 1.00 1.00 O ATOM 0 H SER A 33 3.274 8.878 -16.825 1.00 1.00 H new ATOM 0 HA SER A 33 1.891 8.850 -14.297 1.00 1.00 H new ATOM 0 HB2 SER A 33 0.159 10.027 -15.556 1.00 1.00 H new ATOM 0 HB3 SER A 33 1.718 10.689 -16.005 1.00 1.00 H new ATOM 0 HG SER A 33 0.403 10.195 -17.868 1.00 1.00 H new ATOM 46 N GLY A 34 -0.078 7.228 -14.711 1.00 1.00 N ATOM 47 CA GLY A 34 -0.952 6.059 -14.778 1.00 1.00 C ATOM 48 C GLY A 34 -1.550 5.751 -13.412 1.00 1.00 C ATOM 49 O GLY A 34 -2.703 6.083 -13.140 1.00 1.00 O ATOM 0 H GLY A 34 -0.337 7.910 -13.998 1.00 1.00 H new ATOM 0 HA2 GLY A 34 -1.751 6.238 -15.498 1.00 1.00 H new ATOM 0 HA3 GLY A 34 -0.388 5.198 -15.135 1.00 1.00 H new ATOM 53 N GLU A 35 -0.757 5.114 -12.552 1.00 1.00 N ATOM 54 CA GLU A 35 -1.212 4.761 -11.207 1.00 1.00 C ATOM 55 C GLU A 35 -0.142 5.098 -10.182 1.00 1.00 C ATOM 56 O GLU A 35 1.007 4.671 -10.301 1.00 1.00 O ATOM 57 CB GLU A 35 -1.524 3.266 -11.139 1.00 1.00 C ATOM 58 CG GLU A 35 -2.732 2.960 -12.024 1.00 1.00 C ATOM 59 CD GLU A 35 -3.052 1.470 -11.970 1.00 1.00 C ATOM 60 OE1 GLU A 35 -2.449 0.727 -12.727 1.00 1.00 O ATOM 61 OE2 GLU A 35 -3.894 1.094 -11.172 1.00 1.00 O ATOM 0 H GLU A 35 0.201 4.832 -12.761 1.00 1.00 H new ATOM 0 HA GLU A 35 -2.113 5.333 -10.985 1.00 1.00 H new ATOM 0 HB2 GLU A 35 -0.661 2.688 -11.469 1.00 1.00 H new ATOM 0 HB3 GLU A 35 -1.729 2.972 -10.110 1.00 1.00 H new ATOM 0 HG2 GLU A 35 -3.594 3.538 -11.690 1.00 1.00 H new ATOM 0 HG3 GLU A 35 -2.526 3.259 -13.052 1.00 1.00 H new ATOM 68 N GLU A 36 -0.531 5.869 -9.174 1.00 1.00 N ATOM 69 CA GLU A 36 0.392 6.274 -8.114 1.00 1.00 C ATOM 70 C GLU A 36 0.082 5.558 -6.822 1.00 1.00 C ATOM 71 O GLU A 36 0.419 6.040 -5.737 1.00 1.00 O ATOM 72 CB GLU A 36 0.298 7.766 -7.878 1.00 1.00 C ATOM 73 CG GLU A 36 -1.056 8.148 -7.263 1.00 1.00 C ATOM 74 CD GLU A 36 -2.175 7.849 -8.252 1.00 1.00 C ATOM 75 OE1 GLU A 36 -1.931 7.964 -9.442 1.00 1.00 O ATOM 76 OE2 GLU A 36 -3.256 7.498 -7.808 1.00 1.00 O ATOM 0 H GLU A 36 -1.480 6.228 -9.066 1.00 1.00 H new ATOM 0 HA GLU A 36 1.400 6.011 -8.436 1.00 1.00 H new ATOM 0 HB2 GLU A 36 1.103 8.083 -7.216 1.00 1.00 H new ATOM 0 HB3 GLU A 36 0.434 8.295 -8.821 1.00 1.00 H new ATOM 0 HG2 GLU A 36 -1.216 7.592 -6.340 1.00 1.00 H new ATOM 0 HG3 GLU A 36 -1.062 9.206 -7.002 1.00 1.00 H new ATOM 83 N ALA A 37 -0.563 4.424 -6.941 1.00 1.00 N ATOM 84 CA ALA A 37 -0.929 3.628 -5.768 1.00 1.00 C ATOM 85 C ALA A 37 0.322 3.176 -5.020 1.00 1.00 C ATOM 86 O ALA A 37 0.310 2.149 -4.338 1.00 1.00 O ATOM 87 CB ALA A 37 -1.734 2.397 -6.190 1.00 1.00 C ATOM 0 H ALA A 37 -0.851 4.021 -7.833 1.00 1.00 H new ATOM 0 HA ALA A 37 -1.537 4.251 -5.112 1.00 1.00 H new ATOM 0 HB1 ALA A 37 -1.999 1.815 -5.307 1.00 1.00 H new ATOM 0 HB2 ALA A 37 -2.643 2.714 -6.701 1.00 1.00 H new ATOM 0 HB3 ALA A 37 -1.135 1.783 -6.863 1.00 1.00 H new ATOM 93 N GLU A 38 1.404 3.943 -5.154 1.00 1.00 N ATOM 94 CA GLU A 38 2.665 3.613 -4.495 1.00 1.00 C ATOM 95 C GLU A 38 3.399 4.881 -4.084 1.00 1.00 C ATOM 96 O GLU A 38 4.629 4.906 -4.026 1.00 1.00 O ATOM 97 CB GLU A 38 3.554 2.793 -5.433 1.00 1.00 C ATOM 98 CG GLU A 38 2.955 1.397 -5.617 1.00 1.00 C ATOM 99 CD GLU A 38 3.841 0.569 -6.541 1.00 1.00 C ATOM 100 OE1 GLU A 38 4.890 1.061 -6.922 1.00 1.00 O ATOM 101 OE2 GLU A 38 3.459 -0.548 -6.849 1.00 1.00 O ATOM 0 H GLU A 38 1.431 4.796 -5.713 1.00 1.00 H new ATOM 0 HA GLU A 38 2.441 3.026 -3.604 1.00 1.00 H new ATOM 0 HB2 GLU A 38 3.641 3.293 -6.398 1.00 1.00 H new ATOM 0 HB3 GLU A 38 4.561 2.717 -5.022 1.00 1.00 H new ATOM 0 HG2 GLU A 38 2.860 0.902 -4.650 1.00 1.00 H new ATOM 0 HG3 GLU A 38 1.951 1.475 -6.035 1.00 1.00 H new ATOM 108 N GLU A 39 2.638 5.937 -3.797 1.00 1.00 N ATOM 109 CA GLU A 39 3.218 7.219 -3.385 1.00 1.00 C ATOM 110 C GLU A 39 2.540 7.734 -2.121 1.00 1.00 C ATOM 111 O GLU A 39 1.801 8.719 -2.155 1.00 1.00 O ATOM 112 CB GLU A 39 3.058 8.247 -4.505 1.00 1.00 C ATOM 113 CG GLU A 39 3.995 7.890 -5.661 1.00 1.00 C ATOM 114 CD GLU A 39 3.777 8.858 -6.820 1.00 1.00 C ATOM 115 OE1 GLU A 39 2.961 9.752 -6.673 1.00 1.00 O ATOM 116 OE2 GLU A 39 4.430 8.690 -7.836 1.00 1.00 O ATOM 0 H GLU A 39 1.619 5.932 -3.842 1.00 1.00 H new ATOM 0 HA GLU A 39 4.277 7.067 -3.178 1.00 1.00 H new ATOM 0 HB2 GLU A 39 2.025 8.265 -4.852 1.00 1.00 H new ATOM 0 HB3 GLU A 39 3.286 9.246 -4.132 1.00 1.00 H new ATOM 0 HG2 GLU A 39 5.032 7.935 -5.328 1.00 1.00 H new ATOM 0 HG3 GLU A 39 3.809 6.867 -5.989 1.00 1.00 H new ATOM 123 N TRP A 40 2.811 7.069 -1.007 1.00 1.00 N ATOM 124 CA TRP A 40 2.238 7.465 0.274 1.00 1.00 C ATOM 125 C TRP A 40 3.114 8.520 0.935 1.00 1.00 C ATOM 126 O TRP A 40 2.628 9.558 1.380 1.00 1.00 O ATOM 127 CB TRP A 40 2.105 6.239 1.193 1.00 1.00 C ATOM 128 CG TRP A 40 3.262 5.319 0.977 1.00 1.00 C ATOM 129 CD1 TRP A 40 3.431 4.525 -0.105 1.00 1.00 C ATOM 130 CD2 TRP A 40 4.400 5.068 1.848 1.00 1.00 C ATOM 131 NE1 TRP A 40 4.609 3.818 0.038 1.00 1.00 N ATOM 132 CE2 TRP A 40 5.240 4.113 1.229 1.00 1.00 C ATOM 133 CE3 TRP A 40 4.784 5.572 3.102 1.00 1.00 C ATOM 134 CZ2 TRP A 40 6.417 3.675 1.833 1.00 1.00 C ATOM 135 CZ3 TRP A 40 5.968 5.130 3.713 1.00 1.00 C ATOM 136 CH2 TRP A 40 6.781 4.184 3.079 1.00 1.00 C ATOM 0 H TRP A 40 3.423 6.254 -0.963 1.00 1.00 H new ATOM 0 HA TRP A 40 1.248 7.887 0.102 1.00 1.00 H new ATOM 0 HB2 TRP A 40 2.070 6.556 2.235 1.00 1.00 H new ATOM 0 HB3 TRP A 40 1.170 5.718 0.987 1.00 1.00 H new ATOM 0 HD1 TRP A 40 2.755 4.455 -0.944 1.00 1.00 H new ATOM 0 HE1 TRP A 40 4.968 3.159 -0.652 1.00 1.00 H new ATOM 0 HE3 TRP A 40 4.164 6.304 3.599 1.00 1.00 H new ATOM 0 HZ2 TRP A 40 7.043 2.946 1.339 1.00 1.00 H new ATOM 0 HZ3 TRP A 40 6.253 5.522 4.678 1.00 1.00 H new ATOM 0 HH2 TRP A 40 7.690 3.848 3.555 1.00 1.00 H new ATOM 147 N LEU A 41 4.404 8.242 1.006 1.00 1.00 N ATOM 148 CA LEU A 41 5.333 9.169 1.633 1.00 1.00 C ATOM 149 C LEU A 41 5.353 10.485 0.867 1.00 1.00 C ATOM 150 O LEU A 41 5.502 11.563 1.438 1.00 1.00 O ATOM 151 CB LEU A 41 6.746 8.547 1.684 1.00 1.00 C ATOM 152 CG LEU A 41 7.491 9.007 2.951 1.00 1.00 C ATOM 153 CD1 LEU A 41 7.538 10.540 2.993 1.00 1.00 C ATOM 154 CD2 LEU A 41 6.774 8.459 4.221 1.00 1.00 C ATOM 0 H LEU A 41 4.830 7.390 0.641 1.00 1.00 H new ATOM 0 HA LEU A 41 5.006 9.368 2.653 1.00 1.00 H new ATOM 0 HB2 LEU A 41 6.672 7.460 1.673 1.00 1.00 H new ATOM 0 HB3 LEU A 41 7.310 8.837 0.798 1.00 1.00 H new ATOM 0 HG LEU A 41 8.509 8.618 2.929 1.00 1.00 H new ATOM 0 HD11 LEU A 41 8.066 10.863 3.890 1.00 1.00 H new ATOM 0 HD12 LEU A 41 8.060 10.912 2.111 1.00 1.00 H new ATOM 0 HD13 LEU A 41 6.522 10.935 3.007 1.00 1.00 H new ATOM 0 HD21 LEU A 41 7.308 8.790 5.112 1.00 1.00 H new ATOM 0 HD22 LEU A 41 5.751 8.834 4.251 1.00 1.00 H new ATOM 0 HD23 LEU A 41 6.760 7.370 4.190 1.00 1.00 H new ATOM 166 N SER A 42 5.209 10.381 -0.430 1.00 1.00 N ATOM 167 CA SER A 42 5.230 11.568 -1.278 1.00 1.00 C ATOM 168 C SER A 42 4.179 12.569 -0.814 1.00 1.00 C ATOM 169 O SER A 42 4.373 13.781 -0.914 1.00 1.00 O ATOM 170 CB SER A 42 4.956 11.174 -2.739 1.00 1.00 C ATOM 171 OG SER A 42 3.660 11.620 -3.126 1.00 1.00 O ATOM 0 H SER A 42 5.077 9.500 -0.927 1.00 1.00 H new ATOM 0 HA SER A 42 6.215 12.029 -1.206 1.00 1.00 H new ATOM 0 HB2 SER A 42 5.711 11.613 -3.391 1.00 1.00 H new ATOM 0 HB3 SER A 42 5.027 10.092 -2.853 1.00 1.00 H new ATOM 0 HG SER A 42 3.553 11.512 -4.094 1.00 1.00 H new ATOM 177 N SER A 43 3.062 12.053 -0.313 1.00 1.00 N ATOM 178 CA SER A 43 1.978 12.910 0.153 1.00 1.00 C ATOM 179 C SER A 43 2.523 14.077 0.968 1.00 1.00 C ATOM 180 O SER A 43 1.897 15.132 1.054 1.00 1.00 O ATOM 181 CB SER A 43 1.000 12.099 1.004 1.00 1.00 C ATOM 182 OG SER A 43 0.022 12.971 1.553 1.00 1.00 O ATOM 0 H SER A 43 2.884 11.053 -0.219 1.00 1.00 H new ATOM 0 HA SER A 43 1.457 13.308 -0.718 1.00 1.00 H new ATOM 0 HB2 SER A 43 0.520 11.332 0.396 1.00 1.00 H new ATOM 0 HB3 SER A 43 1.535 11.584 1.802 1.00 1.00 H new ATOM 0 HG SER A 43 -0.608 12.455 2.098 1.00 1.00 H new ATOM 188 N LEU A 44 3.695 13.880 1.563 1.00 1.00 N ATOM 189 CA LEU A 44 4.332 14.918 2.375 1.00 1.00 C ATOM 190 C LEU A 44 5.785 15.094 1.963 1.00 1.00 C ATOM 191 O LEU A 44 6.331 14.269 1.231 1.00 1.00 O ATOM 192 CB LEU A 44 4.273 14.537 3.856 1.00 1.00 C ATOM 193 CG LEU A 44 4.959 13.160 4.090 1.00 1.00 C ATOM 194 CD1 LEU A 44 5.695 13.157 5.432 1.00 1.00 C ATOM 195 CD2 LEU A 44 3.910 12.040 4.083 1.00 1.00 C ATOM 0 H LEU A 44 4.226 13.011 1.500 1.00 1.00 H new ATOM 0 HA LEU A 44 3.796 15.854 2.217 1.00 1.00 H new ATOM 0 HB2 LEU A 44 4.766 15.303 4.455 1.00 1.00 H new ATOM 0 HB3 LEU A 44 3.235 14.494 4.186 1.00 1.00 H new ATOM 0 HG LEU A 44 5.675 12.990 3.286 1.00 1.00 H new ATOM 0 HD11 LEU A 44 6.171 12.188 5.584 1.00 1.00 H new ATOM 0 HD12 LEU A 44 6.455 13.938 5.432 1.00 1.00 H new ATOM 0 HD13 LEU A 44 4.984 13.342 6.237 1.00 1.00 H new ATOM 0 HD21 LEU A 44 4.401 11.081 4.248 1.00 1.00 H new ATOM 0 HD22 LEU A 44 3.184 12.217 4.876 1.00 1.00 H new ATOM 0 HD23 LEU A 44 3.399 12.026 3.120 1.00 1.00 H new ATOM 207 N ARG A 45 6.409 16.167 2.442 1.00 1.00 N ATOM 208 CA ARG A 45 7.808 16.438 2.123 1.00 1.00 C ATOM 209 C ARG A 45 8.653 16.382 3.384 1.00 1.00 C ATOM 210 O ARG A 45 8.519 17.220 4.275 1.00 1.00 O ATOM 211 CB ARG A 45 7.929 17.817 1.473 1.00 1.00 C ATOM 212 CG ARG A 45 9.320 17.984 0.838 1.00 1.00 C ATOM 213 CD ARG A 45 9.262 19.063 -0.237 1.00 1.00 C ATOM 214 NE ARG A 45 8.555 18.561 -1.406 1.00 1.00 N ATOM 215 CZ ARG A 45 8.360 19.329 -2.471 1.00 1.00 C ATOM 216 NH1 ARG A 45 8.799 20.557 -2.476 1.00 1.00 N ATOM 217 NH2 ARG A 45 7.730 18.856 -3.512 1.00 1.00 N ATOM 0 H ARG A 45 5.971 16.860 3.049 1.00 1.00 H new ATOM 0 HA ARG A 45 8.168 15.680 1.427 1.00 1.00 H new ATOM 0 HB2 ARG A 45 7.157 17.938 0.713 1.00 1.00 H new ATOM 0 HB3 ARG A 45 7.766 18.595 2.219 1.00 1.00 H new ATOM 0 HG2 ARG A 45 10.050 18.255 1.601 1.00 1.00 H new ATOM 0 HG3 ARG A 45 9.649 17.040 0.403 1.00 1.00 H new ATOM 0 HD2 ARG A 45 8.758 19.948 0.151 1.00 1.00 H new ATOM 0 HD3 ARG A 45 10.271 19.367 -0.514 1.00 1.00 H new ATOM 0 HE ARG A 45 8.204 17.603 -1.407 1.00 1.00 H new ATOM 0 HH11 ARG A 45 9.291 20.926 -1.662 1.00 1.00 H new ATOM 0 HH12 ARG A 45 8.650 21.149 -3.294 1.00 1.00 H new ATOM 0 HH21 ARG A 45 7.387 17.895 -3.508 1.00 1.00 H new ATOM 0 HH22 ARG A 45 7.581 19.447 -4.330 1.00 1.00 H new ATOM 231 N ALA A 46 9.524 15.379 3.455 1.00 1.00 N ATOM 232 CA ALA A 46 10.395 15.204 4.614 1.00 1.00 C ATOM 233 C ALA A 46 11.728 15.909 4.391 1.00 1.00 C ATOM 234 O ALA A 46 12.066 16.282 3.268 1.00 1.00 O ATOM 235 CB ALA A 46 10.646 13.705 4.859 1.00 1.00 C ATOM 0 H ALA A 46 9.645 14.676 2.726 1.00 1.00 H new ATOM 0 HA ALA A 46 9.904 15.640 5.484 1.00 1.00 H new ATOM 0 HB1 ALA A 46 11.296 13.582 5.725 1.00 1.00 H new ATOM 0 HB2 ALA A 46 9.697 13.203 5.044 1.00 1.00 H new ATOM 0 HB3 ALA A 46 11.123 13.268 3.982 1.00 1.00 H new ATOM 241 N HIS A 47 12.485 16.070 5.469 1.00 1.00 N ATOM 242 CA HIS A 47 13.788 16.712 5.388 1.00 1.00 C ATOM 243 C HIS A 47 14.758 16.056 6.363 1.00 1.00 C ATOM 244 O HIS A 47 14.506 16.014 7.568 1.00 1.00 O ATOM 245 CB HIS A 47 13.663 18.204 5.714 1.00 1.00 C ATOM 246 CG HIS A 47 14.891 18.931 5.238 1.00 1.00 C ATOM 247 ND1 HIS A 47 15.171 19.100 3.892 1.00 1.00 N ATOM 248 CD2 HIS A 47 15.921 19.531 5.915 1.00 1.00 C ATOM 249 CE1 HIS A 47 16.330 19.776 3.802 1.00 1.00 C ATOM 250 NE2 HIS A 47 16.830 20.064 5.006 1.00 1.00 N ATOM 0 H HIS A 47 12.219 15.766 6.406 1.00 1.00 H new ATOM 0 HA HIS A 47 14.169 16.598 4.373 1.00 1.00 H new ATOM 0 HB2 HIS A 47 12.775 18.618 5.236 1.00 1.00 H new ATOM 0 HB3 HIS A 47 13.540 18.342 6.788 1.00 1.00 H new ATOM 0 HD2 HIS A 47 16.013 19.582 6.990 1.00 1.00 H new ATOM 0 HE1 HIS A 47 16.799 20.052 2.869 1.00 1.00 H new ATOM 0 HE2 HIS A 47 17.693 20.567 5.215 1.00 1.00 H new ATOM 259 N VAL A 48 15.869 15.545 5.837 1.00 1.00 N ATOM 260 CA VAL A 48 16.886 14.891 6.662 1.00 1.00 C ATOM 261 C VAL A 48 18.157 15.740 6.710 1.00 1.00 C ATOM 262 O VAL A 48 18.628 16.232 5.684 1.00 1.00 O ATOM 263 CB VAL A 48 17.211 13.514 6.081 1.00 1.00 C ATOM 264 CG1 VAL A 48 18.409 12.914 6.815 1.00 1.00 C ATOM 265 CG2 VAL A 48 15.999 12.596 6.248 1.00 1.00 C ATOM 0 H VAL A 48 16.089 15.571 4.841 1.00 1.00 H new ATOM 0 HA VAL A 48 16.499 14.778 7.675 1.00 1.00 H new ATOM 0 HB VAL A 48 17.452 13.615 5.023 1.00 1.00 H new ATOM 0 HG11 VAL A 48 18.637 11.933 6.398 1.00 1.00 H new ATOM 0 HG12 VAL A 48 19.273 13.568 6.697 1.00 1.00 H new ATOM 0 HG13 VAL A 48 18.173 12.812 7.874 1.00 1.00 H new ATOM 0 HG21 VAL A 48 16.227 11.613 5.835 1.00 1.00 H new ATOM 0 HG22 VAL A 48 15.760 12.498 7.307 1.00 1.00 H new ATOM 0 HG23 VAL A 48 15.145 13.022 5.721 1.00 1.00 H new ATOM 275 N VAL A 49 18.702 15.908 7.912 1.00 1.00 N ATOM 276 CA VAL A 49 19.914 16.697 8.091 1.00 1.00 C ATOM 277 C VAL A 49 21.121 15.950 7.535 1.00 1.00 C ATOM 278 O VAL A 49 21.297 14.756 7.780 1.00 1.00 O ATOM 279 CB VAL A 49 20.121 16.983 9.581 1.00 1.00 C ATOM 280 CG1 VAL A 49 18.889 17.701 10.147 1.00 1.00 C ATOM 281 CG2 VAL A 49 20.334 15.661 10.314 1.00 1.00 C ATOM 0 H VAL A 49 18.325 15.510 8.772 1.00 1.00 H new ATOM 0 HA VAL A 49 19.808 17.638 7.550 1.00 1.00 H new ATOM 0 HB VAL A 49 20.994 17.622 9.716 1.00 1.00 H new ATOM 0 HG11 VAL A 49 19.041 17.903 11.207 1.00 1.00 H new ATOM 0 HG12 VAL A 49 18.740 18.642 9.616 1.00 1.00 H new ATOM 0 HG13 VAL A 49 18.010 17.070 10.020 1.00 1.00 H new ATOM 0 HG21 VAL A 49 20.482 15.854 11.376 1.00 1.00 H new ATOM 0 HG22 VAL A 49 19.459 15.025 10.179 1.00 1.00 H new ATOM 0 HG23 VAL A 49 21.213 15.159 9.910 1.00 1.00 H new ATOM 291 N ARG A 50 21.944 16.663 6.780 1.00 1.00 N ATOM 292 CA ARG A 50 23.133 16.066 6.180 1.00 1.00 C ATOM 293 C ARG A 50 24.107 15.618 7.258 1.00 1.00 C ATOM 294 O ARG A 50 24.710 14.551 7.157 1.00 1.00 O ATOM 295 CB ARG A 50 23.819 17.074 5.251 1.00 1.00 C ATOM 296 CG ARG A 50 23.015 17.210 3.954 1.00 1.00 C ATOM 297 CD ARG A 50 21.611 17.736 4.267 1.00 1.00 C ATOM 298 NE ARG A 50 21.002 18.298 3.068 1.00 1.00 N ATOM 299 CZ ARG A 50 19.681 18.361 2.933 1.00 1.00 C ATOM 300 NH1 ARG A 50 18.907 17.913 3.883 1.00 1.00 N ATOM 301 NH2 ARG A 50 19.161 18.871 1.852 1.00 1.00 N ATOM 0 H ARG A 50 21.813 17.652 6.568 1.00 1.00 H new ATOM 0 HA ARG A 50 22.825 15.196 5.600 1.00 1.00 H new ATOM 0 HB2 ARG A 50 23.898 18.043 5.744 1.00 1.00 H new ATOM 0 HB3 ARG A 50 24.834 16.746 5.028 1.00 1.00 H new ATOM 0 HG2 ARG A 50 23.524 17.889 3.270 1.00 1.00 H new ATOM 0 HG3 ARG A 50 22.948 16.244 3.454 1.00 1.00 H new ATOM 0 HD2 ARG A 50 20.990 16.928 4.654 1.00 1.00 H new ATOM 0 HD3 ARG A 50 21.666 18.496 5.046 1.00 1.00 H new ATOM 0 HE ARG A 50 21.600 18.649 2.320 1.00 1.00 H new ATOM 0 HH11 ARG A 50 19.316 17.515 4.729 1.00 1.00 H new ATOM 0 HH12 ARG A 50 17.893 17.961 3.780 1.00 1.00 H new ATOM 0 HH21 ARG A 50 19.768 19.221 1.111 1.00 1.00 H new ATOM 0 HH22 ARG A 50 18.148 18.920 1.748 1.00 1.00 H new ATOM 315 N THR A 51 24.256 16.439 8.293 1.00 1.00 N ATOM 316 CA THR A 51 25.162 16.122 9.395 1.00 1.00 C ATOM 317 C THR A 51 24.368 15.662 10.609 1.00 1.00 C ATOM 318 O THR A 51 23.325 16.227 10.933 1.00 1.00 O ATOM 319 CB THR A 51 25.994 17.359 9.758 1.00 1.00 C ATOM 320 OG1 THR A 51 25.156 18.502 9.773 1.00 1.00 O ATOM 321 CG2 THR A 51 27.099 17.559 8.723 1.00 1.00 C ATOM 0 H THR A 51 23.763 17.326 8.393 1.00 1.00 H new ATOM 0 HA THR A 51 25.830 15.319 9.083 1.00 1.00 H new ATOM 0 HB THR A 51 26.440 17.216 10.742 1.00 1.00 H new ATOM 0 HG1 THR A 51 25.706 19.310 9.848 1.00 1.00 H new ATOM 0 HG21 THR A 51 27.688 18.438 8.984 1.00 1.00 H new ATOM 0 HG22 THR A 51 27.745 16.682 8.707 1.00 1.00 H new ATOM 0 HG23 THR A 51 26.654 17.700 7.738 1.00 1.00 H new ATOM 329 N GLY A 52 24.869 14.626 11.273 1.00 1.00 N ATOM 330 CA GLY A 52 24.208 14.080 12.455 1.00 1.00 C ATOM 331 C GLY A 52 23.436 12.819 12.113 1.00 1.00 C ATOM 332 O GLY A 52 23.091 12.040 12.994 1.00 1.00 O ATOM 0 H GLY A 52 25.731 14.147 11.013 1.00 1.00 H new ATOM 0 HA2 GLY A 52 24.951 13.859 13.222 1.00 1.00 H new ATOM 0 HA3 GLY A 52 23.530 14.824 12.873 1.00 1.00 H new ATOM 336 N ILE A 53 23.193 12.607 10.821 1.00 1.00 N ATOM 337 CA ILE A 53 22.472 11.416 10.353 1.00 1.00 C ATOM 338 C ILE A 53 23.374 10.572 9.448 1.00 1.00 C ATOM 339 O ILE A 53 23.163 9.371 9.286 1.00 1.00 O ATOM 340 CB ILE A 53 21.189 11.846 9.595 1.00 1.00 C ATOM 341 CG1 ILE A 53 20.018 12.045 10.585 1.00 1.00 C ATOM 342 CG2 ILE A 53 20.796 10.796 8.544 1.00 1.00 C ATOM 343 CD1 ILE A 53 19.372 10.696 10.934 1.00 1.00 C ATOM 0 H ILE A 53 23.483 13.242 10.077 1.00 1.00 H new ATOM 0 HA ILE A 53 22.187 10.810 11.213 1.00 1.00 H new ATOM 0 HB ILE A 53 21.400 12.789 9.090 1.00 1.00 H new ATOM 0 HG12 ILE A 53 20.380 12.527 11.493 1.00 1.00 H new ATOM 0 HG13 ILE A 53 19.273 12.709 10.147 1.00 1.00 H new ATOM 0 HG21 ILE A 53 19.893 11.120 8.026 1.00 1.00 H new ATOM 0 HG22 ILE A 53 21.606 10.681 7.824 1.00 1.00 H new ATOM 0 HG23 ILE A 53 20.609 9.841 9.036 1.00 1.00 H new ATOM 0 HD11 ILE A 53 18.550 10.856 11.632 1.00 1.00 H new ATOM 0 HD12 ILE A 53 18.991 10.229 10.026 1.00 1.00 H new ATOM 0 HD13 ILE A 53 20.116 10.044 11.393 1.00 1.00 H new ATOM 355 N GLY A 54 24.370 11.197 8.862 1.00 1.00 N ATOM 356 CA GLY A 54 25.268 10.474 7.974 1.00 1.00 C ATOM 357 C GLY A 54 26.154 9.509 8.751 1.00 1.00 C ATOM 358 O GLY A 54 27.315 9.299 8.399 1.00 1.00 O ATOM 0 H GLY A 54 24.582 12.188 8.978 1.00 1.00 H new ATOM 0 HA2 GLY A 54 24.687 9.923 7.235 1.00 1.00 H new ATOM 0 HA3 GLY A 54 25.890 11.182 7.427 1.00 1.00 H new ATOM 362 N ARG A 55 25.601 8.925 9.809 1.00 1.00 N ATOM 363 CA ARG A 55 26.354 7.988 10.631 1.00 1.00 C ATOM 364 C ARG A 55 26.465 6.632 9.936 1.00 1.00 C ATOM 365 O ARG A 55 27.564 6.168 9.643 1.00 1.00 O ATOM 366 CB ARG A 55 25.662 7.820 12.004 1.00 1.00 C ATOM 367 CG ARG A 55 24.163 8.099 11.861 1.00 1.00 C ATOM 368 CD ARG A 55 23.425 7.565 13.084 1.00 1.00 C ATOM 369 NE ARG A 55 23.893 8.241 14.286 1.00 1.00 N ATOM 370 CZ ARG A 55 23.524 7.827 15.491 1.00 1.00 C ATOM 371 NH1 ARG A 55 22.727 6.801 15.612 1.00 1.00 N ATOM 372 NH2 ARG A 55 23.956 8.448 16.554 1.00 1.00 N ATOM 0 H ARG A 55 24.641 9.083 10.115 1.00 1.00 H new ATOM 0 HA ARG A 55 27.358 8.385 10.779 1.00 1.00 H new ATOM 0 HB2 ARG A 55 25.820 6.809 12.381 1.00 1.00 H new ATOM 0 HB3 ARG A 55 26.102 8.503 12.730 1.00 1.00 H new ATOM 0 HG2 ARG A 55 23.990 9.170 11.758 1.00 1.00 H new ATOM 0 HG3 ARG A 55 23.779 7.626 10.957 1.00 1.00 H new ATOM 0 HD2 ARG A 55 22.352 7.717 12.966 1.00 1.00 H new ATOM 0 HD3 ARG A 55 23.586 6.491 13.175 1.00 1.00 H new ATOM 0 HE ARG A 55 24.514 9.045 14.200 1.00 1.00 H new ATOM 0 HH11 ARG A 55 22.388 6.318 14.780 1.00 1.00 H new ATOM 0 HH12 ARG A 55 22.443 6.482 16.538 1.00 1.00 H new ATOM 0 HH21 ARG A 55 24.577 9.251 16.458 1.00 1.00 H new ATOM 0 HH22 ARG A 55 23.673 8.130 17.481 1.00 1.00 H new ATOM 386 N ALA A 56 25.318 6.008 9.680 1.00 1.00 N ATOM 387 CA ALA A 56 25.293 4.705 9.028 1.00 1.00 C ATOM 388 C ALA A 56 23.877 4.138 9.046 1.00 1.00 C ATOM 389 O ALA A 56 23.268 4.020 10.109 1.00 1.00 O ATOM 390 CB ALA A 56 26.237 3.738 9.763 1.00 1.00 C ATOM 0 H ALA A 56 24.399 6.383 9.913 1.00 1.00 H new ATOM 0 HA ALA A 56 25.621 4.822 7.995 1.00 1.00 H new ATOM 0 HB1 ALA A 56 26.215 2.765 9.272 1.00 1.00 H new ATOM 0 HB2 ALA A 56 27.253 4.133 9.740 1.00 1.00 H new ATOM 0 HB3 ALA A 56 25.913 3.630 10.798 1.00 1.00 H new ATOM 396 N ARG A 57 23.369 3.791 7.866 1.00 1.00 N ATOM 397 CA ARG A 57 22.034 3.227 7.736 1.00 1.00 C ATOM 398 C ARG A 57 20.985 4.276 8.057 1.00 1.00 C ATOM 399 O ARG A 57 19.892 4.270 7.488 1.00 1.00 O ATOM 400 CB ARG A 57 21.875 2.027 8.678 1.00 1.00 C ATOM 401 CG ARG A 57 20.660 1.203 8.263 1.00 1.00 C ATOM 402 CD ARG A 57 20.357 0.169 9.346 1.00 1.00 C ATOM 403 NE ARG A 57 19.917 0.841 10.565 1.00 1.00 N ATOM 404 CZ ARG A 57 18.690 1.342 10.668 1.00 1.00 C ATOM 405 NH1 ARG A 57 17.861 1.244 9.665 1.00 1.00 N ATOM 406 NH2 ARG A 57 18.315 1.936 11.768 1.00 1.00 N ATOM 0 H ARG A 57 23.868 3.893 6.982 1.00 1.00 H new ATOM 0 HA ARG A 57 21.896 2.894 6.707 1.00 1.00 H new ATOM 0 HB2 ARG A 57 22.772 1.409 8.649 1.00 1.00 H new ATOM 0 HB3 ARG A 57 21.758 2.372 9.705 1.00 1.00 H new ATOM 0 HG2 ARG A 57 19.798 1.854 8.114 1.00 1.00 H new ATOM 0 HG3 ARG A 57 20.851 0.705 7.312 1.00 1.00 H new ATOM 0 HD2 ARG A 57 19.584 -0.518 9.000 1.00 1.00 H new ATOM 0 HD3 ARG A 57 21.246 -0.428 9.550 1.00 1.00 H new ATOM 0 HE ARG A 57 20.562 0.928 11.351 1.00 1.00 H new ATOM 0 HH11 ARG A 57 18.155 0.783 8.804 1.00 1.00 H new ATOM 0 HH12 ARG A 57 16.919 1.628 9.742 1.00 1.00 H new ATOM 0 HH21 ARG A 57 18.964 2.017 12.551 1.00 1.00 H new ATOM 0 HH22 ARG A 57 17.373 2.320 11.845 1.00 1.00 H new ATOM 420 N ALA A 58 21.322 5.178 8.967 1.00 1.00 N ATOM 421 CA ALA A 58 20.399 6.223 9.347 1.00 1.00 C ATOM 422 C ALA A 58 20.107 7.126 8.150 1.00 1.00 C ATOM 423 O ALA A 58 18.998 7.589 7.955 1.00 1.00 O ATOM 424 CB ALA A 58 20.979 7.044 10.509 1.00 1.00 C ATOM 0 H ALA A 58 22.221 5.203 9.449 1.00 1.00 H new ATOM 0 HA ALA A 58 19.465 5.767 9.676 1.00 1.00 H new ATOM 0 HB1 ALA A 58 20.275 7.829 10.787 1.00 1.00 H new ATOM 0 HB2 ALA A 58 21.152 6.391 11.365 1.00 1.00 H new ATOM 0 HB3 ALA A 58 21.922 7.495 10.201 1.00 1.00 H new ATOM 430 N GLU A 59 21.113 7.357 7.335 1.00 1.00 N ATOM 431 CA GLU A 59 20.932 8.202 6.165 1.00 1.00 C ATOM 432 C GLU A 59 19.882 7.624 5.240 1.00 1.00 C ATOM 433 O GLU A 59 19.091 8.354 4.666 1.00 1.00 O ATOM 434 CB GLU A 59 22.257 8.352 5.425 1.00 1.00 C ATOM 435 CG GLU A 59 22.869 6.967 5.193 1.00 1.00 C ATOM 436 CD GLU A 59 24.212 7.099 4.492 1.00 1.00 C ATOM 437 OE1 GLU A 59 24.358 8.015 3.702 1.00 1.00 O ATOM 438 OE2 GLU A 59 25.076 6.280 4.757 1.00 1.00 O ATOM 0 H GLU A 59 22.053 6.980 7.454 1.00 1.00 H new ATOM 0 HA GLU A 59 20.592 9.183 6.496 1.00 1.00 H new ATOM 0 HB2 GLU A 59 22.099 8.856 4.472 1.00 1.00 H new ATOM 0 HB3 GLU A 59 22.941 8.972 6.004 1.00 1.00 H new ATOM 0 HG2 GLU A 59 22.996 6.453 6.146 1.00 1.00 H new ATOM 0 HG3 GLU A 59 22.194 6.359 4.591 1.00 1.00 H new ATOM 445 N LEU A 60 19.884 6.315 5.097 1.00 1.00 N ATOM 446 CA LEU A 60 18.925 5.653 4.220 1.00 1.00 C ATOM 447 C LEU A 60 17.535 6.261 4.378 1.00 1.00 C ATOM 448 O LEU A 60 16.658 6.075 3.539 1.00 1.00 O ATOM 449 CB LEU A 60 18.872 4.160 4.542 1.00 1.00 C ATOM 450 CG LEU A 60 18.255 3.382 3.356 1.00 1.00 C ATOM 451 CD1 LEU A 60 19.349 3.000 2.349 1.00 1.00 C ATOM 452 CD2 LEU A 60 17.583 2.108 3.873 1.00 1.00 C ATOM 0 H LEU A 60 20.533 5.686 5.571 1.00 1.00 H new ATOM 0 HA LEU A 60 19.250 5.793 3.189 1.00 1.00 H new ATOM 0 HB2 LEU A 60 19.876 3.789 4.748 1.00 1.00 H new ATOM 0 HB3 LEU A 60 18.280 3.995 5.442 1.00 1.00 H new ATOM 0 HG LEU A 60 17.518 4.016 2.864 1.00 1.00 H new ATOM 0 HD11 LEU A 60 18.904 2.453 1.518 1.00 1.00 H new ATOM 0 HD12 LEU A 60 19.829 3.904 1.973 1.00 1.00 H new ATOM 0 HD13 LEU A 60 20.092 2.372 2.840 1.00 1.00 H new ATOM 0 HD21 LEU A 60 17.149 1.561 3.036 1.00 1.00 H new ATOM 0 HD22 LEU A 60 18.324 1.482 4.371 1.00 1.00 H new ATOM 0 HD23 LEU A 60 16.797 2.373 4.581 1.00 1.00 H new ATOM 464 N PHE A 61 17.339 6.968 5.472 1.00 1.00 N ATOM 465 CA PHE A 61 16.050 7.574 5.743 1.00 1.00 C ATOM 466 C PHE A 61 15.567 8.389 4.547 1.00 1.00 C ATOM 467 O PHE A 61 14.446 8.213 4.078 1.00 1.00 O ATOM 468 CB PHE A 61 16.156 8.485 6.994 1.00 1.00 C ATOM 469 CG PHE A 61 15.752 7.747 8.258 1.00 1.00 C ATOM 470 CD1 PHE A 61 14.542 7.042 8.315 1.00 1.00 C ATOM 471 CD2 PHE A 61 16.604 7.747 9.372 1.00 1.00 C ATOM 472 CE1 PHE A 61 14.193 6.348 9.465 1.00 1.00 C ATOM 473 CE2 PHE A 61 16.251 7.042 10.522 1.00 1.00 C ATOM 474 CZ PHE A 61 15.044 6.342 10.567 1.00 1.00 C ATOM 0 H PHE A 61 18.050 7.137 6.184 1.00 1.00 H new ATOM 0 HA PHE A 61 15.327 6.780 5.928 1.00 1.00 H new ATOM 0 HB2 PHE A 61 17.179 8.848 7.095 1.00 1.00 H new ATOM 0 HB3 PHE A 61 15.519 9.360 6.863 1.00 1.00 H new ATOM 0 HD1 PHE A 61 13.880 7.039 7.462 1.00 1.00 H new ATOM 0 HD2 PHE A 61 17.535 8.294 9.339 1.00 1.00 H new ATOM 0 HE1 PHE A 61 13.257 5.810 9.505 1.00 1.00 H new ATOM 0 HE2 PHE A 61 16.911 7.037 11.377 1.00 1.00 H new ATOM 0 HZ PHE A 61 14.770 5.795 11.457 1.00 1.00 H new ATOM 484 N GLU A 62 16.418 9.270 4.054 1.00 1.00 N ATOM 485 CA GLU A 62 16.066 10.097 2.914 1.00 1.00 C ATOM 486 C GLU A 62 15.791 9.218 1.694 1.00 1.00 C ATOM 487 O GLU A 62 14.900 9.507 0.900 1.00 1.00 O ATOM 488 CB GLU A 62 17.215 11.082 2.614 1.00 1.00 C ATOM 489 CG GLU A 62 18.551 10.467 3.033 1.00 1.00 C ATOM 490 CD GLU A 62 19.711 11.215 2.390 1.00 1.00 C ATOM 491 OE1 GLU A 62 19.559 11.649 1.261 1.00 1.00 O ATOM 492 OE2 GLU A 62 20.739 11.334 3.036 1.00 1.00 O ATOM 0 H GLU A 62 17.355 9.431 4.423 1.00 1.00 H new ATOM 0 HA GLU A 62 15.164 10.663 3.146 1.00 1.00 H new ATOM 0 HB2 GLU A 62 17.232 11.321 1.551 1.00 1.00 H new ATOM 0 HB3 GLU A 62 17.052 12.018 3.148 1.00 1.00 H new ATOM 0 HG2 GLU A 62 18.648 10.499 4.118 1.00 1.00 H new ATOM 0 HG3 GLU A 62 18.582 9.417 2.741 1.00 1.00 H new ATOM 499 N LYS A 63 16.557 8.149 1.546 1.00 1.00 N ATOM 500 CA LYS A 63 16.370 7.260 0.408 1.00 1.00 C ATOM 501 C LYS A 63 14.976 6.634 0.454 1.00 1.00 C ATOM 502 O LYS A 63 14.267 6.589 -0.550 1.00 1.00 O ATOM 503 CB LYS A 63 17.446 6.163 0.418 1.00 1.00 C ATOM 504 CG LYS A 63 18.741 6.678 -0.220 1.00 1.00 C ATOM 505 CD LYS A 63 19.302 7.826 0.617 1.00 1.00 C ATOM 506 CE LYS A 63 20.696 8.183 0.113 1.00 1.00 C ATOM 507 NZ LYS A 63 21.221 9.343 0.888 1.00 1.00 N ATOM 0 H LYS A 63 17.302 7.878 2.187 1.00 1.00 H new ATOM 0 HA LYS A 63 16.464 7.837 -0.512 1.00 1.00 H new ATOM 0 HB2 LYS A 63 17.640 5.844 1.442 1.00 1.00 H new ATOM 0 HB3 LYS A 63 17.088 5.289 -0.126 1.00 1.00 H new ATOM 0 HG2 LYS A 63 19.472 5.872 -0.286 1.00 1.00 H new ATOM 0 HG3 LYS A 63 18.547 7.017 -1.238 1.00 1.00 H new ATOM 0 HD2 LYS A 63 18.646 8.694 0.551 1.00 1.00 H new ATOM 0 HD3 LYS A 63 19.345 7.538 1.667 1.00 1.00 H new ATOM 0 HE2 LYS A 63 21.363 7.328 0.220 1.00 1.00 H new ATOM 0 HE3 LYS A 63 20.659 8.428 -0.949 1.00 1.00 H new ATOM 0 HZ1 LYS A 63 22.255 9.389 0.787 1.00 1.00 H new ATOM 0 HZ2 LYS A 63 20.798 10.222 0.527 1.00 1.00 H new ATOM 0 HZ3 LYS A 63 20.976 9.229 1.892 1.00 1.00 H new ATOM 521 N GLN A 64 14.596 6.161 1.633 1.00 1.00 N ATOM 522 CA GLN A 64 13.291 5.541 1.811 1.00 1.00 C ATOM 523 C GLN A 64 12.187 6.564 1.588 1.00 1.00 C ATOM 524 O GLN A 64 11.034 6.209 1.356 1.00 1.00 O ATOM 525 CB GLN A 64 13.173 4.951 3.217 1.00 1.00 C ATOM 526 CG GLN A 64 14.169 3.799 3.379 1.00 1.00 C ATOM 527 CD GLN A 64 13.780 2.638 2.470 1.00 1.00 C ATOM 528 OE1 GLN A 64 12.645 2.163 2.521 1.00 1.00 O ATOM 529 NE2 GLN A 64 14.656 2.154 1.634 1.00 1.00 N ATOM 0 H GLN A 64 15.169 6.194 2.476 1.00 1.00 H new ATOM 0 HA GLN A 64 13.186 4.740 1.079 1.00 1.00 H new ATOM 0 HB2 GLN A 64 13.369 5.721 3.963 1.00 1.00 H new ATOM 0 HB3 GLN A 64 12.158 4.593 3.388 1.00 1.00 H new ATOM 0 HG2 GLN A 64 15.175 4.141 3.135 1.00 1.00 H new ATOM 0 HG3 GLN A 64 14.188 3.468 4.417 1.00 1.00 H new ATOM 0 HE21 GLN A 64 15.595 2.549 1.594 1.00 1.00 H new ATOM 0 HE22 GLN A 64 14.402 1.380 1.020 1.00 1.00 H new ATOM 538 N ILE A 65 12.546 7.840 1.661 1.00 1.00 N ATOM 539 CA ILE A 65 11.571 8.910 1.463 1.00 1.00 C ATOM 540 C ILE A 65 11.411 9.233 -0.019 1.00 1.00 C ATOM 541 O ILE A 65 10.308 9.175 -0.558 1.00 1.00 O ATOM 542 CB ILE A 65 12.031 10.169 2.210 1.00 1.00 C ATOM 543 CG1 ILE A 65 11.897 9.950 3.722 1.00 1.00 C ATOM 544 CG2 ILE A 65 11.181 11.376 1.788 1.00 1.00 C ATOM 545 CD1 ILE A 65 12.751 10.974 4.496 1.00 1.00 C ATOM 0 H ILE A 65 13.495 8.159 1.854 1.00 1.00 H new ATOM 0 HA ILE A 65 10.610 8.576 1.853 1.00 1.00 H new ATOM 0 HB ILE A 65 13.074 10.365 1.961 1.00 1.00 H new ATOM 0 HG12 ILE A 65 10.852 10.043 4.017 1.00 1.00 H new ATOM 0 HG13 ILE A 65 12.212 8.938 3.978 1.00 1.00 H new ATOM 0 HG21 ILE A 65 11.517 12.263 2.325 1.00 1.00 H new ATOM 0 HG22 ILE A 65 11.287 11.539 0.716 1.00 1.00 H new ATOM 0 HG23 ILE A 65 10.134 11.184 2.024 1.00 1.00 H new ATOM 0 HD11 ILE A 65 12.643 10.803 5.567 1.00 1.00 H new ATOM 0 HD12 ILE A 65 13.798 10.861 4.214 1.00 1.00 H new ATOM 0 HD13 ILE A 65 12.417 11.983 4.255 1.00 1.00 H new ATOM 557 N VAL A 66 12.513 9.578 -0.669 1.00 1.00 N ATOM 558 CA VAL A 66 12.472 9.916 -2.085 1.00 1.00 C ATOM 559 C VAL A 66 12.079 8.695 -2.911 1.00 1.00 C ATOM 560 O VAL A 66 11.307 8.802 -3.864 1.00 1.00 O ATOM 561 CB VAL A 66 13.842 10.432 -2.539 1.00 1.00 C ATOM 562 CG1 VAL A 66 14.293 11.568 -1.616 1.00 1.00 C ATOM 563 CG2 VAL A 66 14.858 9.286 -2.484 1.00 1.00 C ATOM 0 H VAL A 66 13.439 9.631 -0.244 1.00 1.00 H new ATOM 0 HA VAL A 66 11.727 10.697 -2.236 1.00 1.00 H new ATOM 0 HB VAL A 66 13.773 10.806 -3.560 1.00 1.00 H new ATOM 0 HG11 VAL A 66 15.267 11.934 -1.939 1.00 1.00 H new ATOM 0 HG12 VAL A 66 13.568 12.380 -1.658 1.00 1.00 H new ATOM 0 HG13 VAL A 66 14.366 11.199 -0.593 1.00 1.00 H new ATOM 0 HG21 VAL A 66 15.834 9.649 -2.806 1.00 1.00 H new ATOM 0 HG22 VAL A 66 14.929 8.912 -1.463 1.00 1.00 H new ATOM 0 HG23 VAL A 66 14.534 8.481 -3.144 1.00 1.00 H new ATOM 573 N GLN A 67 12.617 7.539 -2.538 1.00 1.00 N ATOM 574 CA GLN A 67 12.317 6.307 -3.253 1.00 1.00 C ATOM 575 C GLN A 67 10.811 6.099 -3.334 1.00 1.00 C ATOM 576 O GLN A 67 10.284 5.700 -4.373 1.00 1.00 O ATOM 577 CB GLN A 67 12.965 5.117 -2.541 1.00 1.00 C ATOM 578 CG GLN A 67 12.651 3.827 -3.303 1.00 1.00 C ATOM 579 CD GLN A 67 13.438 2.666 -2.708 1.00 1.00 C ATOM 580 OE1 GLN A 67 14.538 2.859 -2.191 1.00 1.00 O ATOM 581 NE2 GLN A 67 12.935 1.463 -2.747 1.00 1.00 N ATOM 0 H GLN A 67 13.257 7.431 -1.752 1.00 1.00 H new ATOM 0 HA GLN A 67 12.719 6.383 -4.263 1.00 1.00 H new ATOM 0 HB2 GLN A 67 14.044 5.261 -2.479 1.00 1.00 H new ATOM 0 HB3 GLN A 67 12.594 5.046 -1.519 1.00 1.00 H new ATOM 0 HG2 GLN A 67 11.583 3.616 -3.253 1.00 1.00 H new ATOM 0 HG3 GLN A 67 12.904 3.946 -4.357 1.00 1.00 H new ATOM 0 HE21 GLN A 67 12.023 1.305 -3.176 1.00 1.00 H new ATOM 0 HE22 GLN A 67 13.454 0.680 -2.349 1.00 1.00 H new ATOM 590 N HIS A 68 10.118 6.381 -2.232 1.00 1.00 N ATOM 591 CA HIS A 68 8.663 6.229 -2.183 1.00 1.00 C ATOM 592 C HIS A 68 7.981 7.565 -2.442 1.00 1.00 C ATOM 593 O HIS A 68 6.774 7.707 -2.249 1.00 1.00 O ATOM 594 CB HIS A 68 8.234 5.693 -0.818 1.00 1.00 C ATOM 595 CG HIS A 68 8.742 4.288 -0.654 1.00 1.00 C ATOM 596 ND1 HIS A 68 7.934 3.180 -0.858 1.00 1.00 N ATOM 597 CD2 HIS A 68 9.973 3.795 -0.309 1.00 1.00 C ATOM 598 CE1 HIS A 68 8.683 2.086 -0.632 1.00 1.00 C ATOM 599 NE2 HIS A 68 9.935 2.404 -0.294 1.00 1.00 N ATOM 0 H HIS A 68 10.537 6.715 -1.364 1.00 1.00 H new ATOM 0 HA HIS A 68 8.365 5.521 -2.957 1.00 1.00 H new ATOM 0 HB2 HIS A 68 8.627 6.329 -0.025 1.00 1.00 H new ATOM 0 HB3 HIS A 68 7.148 5.711 -0.732 1.00 1.00 H new ATOM 0 HD2 HIS A 68 10.842 4.395 -0.083 1.00 1.00 H new ATOM 0 HE1 HIS A 68 8.316 1.073 -0.714 1.00 1.00 H new ATOM 0 HE2 HIS A 68 10.699 1.765 -0.073 1.00 1.00 H new ATOM 608 N GLY A 69 8.770 8.546 -2.881 1.00 1.00 N ATOM 609 CA GLY A 69 8.248 9.881 -3.168 1.00 1.00 C ATOM 610 C GLY A 69 8.478 10.814 -1.985 1.00 1.00 C ATOM 611 O GLY A 69 8.327 10.416 -0.830 1.00 1.00 O ATOM 0 H GLY A 69 9.771 8.441 -3.045 1.00 1.00 H new ATOM 0 HA2 GLY A 69 8.735 10.284 -4.056 1.00 1.00 H new ATOM 0 HA3 GLY A 69 7.182 9.821 -3.388 1.00 1.00 H new ATOM 615 N GLY A 70 8.847 12.059 -2.280 1.00 1.00 N ATOM 616 CA GLY A 70 9.106 13.055 -1.236 1.00 1.00 C ATOM 617 C GLY A 70 10.472 13.698 -1.440 1.00 1.00 C ATOM 618 O GLY A 70 11.351 13.598 -0.584 1.00 1.00 O ATOM 0 H GLY A 70 8.974 12.404 -3.231 1.00 1.00 H new ATOM 0 HA2 GLY A 70 8.330 13.821 -1.255 1.00 1.00 H new ATOM 0 HA3 GLY A 70 9.063 12.582 -0.255 1.00 1.00 H new ATOM 622 N GLN A 71 10.647 14.357 -2.581 1.00 1.00 N ATOM 623 CA GLN A 71 11.916 15.008 -2.884 1.00 1.00 C ATOM 624 C GLN A 71 12.339 15.912 -1.730 1.00 1.00 C ATOM 625 O GLN A 71 11.504 16.521 -1.064 1.00 1.00 O ATOM 626 CB GLN A 71 11.782 15.846 -4.158 1.00 1.00 C ATOM 627 CG GLN A 71 13.133 16.482 -4.504 1.00 1.00 C ATOM 628 CD GLN A 71 13.028 17.247 -5.818 1.00 1.00 C ATOM 629 OE1 GLN A 71 12.251 16.873 -6.696 1.00 1.00 O ATOM 630 NE2 GLN A 71 13.766 18.308 -6.002 1.00 1.00 N ATOM 0 H GLN A 71 9.934 14.454 -3.304 1.00 1.00 H new ATOM 0 HA GLN A 71 12.673 14.237 -3.031 1.00 1.00 H new ATOM 0 HB2 GLN A 71 11.443 15.219 -4.983 1.00 1.00 H new ATOM 0 HB3 GLN A 71 11.030 16.622 -4.017 1.00 1.00 H new ATOM 0 HG2 GLN A 71 13.442 17.156 -3.705 1.00 1.00 H new ATOM 0 HG3 GLN A 71 13.898 15.710 -4.583 1.00 1.00 H new ATOM 0 HE21 GLN A 71 14.409 18.615 -5.272 1.00 1.00 H new ATOM 0 HE22 GLN A 71 13.700 18.830 -6.876 1.00 1.00 H new ATOM 639 N LEU A 72 13.644 15.991 -1.504 1.00 1.00 N ATOM 640 CA LEU A 72 14.183 16.822 -0.434 1.00 1.00 C ATOM 641 C LEU A 72 14.278 18.273 -0.874 1.00 1.00 C ATOM 642 O LEU A 72 14.371 18.566 -2.066 1.00 1.00 O ATOM 643 CB LEU A 72 15.570 16.321 -0.040 1.00 1.00 C ATOM 644 CG LEU A 72 15.451 14.956 0.658 1.00 1.00 C ATOM 645 CD1 LEU A 72 16.831 14.281 0.690 1.00 1.00 C ATOM 646 CD2 LEU A 72 14.932 15.127 2.101 1.00 1.00 C ATOM 0 H LEU A 72 14.348 15.491 -2.046 1.00 1.00 H new ATOM 0 HA LEU A 72 13.511 16.758 0.422 1.00 1.00 H new ATOM 0 HB2 LEU A 72 16.200 16.234 -0.925 1.00 1.00 H new ATOM 0 HB3 LEU A 72 16.051 17.039 0.624 1.00 1.00 H new ATOM 0 HG LEU A 72 14.745 14.338 0.103 1.00 1.00 H new ATOM 0 HD11 LEU A 72 16.751 13.313 1.184 1.00 1.00 H new ATOM 0 HD12 LEU A 72 17.191 14.140 -0.329 1.00 1.00 H new ATOM 0 HD13 LEU A 72 17.532 14.911 1.238 1.00 1.00 H new ATOM 0 HD21 LEU A 72 14.855 14.150 2.578 1.00 1.00 H new ATOM 0 HD22 LEU A 72 15.624 15.752 2.665 1.00 1.00 H new ATOM 0 HD23 LEU A 72 13.950 15.600 2.081 1.00 1.00 H new ATOM 658 N CYS A 73 14.262 19.180 0.097 1.00 1.00 N ATOM 659 CA CYS A 73 14.355 20.602 -0.210 1.00 1.00 C ATOM 660 C CYS A 73 14.842 21.381 1.013 1.00 1.00 C ATOM 661 O CYS A 73 14.684 20.934 2.147 1.00 1.00 O ATOM 662 CB CYS A 73 12.977 21.129 -0.662 1.00 1.00 C ATOM 663 SG CYS A 73 12.863 21.083 -2.468 1.00 1.00 S ATOM 0 H CYS A 73 14.187 18.960 1.090 1.00 1.00 H new ATOM 0 HA CYS A 73 15.074 20.742 -1.017 1.00 1.00 H new ATOM 0 HB2 CYS A 73 12.184 20.523 -0.223 1.00 1.00 H new ATOM 0 HB3 CYS A 73 12.833 22.149 -0.306 1.00 1.00 H new ATOM 0 HG CYS A 73 13.420 19.995 -2.910 1.00 1.00 H new ATOM 669 N PRO A 74 15.421 22.537 0.795 1.00 1.00 N ATOM 670 CA PRO A 74 15.932 23.399 1.899 1.00 1.00 C ATOM 671 C PRO A 74 14.819 23.807 2.864 1.00 1.00 C ATOM 672 O PRO A 74 13.796 24.355 2.456 1.00 1.00 O ATOM 673 CB PRO A 74 16.526 24.623 1.161 1.00 1.00 C ATOM 674 CG PRO A 74 15.889 24.614 -0.195 1.00 1.00 C ATOM 675 CD PRO A 74 15.651 23.150 -0.525 1.00 1.00 C ATOM 0 HA PRO A 74 16.664 22.888 2.524 1.00 1.00 H new ATOM 0 HB2 PRO A 74 16.305 25.548 1.693 1.00 1.00 H new ATOM 0 HB3 PRO A 74 17.611 24.549 1.086 1.00 1.00 H new ATOM 0 HG2 PRO A 74 14.953 25.172 -0.192 1.00 1.00 H new ATOM 0 HG3 PRO A 74 16.537 25.082 -0.936 1.00 1.00 H new ATOM 0 HD2 PRO A 74 14.792 23.021 -1.183 1.00 1.00 H new ATOM 0 HD3 PRO A 74 16.509 22.707 -1.030 1.00 1.00 H new ATOM 683 N ALA A 75 15.032 23.536 4.145 1.00 1.00 N ATOM 684 CA ALA A 75 14.050 23.879 5.164 1.00 1.00 C ATOM 685 C ALA A 75 14.108 25.368 5.486 1.00 1.00 C ATOM 686 O ALA A 75 13.348 25.861 6.314 1.00 1.00 O ATOM 687 CB ALA A 75 14.308 23.071 6.431 1.00 1.00 C ATOM 0 H ALA A 75 15.873 23.082 4.502 1.00 1.00 H new ATOM 0 HA ALA A 75 13.058 23.641 4.779 1.00 1.00 H new ATOM 0 HB1 ALA A 75 13.569 23.334 7.187 1.00 1.00 H new ATOM 0 HB2 ALA A 75 14.233 22.007 6.206 1.00 1.00 H new ATOM 0 HB3 ALA A 75 15.307 23.293 6.807 1.00 1.00 H new ATOM 693 N GLN A 76 15.007 26.081 4.821 1.00 1.00 N ATOM 694 CA GLN A 76 15.155 27.512 5.055 1.00 1.00 C ATOM 695 C GLN A 76 13.863 28.250 4.710 1.00 1.00 C ATOM 696 O GLN A 76 13.783 29.473 4.829 1.00 1.00 O ATOM 697 CB GLN A 76 16.307 28.054 4.193 1.00 1.00 C ATOM 698 CG GLN A 76 15.861 28.184 2.720 1.00 1.00 C ATOM 699 CD GLN A 76 15.170 29.525 2.494 1.00 1.00 C ATOM 700 OE1 GLN A 76 15.580 30.538 3.059 1.00 1.00 O ATOM 701 NE2 GLN A 76 14.136 29.590 1.701 1.00 1.00 N ATOM 0 H GLN A 76 15.641 25.696 4.120 1.00 1.00 H new ATOM 0 HA GLN A 76 15.376 27.675 6.110 1.00 1.00 H new ATOM 0 HB2 GLN A 76 16.626 29.026 4.570 1.00 1.00 H new ATOM 0 HB3 GLN A 76 17.166 27.387 4.262 1.00 1.00 H new ATOM 0 HG2 GLN A 76 16.726 28.097 2.062 1.00 1.00 H new ATOM 0 HG3 GLN A 76 15.183 27.370 2.465 1.00 1.00 H new ATOM 0 HE21 GLN A 76 13.798 28.749 1.234 1.00 1.00 H new ATOM 0 HE22 GLN A 76 13.666 30.482 1.548 1.00 1.00 H new ATOM 710 N GLY A 77 12.856 27.498 4.287 1.00 1.00 N ATOM 711 CA GLY A 77 11.578 28.092 3.932 1.00 1.00 C ATOM 712 C GLY A 77 10.497 27.025 3.806 1.00 1.00 C ATOM 713 O GLY A 77 10.723 25.857 4.126 1.00 1.00 O ATOM 0 H GLY A 77 12.900 26.484 4.182 1.00 1.00 H new ATOM 0 HA2 GLY A 77 11.289 28.821 4.689 1.00 1.00 H new ATOM 0 HA3 GLY A 77 11.673 28.632 2.990 1.00 1.00 H new ATOM 717 N PRO A 78 9.335 27.406 3.343 1.00 1.00 N ATOM 718 CA PRO A 78 8.186 26.469 3.164 1.00 1.00 C ATOM 719 C PRO A 78 8.567 25.252 2.326 1.00 1.00 C ATOM 720 O PRO A 78 7.758 24.343 2.139 1.00 1.00 O ATOM 721 CB PRO A 78 7.117 27.321 2.456 1.00 1.00 C ATOM 722 CG PRO A 78 7.466 28.738 2.790 1.00 1.00 C ATOM 723 CD PRO A 78 8.988 28.778 2.942 1.00 1.00 C ATOM 0 HA PRO A 78 7.839 26.060 4.113 1.00 1.00 H new ATOM 0 HB2 PRO A 78 7.130 27.155 1.379 1.00 1.00 H new ATOM 0 HB3 PRO A 78 6.116 27.068 2.806 1.00 1.00 H new ATOM 0 HG2 PRO A 78 7.135 29.416 2.003 1.00 1.00 H new ATOM 0 HG3 PRO A 78 6.974 29.054 3.710 1.00 1.00 H new ATOM 0 HD2 PRO A 78 9.476 29.058 2.009 1.00 1.00 H new ATOM 0 HD3 PRO A 78 9.296 29.505 3.693 1.00 1.00 H new ATOM 731 N GLY A 79 9.798 25.247 1.818 1.00 1.00 N ATOM 732 CA GLY A 79 10.274 24.142 0.992 1.00 1.00 C ATOM 733 C GLY A 79 9.771 22.806 1.524 1.00 1.00 C ATOM 734 O GLY A 79 9.044 22.095 0.839 1.00 1.00 O ATOM 0 H GLY A 79 10.480 25.992 1.963 1.00 1.00 H new ATOM 0 HA2 GLY A 79 9.936 24.279 -0.035 1.00 1.00 H new ATOM 0 HA3 GLY A 79 11.364 24.142 0.971 1.00 1.00 H new ATOM 738 N VAL A 80 10.155 22.477 2.755 1.00 1.00 N ATOM 739 CA VAL A 80 9.737 21.224 3.385 1.00 1.00 C ATOM 740 C VAL A 80 8.688 21.498 4.457 1.00 1.00 C ATOM 741 O VAL A 80 8.150 22.601 4.550 1.00 1.00 O ATOM 742 CB VAL A 80 10.956 20.528 4.012 1.00 1.00 C ATOM 743 CG1 VAL A 80 12.135 20.613 3.038 1.00 1.00 C ATOM 744 CG2 VAL A 80 11.330 21.212 5.337 1.00 1.00 C ATOM 0 H VAL A 80 10.755 23.060 3.338 1.00 1.00 H new ATOM 0 HA VAL A 80 9.302 20.574 2.626 1.00 1.00 H new ATOM 0 HB VAL A 80 10.715 19.484 4.211 1.00 1.00 H new ATOM 0 HG11 VAL A 80 13.004 20.122 3.475 1.00 1.00 H new ATOM 0 HG12 VAL A 80 11.871 20.119 2.103 1.00 1.00 H new ATOM 0 HG13 VAL A 80 12.370 21.659 2.842 1.00 1.00 H new ATOM 0 HG21 VAL A 80 12.195 20.712 5.773 1.00 1.00 H new ATOM 0 HG22 VAL A 80 11.572 22.258 5.151 1.00 1.00 H new ATOM 0 HG23 VAL A 80 10.489 21.152 6.028 1.00 1.00 H new ATOM 754 N THR A 81 8.409 20.482 5.266 1.00 1.00 N ATOM 755 CA THR A 81 7.426 20.606 6.343 1.00 1.00 C ATOM 756 C THR A 81 7.900 19.880 7.597 1.00 1.00 C ATOM 757 O THR A 81 7.559 20.265 8.709 1.00 1.00 O ATOM 758 CB THR A 81 6.089 20.024 5.892 1.00 1.00 C ATOM 759 OG1 THR A 81 5.223 19.919 7.013 1.00 1.00 O ATOM 760 CG2 THR A 81 6.310 18.640 5.281 1.00 1.00 C ATOM 0 H THR A 81 8.847 19.563 5.199 1.00 1.00 H new ATOM 0 HA THR A 81 7.306 21.664 6.577 1.00 1.00 H new ATOM 0 HB THR A 81 5.640 20.677 5.144 1.00 1.00 H new ATOM 0 HG1 THR A 81 4.362 19.547 6.728 1.00 1.00 H new ATOM 0 HG21 THR A 81 5.354 18.227 4.960 1.00 1.00 H new ATOM 0 HG22 THR A 81 6.976 18.724 4.422 1.00 1.00 H new ATOM 0 HG23 THR A 81 6.758 17.981 6.025 1.00 1.00 H new ATOM 768 N HIS A 82 8.679 18.818 7.417 1.00 1.00 N ATOM 769 CA HIS A 82 9.184 18.036 8.551 1.00 1.00 C ATOM 770 C HIS A 82 10.708 18.014 8.557 1.00 1.00 C ATOM 771 O HIS A 82 11.339 18.093 7.506 1.00 1.00 O ATOM 772 CB HIS A 82 8.661 16.599 8.458 1.00 1.00 C ATOM 773 CG HIS A 82 7.171 16.595 8.641 1.00 1.00 C ATOM 774 ND1 HIS A 82 6.292 16.460 7.577 1.00 1.00 N ATOM 775 CD2 HIS A 82 6.390 16.705 9.763 1.00 1.00 C ATOM 776 CE1 HIS A 82 5.044 16.489 8.078 1.00 1.00 C ATOM 777 NE2 HIS A 82 5.046 16.638 9.406 1.00 1.00 N ATOM 0 H HIS A 82 8.976 18.477 6.503 1.00 1.00 H new ATOM 0 HA HIS A 82 8.835 18.502 9.473 1.00 1.00 H new ATOM 0 HB2 HIS A 82 8.920 16.168 7.491 1.00 1.00 H new ATOM 0 HB3 HIS A 82 9.133 15.979 9.220 1.00 1.00 H new ATOM 0 HD2 HIS A 82 6.761 16.825 10.770 1.00 1.00 H new ATOM 0 HE1 HIS A 82 4.149 16.402 7.480 1.00 1.00 H new ATOM 0 HE2 HIS A 82 4.237 16.691 10.025 1.00 1.00 H new ATOM 786 N ILE A 83 11.295 17.895 9.755 1.00 1.00 N ATOM 787 CA ILE A 83 12.746 17.842 9.879 1.00 1.00 C ATOM 788 C ILE A 83 13.132 16.720 10.826 1.00 1.00 C ATOM 789 O ILE A 83 12.871 16.784 12.023 1.00 1.00 O ATOM 790 CB ILE A 83 13.273 19.178 10.383 1.00 1.00 C ATOM 791 CG1 ILE A 83 12.821 20.296 9.437 1.00 1.00 C ATOM 792 CG2 ILE A 83 14.797 19.140 10.437 1.00 1.00 C ATOM 793 CD1 ILE A 83 13.217 21.643 10.030 1.00 1.00 C ATOM 0 H ILE A 83 10.789 17.835 10.639 1.00 1.00 H new ATOM 0 HA ILE A 83 13.189 17.646 8.903 1.00 1.00 H new ATOM 0 HB ILE A 83 12.881 19.368 11.382 1.00 1.00 H new ATOM 0 HG12 ILE A 83 13.280 20.167 8.457 1.00 1.00 H new ATOM 0 HG13 ILE A 83 11.742 20.252 9.292 1.00 1.00 H new ATOM 0 HG21 ILE A 83 15.172 20.098 10.798 1.00 1.00 H new ATOM 0 HG22 ILE A 83 15.117 18.347 11.112 1.00 1.00 H new ATOM 0 HG23 ILE A 83 15.192 18.949 9.439 1.00 1.00 H new ATOM 0 HD11 ILE A 83 12.898 22.443 9.362 1.00 1.00 H new ATOM 0 HD12 ILE A 83 12.737 21.768 11.001 1.00 1.00 H new ATOM 0 HD13 ILE A 83 14.299 21.683 10.153 1.00 1.00 H new ATOM 805 N VAL A 84 13.741 15.677 10.272 1.00 1.00 N ATOM 806 CA VAL A 84 14.143 14.516 11.062 1.00 1.00 C ATOM 807 C VAL A 84 15.584 14.645 11.522 1.00 1.00 C ATOM 808 O VAL A 84 16.435 15.169 10.802 1.00 1.00 O ATOM 809 CB VAL A 84 13.995 13.241 10.234 1.00 1.00 C ATOM 810 CG1 VAL A 84 14.150 12.022 11.149 1.00 1.00 C ATOM 811 CG2 VAL A 84 12.614 13.205 9.563 1.00 1.00 C ATOM 0 H VAL A 84 13.967 15.611 9.280 1.00 1.00 H new ATOM 0 HA VAL A 84 13.495 14.465 11.937 1.00 1.00 H new ATOM 0 HB VAL A 84 14.765 13.224 9.463 1.00 1.00 H new ATOM 0 HG11 VAL A 84 14.045 11.110 10.561 1.00 1.00 H new ATOM 0 HG12 VAL A 84 15.134 12.041 11.617 1.00 1.00 H new ATOM 0 HG13 VAL A 84 13.381 12.047 11.921 1.00 1.00 H new ATOM 0 HG21 VAL A 84 12.519 12.292 8.975 1.00 1.00 H new ATOM 0 HG22 VAL A 84 11.837 13.227 10.327 1.00 1.00 H new ATOM 0 HG23 VAL A 84 12.504 14.070 8.909 1.00 1.00 H new ATOM 821 N VAL A 85 15.856 14.164 12.730 1.00 1.00 N ATOM 822 CA VAL A 85 17.204 14.225 13.290 1.00 1.00 C ATOM 823 C VAL A 85 17.586 12.887 13.914 1.00 1.00 C ATOM 824 O VAL A 85 16.722 12.116 14.328 1.00 1.00 O ATOM 825 CB VAL A 85 17.275 15.325 14.349 1.00 1.00 C ATOM 826 CG1 VAL A 85 17.003 16.681 13.698 1.00 1.00 C ATOM 827 CG2 VAL A 85 16.238 15.064 15.443 1.00 1.00 C ATOM 0 H VAL A 85 15.164 13.728 13.340 1.00 1.00 H new ATOM 0 HA VAL A 85 17.905 14.448 12.485 1.00 1.00 H new ATOM 0 HB VAL A 85 18.270 15.328 14.794 1.00 1.00 H new ATOM 0 HG11 VAL A 85 17.054 17.464 14.454 1.00 1.00 H new ATOM 0 HG12 VAL A 85 17.750 16.871 12.928 1.00 1.00 H new ATOM 0 HG13 VAL A 85 16.011 16.676 13.247 1.00 1.00 H new ATOM 0 HG21 VAL A 85 16.295 15.852 16.194 1.00 1.00 H new ATOM 0 HG22 VAL A 85 15.241 15.053 15.004 1.00 1.00 H new ATOM 0 HG23 VAL A 85 16.439 14.101 15.912 1.00 1.00 H new ATOM 837 N ASP A 86 18.889 12.621 13.984 1.00 1.00 N ATOM 838 CA ASP A 86 19.373 11.371 14.564 1.00 1.00 C ATOM 839 C ASP A 86 19.187 11.370 16.076 1.00 1.00 C ATOM 840 O ASP A 86 19.822 10.595 16.789 1.00 1.00 O ATOM 841 CB ASP A 86 20.850 11.175 14.224 1.00 1.00 C ATOM 842 CG ASP A 86 21.385 9.914 14.884 1.00 1.00 C ATOM 843 OD1 ASP A 86 20.970 8.838 14.485 1.00 1.00 O ATOM 844 OD2 ASP A 86 22.194 10.042 15.786 1.00 1.00 O ATOM 0 H ASP A 86 19.621 13.247 13.650 1.00 1.00 H new ATOM 0 HA ASP A 86 18.793 10.550 14.143 1.00 1.00 H new ATOM 0 HB2 ASP A 86 20.975 11.108 13.143 1.00 1.00 H new ATOM 0 HB3 ASP A 86 21.424 12.039 14.558 1.00 1.00 H new ATOM 849 N GLU A 87 18.303 12.228 16.560 1.00 1.00 N ATOM 850 CA GLU A 87 18.030 12.298 17.988 1.00 1.00 C ATOM 851 C GLU A 87 19.224 12.862 18.746 1.00 1.00 C ATOM 852 O GLU A 87 19.061 13.633 19.692 1.00 1.00 O ATOM 853 CB GLU A 87 17.690 10.895 18.530 1.00 1.00 C ATOM 854 CG GLU A 87 16.850 10.095 17.490 1.00 1.00 C ATOM 855 CD GLU A 87 17.708 9.053 16.778 1.00 1.00 C ATOM 856 OE1 GLU A 87 18.415 8.333 17.462 1.00 1.00 O ATOM 857 OE2 GLU A 87 17.652 9.000 15.561 1.00 1.00 O ATOM 0 H GLU A 87 17.765 12.882 15.991 1.00 1.00 H new ATOM 0 HA GLU A 87 17.179 12.963 18.137 1.00 1.00 H new ATOM 0 HB2 GLU A 87 18.609 10.354 18.757 1.00 1.00 H new ATOM 0 HB3 GLU A 87 17.134 10.984 19.463 1.00 1.00 H new ATOM 0 HG2 GLU A 87 16.016 9.603 17.992 1.00 1.00 H new ATOM 0 HG3 GLU A 87 16.422 10.780 16.758 1.00 1.00 H new ATOM 864 N GLY A 88 20.423 12.466 18.328 1.00 1.00 N ATOM 865 CA GLY A 88 21.645 12.926 18.972 1.00 1.00 C ATOM 866 C GLY A 88 21.538 14.395 19.360 1.00 1.00 C ATOM 867 O GLY A 88 21.683 14.755 20.528 1.00 1.00 O ATOM 0 H GLY A 88 20.572 11.828 17.546 1.00 1.00 H new ATOM 0 HA2 GLY A 88 21.841 12.325 19.860 1.00 1.00 H new ATOM 0 HA3 GLY A 88 22.490 12.785 18.299 1.00 1.00 H new ATOM 871 N MET A 89 21.270 15.234 18.371 1.00 1.00 N ATOM 872 CA MET A 89 21.128 16.668 18.607 1.00 1.00 C ATOM 873 C MET A 89 19.692 17.007 18.993 1.00 1.00 C ATOM 874 O MET A 89 18.767 16.243 18.715 1.00 1.00 O ATOM 875 CB MET A 89 21.527 17.455 17.353 1.00 1.00 C ATOM 876 CG MET A 89 20.543 17.189 16.207 1.00 1.00 C ATOM 877 SD MET A 89 20.770 15.495 15.602 1.00 1.00 S ATOM 878 CE MET A 89 21.171 15.891 13.889 1.00 1.00 C ATOM 0 H MET A 89 21.146 14.951 17.399 1.00 1.00 H new ATOM 0 HA MET A 89 21.788 16.947 19.428 1.00 1.00 H new ATOM 0 HB2 MET A 89 21.549 18.521 17.579 1.00 1.00 H new ATOM 0 HB3 MET A 89 22.534 17.173 17.046 1.00 1.00 H new ATOM 0 HG2 MET A 89 19.519 17.330 16.552 1.00 1.00 H new ATOM 0 HG3 MET A 89 20.708 17.901 15.398 1.00 1.00 H new ATOM 0 HE1 MET A 89 21.210 14.973 13.303 1.00 1.00 H new ATOM 0 HE2 MET A 89 20.406 16.551 13.480 1.00 1.00 H new ATOM 0 HE3 MET A 89 22.140 16.389 13.848 1.00 1.00 H new ATOM 888 N ASP A 90 19.511 18.162 19.617 1.00 1.00 N ATOM 889 CA ASP A 90 18.184 18.615 20.027 1.00 1.00 C ATOM 890 C ASP A 90 17.610 19.576 18.995 1.00 1.00 C ATOM 891 O ASP A 90 18.225 19.840 17.962 1.00 1.00 O ATOM 892 CB ASP A 90 18.265 19.307 21.385 1.00 1.00 C ATOM 893 CG ASP A 90 18.514 18.275 22.477 1.00 1.00 C ATOM 894 OD1 ASP A 90 18.427 17.095 22.180 1.00 1.00 O ATOM 895 OD2 ASP A 90 18.790 18.679 23.594 1.00 1.00 O ATOM 0 H ASP A 90 20.266 18.806 19.852 1.00 1.00 H new ATOM 0 HA ASP A 90 17.529 17.747 20.104 1.00 1.00 H new ATOM 0 HB2 ASP A 90 19.067 20.045 21.380 1.00 1.00 H new ATOM 0 HB3 ASP A 90 17.338 19.845 21.585 1.00 1.00 H new ATOM 900 N TYR A 91 16.432 20.102 19.289 1.00 1.00 N ATOM 901 CA TYR A 91 15.787 21.040 18.386 1.00 1.00 C ATOM 902 C TYR A 91 16.638 22.303 18.224 1.00 1.00 C ATOM 903 O TYR A 91 16.835 22.793 17.118 1.00 1.00 O ATOM 904 CB TYR A 91 14.370 21.403 18.913 1.00 1.00 C ATOM 905 CG TYR A 91 14.170 22.906 18.912 1.00 1.00 C ATOM 906 CD1 TYR A 91 14.643 23.662 19.988 1.00 1.00 C ATOM 907 CD2 TYR A 91 13.558 23.539 17.828 1.00 1.00 C ATOM 908 CE1 TYR A 91 14.497 25.052 19.986 1.00 1.00 C ATOM 909 CE2 TYR A 91 13.407 24.929 17.825 1.00 1.00 C ATOM 910 CZ TYR A 91 13.881 25.686 18.904 1.00 1.00 C ATOM 911 OH TYR A 91 13.734 27.056 18.902 1.00 1.00 O ATOM 0 H TYR A 91 15.907 19.897 20.139 1.00 1.00 H new ATOM 0 HA TYR A 91 15.686 20.568 17.409 1.00 1.00 H new ATOM 0 HB2 TYR A 91 13.612 20.929 18.290 1.00 1.00 H new ATOM 0 HB3 TYR A 91 14.241 21.014 19.923 1.00 1.00 H new ATOM 0 HD1 TYR A 91 15.122 23.171 20.822 1.00 1.00 H new ATOM 0 HD2 TYR A 91 13.201 22.955 16.992 1.00 1.00 H new ATOM 0 HE1 TYR A 91 14.860 25.635 20.820 1.00 1.00 H new ATOM 0 HE2 TYR A 91 12.925 25.419 16.991 1.00 1.00 H new ATOM 0 HH TYR A 91 13.583 27.367 17.985 1.00 1.00 H new ATOM 921 N GLU A 92 17.102 22.840 19.342 1.00 1.00 N ATOM 922 CA GLU A 92 17.884 24.064 19.309 1.00 1.00 C ATOM 923 C GLU A 92 19.058 23.933 18.350 1.00 1.00 C ATOM 924 O GLU A 92 19.256 24.782 17.479 1.00 1.00 O ATOM 925 CB GLU A 92 18.393 24.378 20.721 1.00 1.00 C ATOM 926 CG GLU A 92 19.279 23.229 21.219 1.00 1.00 C ATOM 927 CD GLU A 92 19.405 23.275 22.735 1.00 1.00 C ATOM 928 OE1 GLU A 92 18.410 23.544 23.386 1.00 1.00 O ATOM 929 OE2 GLU A 92 20.496 23.032 23.224 1.00 1.00 O ATOM 0 H GLU A 92 16.952 22.452 20.273 1.00 1.00 H new ATOM 0 HA GLU A 92 17.249 24.877 18.957 1.00 1.00 H new ATOM 0 HB2 GLU A 92 18.959 25.310 20.715 1.00 1.00 H new ATOM 0 HB3 GLU A 92 17.551 24.520 21.398 1.00 1.00 H new ATOM 0 HG2 GLU A 92 18.853 22.274 20.912 1.00 1.00 H new ATOM 0 HG3 GLU A 92 20.267 23.299 20.763 1.00 1.00 H new ATOM 936 N ARG A 93 19.824 22.863 18.508 1.00 1.00 N ATOM 937 CA ARG A 93 20.968 22.619 17.649 1.00 1.00 C ATOM 938 C ARG A 93 20.528 22.226 16.251 1.00 1.00 C ATOM 939 O ARG A 93 21.101 22.680 15.263 1.00 1.00 O ATOM 940 CB ARG A 93 21.843 21.526 18.245 1.00 1.00 C ATOM 941 CG ARG A 93 22.902 21.103 17.218 1.00 1.00 C ATOM 942 CD ARG A 93 24.086 20.488 17.930 1.00 1.00 C ATOM 943 NE ARG A 93 23.664 19.388 18.792 1.00 1.00 N ATOM 944 CZ ARG A 93 24.520 18.787 19.613 1.00 1.00 C ATOM 945 NH1 ARG A 93 25.768 19.169 19.655 1.00 1.00 N ATOM 946 NH2 ARG A 93 24.113 17.816 20.384 1.00 1.00 N ATOM 0 H ARG A 93 19.672 22.152 19.223 1.00 1.00 H new ATOM 0 HA ARG A 93 21.542 23.543 17.578 1.00 1.00 H new ATOM 0 HB2 ARG A 93 22.325 21.886 19.154 1.00 1.00 H new ATOM 0 HB3 ARG A 93 21.232 20.669 18.527 1.00 1.00 H new ATOM 0 HG2 ARG A 93 22.476 20.387 16.516 1.00 1.00 H new ATOM 0 HG3 ARG A 93 23.224 21.967 16.636 1.00 1.00 H new ATOM 0 HD2 ARG A 93 24.807 20.125 17.198 1.00 1.00 H new ATOM 0 HD3 ARG A 93 24.592 21.248 18.525 1.00 1.00 H new ATOM 0 HE ARG A 93 22.694 19.074 18.764 1.00 1.00 H new ATOM 0 HH11 ARG A 93 26.089 19.930 19.057 1.00 1.00 H new ATOM 0 HH12 ARG A 93 26.422 18.706 20.286 1.00 1.00 H new ATOM 0 HH21 ARG A 93 23.138 17.518 20.357 1.00 1.00 H new ATOM 0 HH22 ARG A 93 24.770 17.355 21.014 1.00 1.00 H new ATOM 960 N ALA A 94 19.521 21.366 16.180 1.00 1.00 N ATOM 961 CA ALA A 94 19.036 20.892 14.898 1.00 1.00 C ATOM 962 C ALA A 94 18.920 22.042 13.905 1.00 1.00 C ATOM 963 O ALA A 94 19.155 21.864 12.712 1.00 1.00 O ATOM 964 CB ALA A 94 17.668 20.229 15.066 1.00 1.00 C ATOM 0 H ALA A 94 19.030 20.987 16.990 1.00 1.00 H new ATOM 0 HA ALA A 94 19.751 20.164 14.514 1.00 1.00 H new ATOM 0 HB1 ALA A 94 17.313 19.877 14.098 1.00 1.00 H new ATOM 0 HB2 ALA A 94 17.754 19.385 15.750 1.00 1.00 H new ATOM 0 HB3 ALA A 94 16.960 20.953 15.471 1.00 1.00 H new ATOM 970 N LEU A 95 18.550 23.219 14.399 1.00 1.00 N ATOM 971 CA LEU A 95 18.397 24.374 13.527 1.00 1.00 C ATOM 972 C LEU A 95 19.709 24.701 12.823 1.00 1.00 C ATOM 973 O LEU A 95 19.796 24.669 11.596 1.00 1.00 O ATOM 974 CB LEU A 95 17.921 25.587 14.361 1.00 1.00 C ATOM 975 CG LEU A 95 16.394 25.743 14.276 1.00 1.00 C ATOM 976 CD1 LEU A 95 15.687 24.390 14.495 1.00 1.00 C ATOM 977 CD2 LEU A 95 15.934 26.750 15.328 1.00 1.00 C ATOM 0 H LEU A 95 18.353 23.396 15.384 1.00 1.00 H new ATOM 0 HA LEU A 95 17.654 24.143 12.764 1.00 1.00 H new ATOM 0 HB2 LEU A 95 18.221 25.459 15.401 1.00 1.00 H new ATOM 0 HB3 LEU A 95 18.404 26.495 14.000 1.00 1.00 H new ATOM 0 HG LEU A 95 16.132 26.102 13.281 1.00 1.00 H new ATOM 0 HD11 LEU A 95 14.608 24.529 14.430 1.00 1.00 H new ATOM 0 HD12 LEU A 95 16.009 23.683 13.730 1.00 1.00 H new ATOM 0 HD13 LEU A 95 15.944 24.000 15.480 1.00 1.00 H new ATOM 0 HD21 LEU A 95 14.852 26.865 15.273 1.00 1.00 H new ATOM 0 HD22 LEU A 95 16.211 26.392 16.320 1.00 1.00 H new ATOM 0 HD23 LEU A 95 16.411 27.713 15.143 1.00 1.00 H new ATOM 989 N ARG A 96 20.720 25.012 13.606 1.00 1.00 N ATOM 990 CA ARG A 96 22.014 25.345 13.051 1.00 1.00 C ATOM 991 C ARG A 96 22.643 24.122 12.419 1.00 1.00 C ATOM 992 O ARG A 96 23.531 24.231 11.576 1.00 1.00 O ATOM 993 CB ARG A 96 22.926 25.895 14.150 1.00 1.00 C ATOM 994 CG ARG A 96 22.424 27.284 14.579 1.00 1.00 C ATOM 995 CD ARG A 96 22.659 28.326 13.463 1.00 1.00 C ATOM 996 NE ARG A 96 21.484 28.418 12.605 1.00 1.00 N ATOM 997 CZ ARG A 96 21.576 28.892 11.369 1.00 1.00 C ATOM 998 NH1 ARG A 96 22.731 29.279 10.907 1.00 1.00 N ATOM 999 NH2 ARG A 96 20.515 28.961 10.616 1.00 1.00 N ATOM 0 H ARG A 96 20.671 25.041 14.624 1.00 1.00 H new ATOM 0 HA ARG A 96 21.882 26.107 12.283 1.00 1.00 H new ATOM 0 HB2 ARG A 96 22.934 25.218 15.005 1.00 1.00 H new ATOM 0 HB3 ARG A 96 23.952 25.962 13.788 1.00 1.00 H new ATOM 0 HG2 ARG A 96 21.361 27.233 14.816 1.00 1.00 H new ATOM 0 HG3 ARG A 96 22.939 27.596 15.487 1.00 1.00 H new ATOM 0 HD2 ARG A 96 22.874 29.300 13.904 1.00 1.00 H new ATOM 0 HD3 ARG A 96 23.530 28.045 12.871 1.00 1.00 H new ATOM 0 HE ARG A 96 20.578 28.113 12.960 1.00 1.00 H new ATOM 0 HH11 ARG A 96 23.562 29.217 11.495 1.00 1.00 H new ATOM 0 HH12 ARG A 96 22.804 29.644 9.957 1.00 1.00 H new ATOM 0 HH21 ARG A 96 19.613 28.651 10.976 1.00 1.00 H new ATOM 0 HH22 ARG A 96 20.587 29.326 9.666 1.00 1.00 H new ATOM 1013 N LEU A 97 22.197 22.958 12.850 1.00 1.00 N ATOM 1014 CA LEU A 97 22.752 21.717 12.342 1.00 1.00 C ATOM 1015 C LEU A 97 22.477 21.566 10.854 1.00 1.00 C ATOM 1016 O LEU A 97 23.305 21.063 10.100 1.00 1.00 O ATOM 1017 CB LEU A 97 22.156 20.526 13.110 1.00 1.00 C ATOM 1018 CG LEU A 97 23.213 19.432 13.296 1.00 1.00 C ATOM 1019 CD1 LEU A 97 23.787 19.029 11.931 1.00 1.00 C ATOM 1020 CD2 LEU A 97 24.343 19.946 14.232 1.00 1.00 C ATOM 0 H LEU A 97 21.459 22.845 13.544 1.00 1.00 H new ATOM 0 HA LEU A 97 23.832 21.738 12.488 1.00 1.00 H new ATOM 0 HB2 LEU A 97 21.790 20.857 14.082 1.00 1.00 H new ATOM 0 HB3 LEU A 97 21.300 20.126 12.567 1.00 1.00 H new ATOM 0 HG LEU A 97 22.753 18.556 13.754 1.00 1.00 H new ATOM 0 HD11 LEU A 97 24.538 18.251 12.067 1.00 1.00 H new ATOM 0 HD12 LEU A 97 22.985 18.652 11.296 1.00 1.00 H new ATOM 0 HD13 LEU A 97 24.246 19.897 11.459 1.00 1.00 H new ATOM 0 HD21 LEU A 97 25.092 19.165 14.361 1.00 1.00 H new ATOM 0 HD22 LEU A 97 24.809 20.826 13.790 1.00 1.00 H new ATOM 0 HD23 LEU A 97 23.921 20.208 15.202 1.00 1.00 H new ATOM 1032 N LEU A 98 21.309 22.008 10.451 1.00 1.00 N ATOM 1033 CA LEU A 98 20.899 21.928 9.049 1.00 1.00 C ATOM 1034 C LEU A 98 20.835 23.317 8.424 1.00 1.00 C ATOM 1035 O LEU A 98 20.258 23.490 7.359 1.00 1.00 O ATOM 1036 CB LEU A 98 19.527 21.222 8.977 1.00 1.00 C ATOM 1037 CG LEU A 98 18.346 22.253 9.016 1.00 1.00 C ATOM 1038 CD1 LEU A 98 17.750 22.491 7.596 1.00 1.00 C ATOM 1039 CD2 LEU A 98 17.252 21.749 9.951 1.00 1.00 C ATOM 0 H LEU A 98 20.616 22.430 11.069 1.00 1.00 H new ATOM 0 HA LEU A 98 21.632 21.354 8.483 1.00 1.00 H new ATOM 0 HB2 LEU A 98 19.467 20.634 8.061 1.00 1.00 H new ATOM 0 HB3 LEU A 98 19.431 20.526 9.810 1.00 1.00 H new ATOM 0 HG LEU A 98 18.740 23.201 9.383 1.00 1.00 H new ATOM 0 HD11 LEU A 98 16.934 23.211 7.660 1.00 1.00 H new ATOM 0 HD12 LEU A 98 18.526 22.880 6.936 1.00 1.00 H new ATOM 0 HD13 LEU A 98 17.373 21.549 7.197 1.00 1.00 H new ATOM 0 HD21 LEU A 98 16.434 22.469 9.975 1.00 1.00 H new ATOM 0 HD22 LEU A 98 16.881 20.789 9.592 1.00 1.00 H new ATOM 0 HD23 LEU A 98 17.659 21.629 10.955 1.00 1.00 H new ATOM 1051 N ARG A 99 21.410 24.305 9.098 1.00 1.00 N ATOM 1052 CA ARG A 99 21.382 25.664 8.584 1.00 1.00 C ATOM 1053 C ARG A 99 19.967 26.179 8.495 1.00 1.00 C ATOM 1054 O ARG A 99 19.508 26.551 7.414 1.00 1.00 O ATOM 1055 CB ARG A 99 22.041 25.737 7.205 1.00 1.00 C ATOM 1056 CG ARG A 99 23.536 25.335 7.313 1.00 1.00 C ATOM 1057 CD ARG A 99 23.737 23.885 6.859 1.00 1.00 C ATOM 1058 NE ARG A 99 23.233 23.716 5.503 1.00 1.00 N ATOM 1059 CZ ARG A 99 22.875 22.521 5.044 1.00 1.00 C ATOM 1060 NH1 ARG A 99 22.957 21.476 5.821 1.00 1.00 N ATOM 1061 NH2 ARG A 99 22.433 22.396 3.823 1.00 1.00 N ATOM 0 H ARG A 99 21.894 24.192 9.989 1.00 1.00 H new ATOM 0 HA ARG A 99 21.941 26.290 9.279 1.00 1.00 H new ATOM 0 HB2 ARG A 99 21.526 25.073 6.510 1.00 1.00 H new ATOM 0 HB3 ARG A 99 21.955 26.747 6.804 1.00 1.00 H new ATOM 0 HG2 ARG A 99 24.143 26.001 6.700 1.00 1.00 H new ATOM 0 HG3 ARG A 99 23.876 25.450 8.342 1.00 1.00 H new ATOM 0 HD2 ARG A 99 24.795 23.626 6.898 1.00 1.00 H new ATOM 0 HD3 ARG A 99 23.218 23.207 7.537 1.00 1.00 H new ATOM 0 HE ARG A 99 23.153 24.530 4.894 1.00 1.00 H new ATOM 0 HH11 ARG A 99 23.295 21.577 6.778 1.00 1.00 H new ATOM 0 HH12 ARG A 99 22.683 20.558 5.471 1.00 1.00 H new ATOM 0 HH21 ARG A 99 22.362 23.216 3.220 1.00 1.00 H new ATOM 0 HH22 ARG A 99 22.158 21.479 3.471 1.00 1.00 H new ATOM 1075 N LEU A 100 19.277 26.221 9.639 1.00 1.00 N ATOM 1076 CA LEU A 100 17.905 26.727 9.666 1.00 1.00 C ATOM 1077 C LEU A 100 17.764 27.866 10.680 1.00 1.00 C ATOM 1078 O LEU A 100 18.144 27.713 11.843 1.00 1.00 O ATOM 1079 CB LEU A 100 16.920 25.620 10.032 1.00 1.00 C ATOM 1080 CG LEU A 100 15.469 26.095 9.828 1.00 1.00 C ATOM 1081 CD1 LEU A 100 15.072 26.034 8.333 1.00 1.00 C ATOM 1082 CD2 LEU A 100 14.528 25.196 10.646 1.00 1.00 C ATOM 0 H LEU A 100 19.639 25.916 10.542 1.00 1.00 H new ATOM 0 HA LEU A 100 17.678 27.098 8.666 1.00 1.00 H new ATOM 0 HB2 LEU A 100 17.110 24.740 9.418 1.00 1.00 H new ATOM 0 HB3 LEU A 100 17.068 25.323 11.070 1.00 1.00 H new ATOM 0 HG LEU A 100 15.388 27.129 10.162 1.00 1.00 H new ATOM 0 HD11 LEU A 100 14.043 26.374 8.216 1.00 1.00 H new ATOM 0 HD12 LEU A 100 15.735 26.677 7.754 1.00 1.00 H new ATOM 0 HD13 LEU A 100 15.158 25.008 7.975 1.00 1.00 H new ATOM 0 HD21 LEU A 100 13.498 25.525 10.507 1.00 1.00 H new ATOM 0 HD22 LEU A 100 14.627 24.164 10.310 1.00 1.00 H new ATOM 0 HD23 LEU A 100 14.790 25.260 11.702 1.00 1.00 H new ATOM 1094 N PRO A 101 17.228 28.999 10.273 1.00 1.00 N ATOM 1095 CA PRO A 101 17.048 30.164 11.189 1.00 1.00 C ATOM 1096 C PRO A 101 16.075 29.857 12.321 1.00 1.00 C ATOM 1097 O PRO A 101 16.333 30.183 13.479 1.00 1.00 O ATOM 1098 CB PRO A 101 16.506 31.280 10.266 1.00 1.00 C ATOM 1099 CG PRO A 101 15.917 30.571 9.090 1.00 1.00 C ATOM 1100 CD PRO A 101 16.732 29.304 8.912 1.00 1.00 C ATOM 0 HA PRO A 101 17.976 30.442 11.689 1.00 1.00 H new ATOM 0 HB2 PRO A 101 15.756 31.883 10.777 1.00 1.00 H new ATOM 0 HB3 PRO A 101 17.303 31.957 9.958 1.00 1.00 H new ATOM 0 HG2 PRO A 101 14.866 30.338 9.262 1.00 1.00 H new ATOM 0 HG3 PRO A 101 15.963 31.193 8.196 1.00 1.00 H new ATOM 0 HD2 PRO A 101 16.123 28.490 8.518 1.00 1.00 H new ATOM 0 HD3 PRO A 101 17.554 29.454 8.212 1.00 1.00 H new ATOM 1108 N GLN A 102 14.954 29.233 11.976 1.00 1.00 N ATOM 1109 CA GLN A 102 13.937 28.899 12.975 1.00 1.00 C ATOM 1110 C GLN A 102 12.724 28.268 12.312 1.00 1.00 C ATOM 1111 O GLN A 102 12.258 28.724 11.266 1.00 1.00 O ATOM 1112 CB GLN A 102 13.515 30.168 13.764 1.00 1.00 C ATOM 1113 CG GLN A 102 13.909 30.037 15.234 1.00 1.00 C ATOM 1114 CD GLN A 102 13.037 28.984 15.903 1.00 1.00 C ATOM 1115 OE1 GLN A 102 13.565 28.174 16.776 1.00 1.00 O flip ATOM 1116 NE2 GLN A 102 11.839 28.902 15.629 1.00 1.00 N flip ATOM 0 H GLN A 102 14.725 28.949 11.023 1.00 1.00 H new ATOM 0 HA GLN A 102 14.366 28.179 13.672 1.00 1.00 H new ATOM 0 HB2 GLN A 102 13.990 31.048 13.331 1.00 1.00 H new ATOM 0 HB3 GLN A 102 12.438 30.314 13.681 1.00 1.00 H new ATOM 0 HG2 GLN A 102 14.960 29.760 15.316 1.00 1.00 H new ATOM 0 HG3 GLN A 102 13.792 30.996 15.739 1.00 1.00 H new ATOM 0 HE21 GLN A 102 11.428 29.537 14.945 1.00 1.00 H new ATOM 0 HE22 GLN A 102 11.258 28.199 16.086 1.00 1.00 H new ATOM 1125 N LEU A 103 12.223 27.211 12.932 1.00 1.00 N ATOM 1126 CA LEU A 103 11.078 26.513 12.393 1.00 1.00 C ATOM 1127 C LEU A 103 10.019 27.493 11.868 1.00 1.00 C ATOM 1128 O LEU A 103 9.452 28.260 12.645 1.00 1.00 O ATOM 1129 CB LEU A 103 10.450 25.611 13.456 1.00 1.00 C ATOM 1130 CG LEU A 103 11.303 24.344 13.624 1.00 1.00 C ATOM 1131 CD1 LEU A 103 10.917 23.640 14.930 1.00 1.00 C ATOM 1132 CD2 LEU A 103 11.098 23.386 12.424 1.00 1.00 C ATOM 0 H LEU A 103 12.591 26.824 13.801 1.00 1.00 H new ATOM 0 HA LEU A 103 11.431 25.904 11.561 1.00 1.00 H new ATOM 0 HB2 LEU A 103 10.380 26.143 14.405 1.00 1.00 H new ATOM 0 HB3 LEU A 103 9.434 25.342 13.166 1.00 1.00 H new ATOM 0 HG LEU A 103 12.355 24.627 13.660 1.00 1.00 H new ATOM 0 HD11 LEU A 103 11.521 22.741 15.051 1.00 1.00 H new ATOM 0 HD12 LEU A 103 11.093 24.311 15.771 1.00 1.00 H new ATOM 0 HD13 LEU A 103 9.862 23.367 14.898 1.00 1.00 H new ATOM 0 HD21 LEU A 103 11.710 22.495 12.561 1.00 1.00 H new ATOM 0 HD22 LEU A 103 10.048 23.099 12.363 1.00 1.00 H new ATOM 0 HD23 LEU A 103 11.391 23.889 11.503 1.00 1.00 H new ATOM 1144 N PRO A 104 9.738 27.487 10.585 1.00 1.00 N ATOM 1145 CA PRO A 104 8.731 28.406 10.004 1.00 1.00 C ATOM 1146 C PRO A 104 7.294 28.015 10.407 1.00 1.00 C ATOM 1147 O PRO A 104 6.967 26.829 10.469 1.00 1.00 O ATOM 1148 CB PRO A 104 8.945 28.277 8.483 1.00 1.00 C ATOM 1149 CG PRO A 104 9.558 26.929 8.284 1.00 1.00 C ATOM 1150 CD PRO A 104 10.344 26.624 9.558 1.00 1.00 C ATOM 0 HA PRO A 104 8.852 29.429 10.360 1.00 1.00 H new ATOM 0 HB2 PRO A 104 8.001 28.363 7.944 1.00 1.00 H new ATOM 0 HB3 PRO A 104 9.599 29.065 8.109 1.00 1.00 H new ATOM 0 HG2 PRO A 104 8.791 26.175 8.110 1.00 1.00 H new ATOM 0 HG3 PRO A 104 10.213 26.924 7.413 1.00 1.00 H new ATOM 0 HD2 PRO A 104 10.266 25.571 9.829 1.00 1.00 H new ATOM 0 HD3 PRO A 104 11.404 26.843 9.432 1.00 1.00 H new ATOM 1158 N PRO A 105 6.440 28.976 10.669 1.00 1.00 N ATOM 1159 CA PRO A 105 5.027 28.706 11.058 1.00 1.00 C ATOM 1160 C PRO A 105 4.401 27.570 10.249 1.00 1.00 C ATOM 1161 O PRO A 105 3.848 27.792 9.170 1.00 1.00 O ATOM 1162 CB PRO A 105 4.316 30.042 10.782 1.00 1.00 C ATOM 1163 CG PRO A 105 5.376 31.098 10.914 1.00 1.00 C ATOM 1164 CD PRO A 105 6.723 30.422 10.629 1.00 1.00 C ATOM 0 HA PRO A 105 4.945 28.378 12.094 1.00 1.00 H new ATOM 0 HB2 PRO A 105 3.874 30.052 9.786 1.00 1.00 H new ATOM 0 HB3 PRO A 105 3.506 30.209 11.492 1.00 1.00 H new ATOM 0 HG2 PRO A 105 5.198 31.913 10.212 1.00 1.00 H new ATOM 0 HG3 PRO A 105 5.366 31.531 11.914 1.00 1.00 H new ATOM 0 HD2 PRO A 105 7.117 30.720 9.657 1.00 1.00 H new ATOM 0 HD3 PRO A 105 7.469 30.699 11.374 1.00 1.00 H new ATOM 1172 N GLY A 106 4.474 26.355 10.780 1.00 1.00 N ATOM 1173 CA GLY A 106 3.895 25.194 10.100 1.00 1.00 C ATOM 1174 C GLY A 106 4.779 23.967 10.260 1.00 1.00 C ATOM 1175 O GLY A 106 4.330 22.924 10.738 1.00 1.00 O ATOM 0 H GLY A 106 4.923 26.145 11.671 1.00 1.00 H new ATOM 0 HA2 GLY A 106 2.905 24.988 10.506 1.00 1.00 H new ATOM 0 HA3 GLY A 106 3.765 25.417 9.041 1.00 1.00 H new ATOM 1179 N ALA A 107 6.032 24.093 9.844 1.00 1.00 N ATOM 1180 CA ALA A 107 6.967 22.980 9.934 1.00 1.00 C ATOM 1181 C ALA A 107 7.347 22.703 11.385 1.00 1.00 C ATOM 1182 O ALA A 107 7.184 23.559 12.255 1.00 1.00 O ATOM 1183 CB ALA A 107 8.231 23.280 9.116 1.00 1.00 C ATOM 0 H ALA A 107 6.422 24.947 9.444 1.00 1.00 H new ATOM 0 HA ALA A 107 6.477 22.095 9.528 1.00 1.00 H new ATOM 0 HB1 ALA A 107 8.921 22.440 9.192 1.00 1.00 H new ATOM 0 HB2 ALA A 107 7.960 23.434 8.071 1.00 1.00 H new ATOM 0 HB3 ALA A 107 8.710 24.179 9.503 1.00 1.00 H new ATOM 1189 N GLN A 108 7.850 21.498 11.641 1.00 1.00 N ATOM 1190 CA GLN A 108 8.245 21.114 12.994 1.00 1.00 C ATOM 1191 C GLN A 108 9.398 20.132 12.950 1.00 1.00 C ATOM 1192 O GLN A 108 9.600 19.440 11.953 1.00 1.00 O ATOM 1193 CB GLN A 108 7.069 20.465 13.722 1.00 1.00 C ATOM 1194 CG GLN A 108 5.878 21.417 13.708 1.00 1.00 C ATOM 1195 CD GLN A 108 4.770 20.892 14.609 1.00 1.00 C ATOM 1196 OE1 GLN A 108 4.162 19.867 14.313 1.00 1.00 O ATOM 1197 NE2 GLN A 108 4.465 21.542 15.698 1.00 1.00 N ATOM 0 H GLN A 108 7.993 20.775 10.936 1.00 1.00 H new ATOM 0 HA GLN A 108 8.555 22.014 13.526 1.00 1.00 H new ATOM 0 HB2 GLN A 108 6.803 19.524 13.240 1.00 1.00 H new ATOM 0 HB3 GLN A 108 7.348 20.229 14.749 1.00 1.00 H new ATOM 0 HG2 GLN A 108 6.191 22.406 14.043 1.00 1.00 H new ATOM 0 HG3 GLN A 108 5.505 21.529 12.690 1.00 1.00 H new ATOM 0 HE21 GLN A 108 4.971 22.393 15.942 1.00 1.00 H new ATOM 0 HE22 GLN A 108 3.721 21.199 16.305 1.00 1.00 H new ATOM 1206 N LEU A 109 10.159 20.066 14.036 1.00 1.00 N ATOM 1207 CA LEU A 109 11.293 19.156 14.104 1.00 1.00 C ATOM 1208 C LEU A 109 10.890 17.834 14.722 1.00 1.00 C ATOM 1209 O LEU A 109 10.586 17.763 15.904 1.00 1.00 O ATOM 1210 CB LEU A 109 12.421 19.789 14.946 1.00 1.00 C ATOM 1211 CG LEU A 109 13.490 20.446 14.046 1.00 1.00 C ATOM 1212 CD1 LEU A 109 14.180 21.599 14.781 1.00 1.00 C ATOM 1213 CD2 LEU A 109 14.530 19.384 13.673 1.00 1.00 C ATOM 0 H LEU A 109 10.012 20.627 14.875 1.00 1.00 H new ATOM 0 HA LEU A 109 11.645 18.975 13.088 1.00 1.00 H new ATOM 0 HB2 LEU A 109 12.000 20.536 15.619 1.00 1.00 H new ATOM 0 HB3 LEU A 109 12.886 19.025 15.568 1.00 1.00 H new ATOM 0 HG LEU A 109 13.013 20.845 13.151 1.00 1.00 H new ATOM 0 HD11 LEU A 109 14.930 22.049 14.130 1.00 1.00 H new ATOM 0 HD12 LEU A 109 13.440 22.351 15.055 1.00 1.00 H new ATOM 0 HD13 LEU A 109 14.662 21.219 15.682 1.00 1.00 H new ATOM 0 HD21 LEU A 109 15.294 19.831 13.037 1.00 1.00 H new ATOM 0 HD22 LEU A 109 14.994 18.995 14.579 1.00 1.00 H new ATOM 0 HD23 LEU A 109 14.042 18.569 13.137 1.00 1.00 H new ATOM 1225 N VAL A 110 10.890 16.781 13.912 1.00 1.00 N ATOM 1226 CA VAL A 110 10.505 15.467 14.383 1.00 1.00 C ATOM 1227 C VAL A 110 11.751 14.625 14.575 1.00 1.00 C ATOM 1228 O VAL A 110 12.847 15.035 14.197 1.00 1.00 O ATOM 1229 CB VAL A 110 9.597 14.795 13.335 1.00 1.00 C ATOM 1230 CG1 VAL A 110 8.510 15.773 12.883 1.00 1.00 C ATOM 1231 CG2 VAL A 110 10.432 14.358 12.111 1.00 1.00 C ATOM 0 H VAL A 110 11.153 16.818 12.927 1.00 1.00 H new ATOM 0 HA VAL A 110 9.969 15.557 15.328 1.00 1.00 H new ATOM 0 HB VAL A 110 9.133 13.918 13.786 1.00 1.00 H new ATOM 0 HG11 VAL A 110 7.872 15.291 12.142 1.00 1.00 H new ATOM 0 HG12 VAL A 110 7.908 16.070 13.742 1.00 1.00 H new ATOM 0 HG13 VAL A 110 8.975 16.655 12.443 1.00 1.00 H new ATOM 0 HG21 VAL A 110 9.781 13.884 11.377 1.00 1.00 H new ATOM 0 HG22 VAL A 110 10.908 15.231 11.664 1.00 1.00 H new ATOM 0 HG23 VAL A 110 11.198 13.650 12.427 1.00 1.00 H new ATOM 1241 N LYS A 111 11.582 13.465 15.190 1.00 1.00 N ATOM 1242 CA LYS A 111 12.715 12.583 15.462 1.00 1.00 C ATOM 1243 C LYS A 111 12.781 11.429 14.465 1.00 1.00 C ATOM 1244 O LYS A 111 11.864 11.220 13.673 1.00 1.00 O ATOM 1245 CB LYS A 111 12.586 12.044 16.892 1.00 1.00 C ATOM 1246 CG LYS A 111 13.946 11.583 17.426 1.00 1.00 C ATOM 1247 CD LYS A 111 13.879 11.445 18.949 1.00 1.00 C ATOM 1248 CE LYS A 111 12.731 10.522 19.342 1.00 1.00 C ATOM 1249 NZ LYS A 111 12.891 10.128 20.770 1.00 1.00 N ATOM 0 H LYS A 111 10.680 13.111 15.510 1.00 1.00 H new ATOM 0 HA LYS A 111 13.638 13.153 15.357 1.00 1.00 H new ATOM 0 HB2 LYS A 111 12.179 12.819 17.542 1.00 1.00 H new ATOM 0 HB3 LYS A 111 11.883 11.212 16.909 1.00 1.00 H new ATOM 0 HG2 LYS A 111 14.220 10.629 16.976 1.00 1.00 H new ATOM 0 HG3 LYS A 111 14.719 12.300 17.149 1.00 1.00 H new ATOM 0 HD2 LYS A 111 14.821 11.048 19.328 1.00 1.00 H new ATOM 0 HD3 LYS A 111 13.740 12.425 19.405 1.00 1.00 H new ATOM 0 HE2 LYS A 111 11.776 11.026 19.196 1.00 1.00 H new ATOM 0 HE3 LYS A 111 12.725 9.637 18.706 1.00 1.00 H new ATOM 0 HZ1 LYS A 111 12.111 9.498 21.046 1.00 1.00 H new ATOM 0 HZ2 LYS A 111 13.797 9.632 20.894 1.00 1.00 H new ATOM 0 HZ3 LYS A 111 12.877 10.978 21.368 1.00 1.00 H new ATOM 1263 N SER A 112 13.876 10.684 14.518 1.00 1.00 N ATOM 1264 CA SER A 112 14.056 9.553 13.624 1.00 1.00 C ATOM 1265 C SER A 112 12.891 8.580 13.758 1.00 1.00 C ATOM 1266 O SER A 112 12.470 7.964 12.779 1.00 1.00 O ATOM 1267 CB SER A 112 15.362 8.836 13.947 1.00 1.00 C ATOM 1268 OG SER A 112 16.455 9.670 13.589 1.00 1.00 O ATOM 0 H SER A 112 14.647 10.842 15.166 1.00 1.00 H new ATOM 0 HA SER A 112 14.092 9.923 12.599 1.00 1.00 H new ATOM 0 HB2 SER A 112 15.405 8.596 15.009 1.00 1.00 H new ATOM 0 HB3 SER A 112 15.416 7.892 13.404 1.00 1.00 H new ATOM 0 HG SER A 112 16.867 10.035 14.400 1.00 1.00 H new ATOM 1274 N ALA A 113 12.370 8.444 14.974 1.00 1.00 N ATOM 1275 CA ALA A 113 11.251 7.539 15.217 1.00 1.00 C ATOM 1276 C ALA A 113 10.029 7.963 14.410 1.00 1.00 C ATOM 1277 O ALA A 113 9.295 7.123 13.891 1.00 1.00 O ATOM 1278 CB ALA A 113 10.900 7.532 16.705 1.00 1.00 C ATOM 0 H ALA A 113 12.701 8.944 15.799 1.00 1.00 H new ATOM 0 HA ALA A 113 11.547 6.537 14.906 1.00 1.00 H new ATOM 0 HB1 ALA A 113 10.064 6.854 16.878 1.00 1.00 H new ATOM 0 HB2 ALA A 113 11.763 7.198 17.281 1.00 1.00 H new ATOM 0 HB3 ALA A 113 10.622 8.538 17.018 1.00 1.00 H new ATOM 1284 N TRP A 114 9.817 9.270 14.302 1.00 1.00 N ATOM 1285 CA TRP A 114 8.679 9.782 13.551 1.00 1.00 C ATOM 1286 C TRP A 114 8.760 9.337 12.097 1.00 1.00 C ATOM 1287 O TRP A 114 7.790 8.823 11.541 1.00 1.00 O ATOM 1288 CB TRP A 114 8.659 11.311 13.617 1.00 1.00 C ATOM 1289 CG TRP A 114 7.589 11.844 12.717 1.00 1.00 C ATOM 1290 CD1 TRP A 114 6.309 12.087 13.083 1.00 1.00 C ATOM 1291 CD2 TRP A 114 7.681 12.187 11.301 1.00 1.00 C ATOM 1292 NE1 TRP A 114 5.622 12.584 11.990 1.00 1.00 N ATOM 1293 CE2 TRP A 114 6.420 12.653 10.869 1.00 1.00 C ATOM 1294 CE3 TRP A 114 8.728 12.144 10.361 1.00 1.00 C ATOM 1295 CZ2 TRP A 114 6.202 13.061 9.554 1.00 1.00 C ATOM 1296 CZ3 TRP A 114 8.510 12.554 9.036 1.00 1.00 C ATOM 1297 CH2 TRP A 114 7.249 13.010 8.634 1.00 1.00 C ATOM 0 H TRP A 114 10.411 9.986 14.720 1.00 1.00 H new ATOM 0 HA TRP A 114 7.764 9.386 13.992 1.00 1.00 H new ATOM 0 HB2 TRP A 114 8.481 11.637 14.642 1.00 1.00 H new ATOM 0 HB3 TRP A 114 9.629 11.710 13.319 1.00 1.00 H new ATOM 0 HD1 TRP A 114 5.893 11.921 14.066 1.00 1.00 H new ATOM 0 HE1 TRP A 114 4.642 12.866 12.011 1.00 1.00 H new ATOM 0 HE3 TRP A 114 9.705 11.794 10.661 1.00 1.00 H new ATOM 0 HZ2 TRP A 114 5.228 13.415 9.249 1.00 1.00 H new ATOM 0 HZ3 TRP A 114 9.320 12.517 8.323 1.00 1.00 H new ATOM 0 HH2 TRP A 114 7.087 13.322 7.613 1.00 1.00 H new ATOM 1308 N LEU A 115 9.916 9.545 11.482 1.00 1.00 N ATOM 1309 CA LEU A 115 10.083 9.161 10.090 1.00 1.00 C ATOM 1310 C LEU A 115 9.937 7.656 9.930 1.00 1.00 C ATOM 1311 O LEU A 115 9.144 7.185 9.117 1.00 1.00 O ATOM 1312 CB LEU A 115 11.463 9.605 9.586 1.00 1.00 C ATOM 1313 CG LEU A 115 11.698 9.099 8.154 1.00 1.00 C ATOM 1314 CD1 LEU A 115 10.554 9.544 7.240 1.00 1.00 C ATOM 1315 CD2 LEU A 115 13.014 9.669 7.623 1.00 1.00 C ATOM 0 H LEU A 115 10.736 9.969 11.915 1.00 1.00 H new ATOM 0 HA LEU A 115 9.309 9.652 9.500 1.00 1.00 H new ATOM 0 HB2 LEU A 115 11.534 10.692 9.611 1.00 1.00 H new ATOM 0 HB3 LEU A 115 12.240 9.220 10.247 1.00 1.00 H new ATOM 0 HG LEU A 115 11.742 8.010 8.168 1.00 1.00 H new ATOM 0 HD11 LEU A 115 10.733 9.179 6.229 1.00 1.00 H new ATOM 0 HD12 LEU A 115 9.613 9.138 7.611 1.00 1.00 H new ATOM 0 HD13 LEU A 115 10.500 10.633 7.228 1.00 1.00 H new ATOM 0 HD21 LEU A 115 13.182 9.311 6.607 1.00 1.00 H new ATOM 0 HD22 LEU A 115 12.964 10.758 7.620 1.00 1.00 H new ATOM 0 HD23 LEU A 115 13.835 9.345 8.262 1.00 1.00 H new ATOM 1327 N SER A 116 10.710 6.903 10.700 1.00 1.00 N ATOM 1328 CA SER A 116 10.659 5.452 10.612 1.00 1.00 C ATOM 1329 C SER A 116 9.222 4.978 10.713 1.00 1.00 C ATOM 1330 O SER A 116 8.776 4.152 9.928 1.00 1.00 O ATOM 1331 CB SER A 116 11.485 4.847 11.748 1.00 1.00 C ATOM 1332 OG SER A 116 11.406 3.429 11.690 1.00 1.00 O ATOM 0 H SER A 116 11.372 7.268 11.385 1.00 1.00 H new ATOM 0 HA SER A 116 11.069 5.133 9.654 1.00 1.00 H new ATOM 0 HB2 SER A 116 12.524 5.167 11.667 1.00 1.00 H new ATOM 0 HB3 SER A 116 11.116 5.203 12.710 1.00 1.00 H new ATOM 0 HG SER A 116 11.937 3.042 12.417 1.00 1.00 H new ATOM 1338 N LEU A 117 8.500 5.512 11.680 1.00 1.00 N ATOM 1339 CA LEU A 117 7.110 5.122 11.861 1.00 1.00 C ATOM 1340 C LEU A 117 6.365 5.242 10.541 1.00 1.00 C ATOM 1341 O LEU A 117 5.660 4.326 10.133 1.00 1.00 O ATOM 1342 CB LEU A 117 6.458 6.032 12.908 1.00 1.00 C ATOM 1343 CG LEU A 117 6.831 5.561 14.325 1.00 1.00 C ATOM 1344 CD1 LEU A 117 6.586 6.699 15.321 1.00 1.00 C ATOM 1345 CD2 LEU A 117 5.982 4.338 14.731 1.00 1.00 C ATOM 0 H LEU A 117 8.843 6.206 12.344 1.00 1.00 H new ATOM 0 HA LEU A 117 7.066 4.087 12.201 1.00 1.00 H new ATOM 0 HB2 LEU A 117 6.785 7.061 12.761 1.00 1.00 H new ATOM 0 HB3 LEU A 117 5.375 6.021 12.786 1.00 1.00 H new ATOM 0 HG LEU A 117 7.884 5.278 14.333 1.00 1.00 H new ATOM 0 HD11 LEU A 117 6.850 6.367 16.325 1.00 1.00 H new ATOM 0 HD12 LEU A 117 7.200 7.558 15.050 1.00 1.00 H new ATOM 0 HD13 LEU A 117 5.534 6.983 15.297 1.00 1.00 H new ATOM 0 HD21 LEU A 117 6.260 4.019 15.736 1.00 1.00 H new ATOM 0 HD22 LEU A 117 4.926 4.607 14.715 1.00 1.00 H new ATOM 0 HD23 LEU A 117 6.160 3.523 14.030 1.00 1.00 H new ATOM 1357 N CYS A 118 6.518 6.373 9.877 1.00 1.00 N ATOM 1358 CA CYS A 118 5.840 6.589 8.610 1.00 1.00 C ATOM 1359 C CYS A 118 6.112 5.419 7.668 1.00 1.00 C ATOM 1360 O CYS A 118 5.251 5.032 6.885 1.00 1.00 O ATOM 1361 CB CYS A 118 6.345 7.880 7.966 1.00 1.00 C ATOM 1362 SG CYS A 118 6.182 9.246 9.142 1.00 1.00 S ATOM 0 H CYS A 118 7.100 7.150 10.189 1.00 1.00 H new ATOM 0 HA CYS A 118 4.768 6.666 8.793 1.00 1.00 H new ATOM 0 HB2 CYS A 118 7.387 7.766 7.667 1.00 1.00 H new ATOM 0 HB3 CYS A 118 5.775 8.095 7.062 1.00 1.00 H new ATOM 0 HG CYS A 118 7.120 9.162 10.038 1.00 1.00 H new ATOM 1368 N LEU A 119 7.315 4.862 7.751 1.00 1.00 N ATOM 1369 CA LEU A 119 7.682 3.733 6.896 1.00 1.00 C ATOM 1370 C LEU A 119 6.920 2.478 7.311 1.00 1.00 C ATOM 1371 O LEU A 119 6.254 1.841 6.494 1.00 1.00 O ATOM 1372 CB LEU A 119 9.188 3.475 7.002 1.00 1.00 C ATOM 1373 CG LEU A 119 9.948 4.791 6.802 1.00 1.00 C ATOM 1374 CD1 LEU A 119 11.454 4.535 6.905 1.00 1.00 C ATOM 1375 CD2 LEU A 119 9.620 5.382 5.424 1.00 1.00 C ATOM 0 H LEU A 119 8.047 5.167 8.393 1.00 1.00 H new ATOM 0 HA LEU A 119 7.423 3.977 5.866 1.00 1.00 H new ATOM 0 HB2 LEU A 119 9.427 3.049 7.977 1.00 1.00 H new ATOM 0 HB3 LEU A 119 9.497 2.747 6.252 1.00 1.00 H new ATOM 0 HG LEU A 119 9.646 5.498 7.574 1.00 1.00 H new ATOM 0 HD11 LEU A 119 11.993 5.472 6.763 1.00 1.00 H new ATOM 0 HD12 LEU A 119 11.687 4.128 7.889 1.00 1.00 H new ATOM 0 HD13 LEU A 119 11.755 3.823 6.137 1.00 1.00 H new ATOM 0 HD21 LEU A 119 10.164 6.317 5.290 1.00 1.00 H new ATOM 0 HD22 LEU A 119 9.914 4.677 4.646 1.00 1.00 H new ATOM 0 HD23 LEU A 119 8.549 5.573 5.355 1.00 1.00 H new ATOM 1387 N GLN A 120 7.032 2.127 8.583 1.00 1.00 N ATOM 1388 CA GLN A 120 6.361 0.939 9.102 1.00 1.00 C ATOM 1389 C GLN A 120 4.850 1.120 9.044 1.00 1.00 C ATOM 1390 O GLN A 120 4.111 0.182 8.742 1.00 1.00 O ATOM 1391 CB GLN A 120 6.794 0.669 10.549 1.00 1.00 C ATOM 1392 CG GLN A 120 8.297 0.898 10.680 1.00 1.00 C ATOM 1393 CD GLN A 120 9.057 0.021 9.688 1.00 1.00 C ATOM 1394 OE1 GLN A 120 8.668 -1.121 9.443 1.00 1.00 O ATOM 1395 NE2 GLN A 120 10.130 0.487 9.107 1.00 1.00 N ATOM 0 H GLN A 120 7.577 2.643 9.274 1.00 1.00 H new ATOM 0 HA GLN A 120 6.643 0.087 8.483 1.00 1.00 H new ATOM 0 HB2 GLN A 120 6.254 1.327 11.230 1.00 1.00 H new ATOM 0 HB3 GLN A 120 6.545 -0.354 10.830 1.00 1.00 H new ATOM 0 HG2 GLN A 120 8.529 1.948 10.499 1.00 1.00 H new ATOM 0 HG3 GLN A 120 8.619 0.671 11.696 1.00 1.00 H new ATOM 0 HE21 GLN A 120 10.450 1.434 9.311 1.00 1.00 H new ATOM 0 HE22 GLN A 120 10.647 -0.096 8.449 1.00 1.00 H new ATOM 1404 N GLU A 121 4.400 2.336 9.335 1.00 1.00 N ATOM 1405 CA GLU A 121 2.976 2.642 9.318 1.00 1.00 C ATOM 1406 C GLU A 121 2.507 2.872 7.891 1.00 1.00 C ATOM 1407 O GLU A 121 1.441 2.402 7.497 1.00 1.00 O ATOM 1408 CB GLU A 121 2.698 3.889 10.158 1.00 1.00 C ATOM 1409 CG GLU A 121 3.059 3.611 11.617 1.00 1.00 C ATOM 1410 CD GLU A 121 2.123 2.555 12.194 1.00 1.00 C ATOM 1411 OE1 GLU A 121 1.050 2.376 11.640 1.00 1.00 O ATOM 1412 OE2 GLU A 121 2.490 1.943 13.183 1.00 1.00 O ATOM 0 H GLU A 121 4.999 3.123 9.585 1.00 1.00 H new ATOM 0 HA GLU A 121 2.432 1.797 9.740 1.00 1.00 H new ATOM 0 HB2 GLU A 121 3.280 4.731 9.782 1.00 1.00 H new ATOM 0 HB3 GLU A 121 1.647 4.167 10.079 1.00 1.00 H new ATOM 0 HG2 GLU A 121 4.092 3.270 11.686 1.00 1.00 H new ATOM 0 HG3 GLU A 121 2.987 4.530 12.199 1.00 1.00 H new ATOM 1419 N ARG A 122 3.313 3.605 7.126 1.00 1.00 N ATOM 1420 CA ARG A 122 2.980 3.909 5.728 1.00 1.00 C ATOM 1421 C ARG A 122 2.017 5.095 5.636 1.00 1.00 C ATOM 1422 O ARG A 122 1.094 5.096 4.823 1.00 1.00 O ATOM 1423 CB ARG A 122 2.350 2.664 5.059 1.00 1.00 C ATOM 1424 CG ARG A 122 2.759 2.587 3.588 1.00 1.00 C ATOM 1425 CD ARG A 122 4.139 1.933 3.486 1.00 1.00 C ATOM 1426 NE ARG A 122 4.065 0.549 3.933 1.00 1.00 N ATOM 1427 CZ ARG A 122 3.594 -0.403 3.140 1.00 1.00 C ATOM 1428 NH1 ARG A 122 3.178 -0.103 1.941 1.00 1.00 N ATOM 1429 NH2 ARG A 122 3.542 -1.635 3.561 1.00 1.00 N ATOM 0 H ARG A 122 4.198 4.000 7.444 1.00 1.00 H new ATOM 0 HA ARG A 122 3.899 4.178 5.207 1.00 1.00 H new ATOM 0 HB2 ARG A 122 2.670 1.762 5.580 1.00 1.00 H new ATOM 0 HB3 ARG A 122 1.264 2.710 5.139 1.00 1.00 H new ATOM 0 HG2 ARG A 122 2.027 2.010 3.024 1.00 1.00 H new ATOM 0 HG3 ARG A 122 2.783 3.585 3.151 1.00 1.00 H new ATOM 0 HD2 ARG A 122 4.495 1.973 2.457 1.00 1.00 H new ATOM 0 HD3 ARG A 122 4.858 2.483 4.094 1.00 1.00 H new ATOM 0 HE ARG A 122 4.381 0.308 4.872 1.00 1.00 H new ATOM 0 HH11 ARG A 122 3.215 0.863 1.615 1.00 1.00 H new ATOM 0 HH12 ARG A 122 2.815 -0.834 1.329 1.00 1.00 H new ATOM 0 HH21 ARG A 122 3.864 -1.867 4.501 1.00 1.00 H new ATOM 0 HH22 ARG A 122 3.180 -2.368 2.951 1.00 1.00 H new ATOM 1443 N ARG A 123 2.241 6.097 6.467 1.00 1.00 N ATOM 1444 CA ARG A 123 1.382 7.272 6.470 1.00 1.00 C ATOM 1445 C ARG A 123 1.992 8.368 7.319 1.00 1.00 C ATOM 1446 O ARG A 123 3.120 8.243 7.795 1.00 1.00 O ATOM 1447 CB ARG A 123 0.002 6.903 7.024 1.00 1.00 C ATOM 1448 CG ARG A 123 0.140 6.137 8.375 1.00 1.00 C ATOM 1449 CD ARG A 123 -0.095 7.085 9.550 1.00 1.00 C ATOM 1450 NE ARG A 123 -1.503 7.440 9.624 1.00 1.00 N ATOM 1451 CZ ARG A 123 -2.381 6.633 10.203 1.00 1.00 C ATOM 1452 NH1 ARG A 123 -1.982 5.499 10.708 1.00 1.00 N ATOM 1453 NH2 ARG A 123 -3.638 6.969 10.260 1.00 1.00 N ATOM 0 H ARG A 123 3.003 6.123 7.144 1.00 1.00 H new ATOM 0 HA ARG A 123 1.279 7.633 5.447 1.00 1.00 H new ATOM 0 HB2 ARG A 123 -0.590 7.806 7.171 1.00 1.00 H new ATOM 0 HB3 ARG A 123 -0.532 6.285 6.302 1.00 1.00 H new ATOM 0 HG2 ARG A 123 -0.578 5.318 8.411 1.00 1.00 H new ATOM 0 HG3 ARG A 123 1.133 5.694 8.450 1.00 1.00 H new ATOM 0 HD2 ARG A 123 0.219 6.611 10.480 1.00 1.00 H new ATOM 0 HD3 ARG A 123 0.510 7.984 9.430 1.00 1.00 H new ATOM 0 HE ARG A 123 -1.820 8.323 9.224 1.00 1.00 H new ATOM 0 HH11 ARG A 123 -0.998 5.236 10.657 1.00 1.00 H new ATOM 0 HH12 ARG A 123 -2.654 4.875 11.154 1.00 1.00 H new ATOM 0 HH21 ARG A 123 -3.948 7.854 9.859 1.00 1.00 H new ATOM 0 HH22 ARG A 123 -4.312 6.347 10.706 1.00 1.00 H new ATOM 1467 N LEU A 124 1.243 9.445 7.514 1.00 1.00 N ATOM 1468 CA LEU A 124 1.724 10.561 8.318 1.00 1.00 C ATOM 1469 C LEU A 124 1.296 10.399 9.770 1.00 1.00 C ATOM 1470 O LEU A 124 0.106 10.310 10.071 1.00 1.00 O ATOM 1471 CB LEU A 124 1.164 11.869 7.766 1.00 1.00 C ATOM 1472 CG LEU A 124 1.675 13.071 8.615 1.00 1.00 C ATOM 1473 CD1 LEU A 124 2.081 14.228 7.699 1.00 1.00 C ATOM 1474 CD2 LEU A 124 0.571 13.556 9.571 1.00 1.00 C ATOM 0 H LEU A 124 0.306 9.570 7.130 1.00 1.00 H new ATOM 0 HA LEU A 124 2.813 10.578 8.273 1.00 1.00 H new ATOM 0 HB2 LEU A 124 1.467 11.993 6.726 1.00 1.00 H new ATOM 0 HB3 LEU A 124 0.074 11.841 7.779 1.00 1.00 H new ATOM 0 HG LEU A 124 2.538 12.740 9.193 1.00 1.00 H new ATOM 0 HD11 LEU A 124 2.437 15.063 8.303 1.00 1.00 H new ATOM 0 HD12 LEU A 124 2.876 13.900 7.029 1.00 1.00 H new ATOM 0 HD13 LEU A 124 1.220 14.546 7.111 1.00 1.00 H new ATOM 0 HD21 LEU A 124 0.942 14.396 10.158 1.00 1.00 H new ATOM 0 HD22 LEU A 124 -0.298 13.872 8.993 1.00 1.00 H new ATOM 0 HD23 LEU A 124 0.286 12.744 10.240 1.00 1.00 H new ATOM 1486 N VAL A 125 2.277 10.362 10.671 1.00 1.00 N ATOM 1487 CA VAL A 125 2.003 10.207 12.102 1.00 1.00 C ATOM 1488 C VAL A 125 2.164 11.544 12.818 1.00 1.00 C ATOM 1489 O VAL A 125 2.929 12.407 12.388 1.00 1.00 O ATOM 1490 CB VAL A 125 2.964 9.171 12.709 1.00 1.00 C ATOM 1491 CG1 VAL A 125 2.477 7.756 12.378 1.00 1.00 C ATOM 1492 CG2 VAL A 125 4.364 9.372 12.119 1.00 1.00 C ATOM 0 H VAL A 125 3.267 10.437 10.438 1.00 1.00 H new ATOM 0 HA VAL A 125 0.977 9.862 12.228 1.00 1.00 H new ATOM 0 HB VAL A 125 2.996 9.300 13.791 1.00 1.00 H new ATOM 0 HG11 VAL A 125 3.161 7.025 12.810 1.00 1.00 H new ATOM 0 HG12 VAL A 125 1.480 7.608 12.792 1.00 1.00 H new ATOM 0 HG13 VAL A 125 2.444 7.626 11.296 1.00 1.00 H new ATOM 0 HG21 VAL A 125 5.048 8.639 12.547 1.00 1.00 H new ATOM 0 HG22 VAL A 125 4.325 9.243 11.037 1.00 1.00 H new ATOM 0 HG23 VAL A 125 4.716 10.377 12.352 1.00 1.00 H new ATOM 1502 N ASP A 126 1.428 11.703 13.909 1.00 1.00 N ATOM 1503 CA ASP A 126 1.478 12.932 14.686 1.00 1.00 C ATOM 1504 C ASP A 126 2.846 13.089 15.336 1.00 1.00 C ATOM 1505 O ASP A 126 3.496 12.106 15.688 1.00 1.00 O ATOM 1506 CB ASP A 126 0.393 12.917 15.766 1.00 1.00 C ATOM 1507 CG ASP A 126 0.571 11.703 16.674 1.00 1.00 C ATOM 1508 OD1 ASP A 126 1.590 11.047 16.561 1.00 1.00 O ATOM 1509 OD2 ASP A 126 -0.323 11.446 17.465 1.00 1.00 O ATOM 0 H ASP A 126 0.790 10.997 14.275 1.00 1.00 H new ATOM 0 HA ASP A 126 1.304 13.774 14.016 1.00 1.00 H new ATOM 0 HB2 ASP A 126 0.444 13.832 16.356 1.00 1.00 H new ATOM 0 HB3 ASP A 126 -0.593 12.892 15.301 1.00 1.00 H new ATOM 1514 N VAL A 127 3.282 14.336 15.488 1.00 1.00 N ATOM 1515 CA VAL A 127 4.581 14.625 16.096 1.00 1.00 C ATOM 1516 C VAL A 127 4.403 15.062 17.549 1.00 1.00 C ATOM 1517 O VAL A 127 3.613 14.473 18.288 1.00 1.00 O ATOM 1518 CB VAL A 127 5.286 15.727 15.297 1.00 1.00 C ATOM 1519 CG1 VAL A 127 5.471 15.261 13.851 1.00 1.00 C ATOM 1520 CG2 VAL A 127 4.454 17.025 15.322 1.00 1.00 C ATOM 0 H VAL A 127 2.758 15.162 15.200 1.00 1.00 H new ATOM 0 HA VAL A 127 5.190 13.721 16.080 1.00 1.00 H new ATOM 0 HB VAL A 127 6.258 15.928 15.748 1.00 1.00 H new ATOM 0 HG11 VAL A 127 5.972 16.042 13.278 1.00 1.00 H new ATOM 0 HG12 VAL A 127 6.076 14.354 13.835 1.00 1.00 H new ATOM 0 HG13 VAL A 127 4.497 15.055 13.408 1.00 1.00 H new ATOM 0 HG21 VAL A 127 4.968 17.798 14.750 1.00 1.00 H new ATOM 0 HG22 VAL A 127 3.475 16.838 14.881 1.00 1.00 H new ATOM 0 HG23 VAL A 127 4.330 17.358 16.352 1.00 1.00 H new ATOM 1530 N ALA A 128 5.137 16.096 17.949 1.00 1.00 N ATOM 1531 CA ALA A 128 5.057 16.608 19.306 1.00 1.00 C ATOM 1532 C ALA A 128 5.772 15.670 20.268 1.00 1.00 C ATOM 1533 O ALA A 128 6.737 16.057 20.928 1.00 1.00 O ATOM 1534 CB ALA A 128 3.588 16.772 19.711 1.00 1.00 C ATOM 0 H ALA A 128 5.794 16.594 17.349 1.00 1.00 H new ATOM 0 HA ALA A 128 5.547 17.581 19.349 1.00 1.00 H new ATOM 0 HB1 ALA A 128 3.532 17.156 20.730 1.00 1.00 H new ATOM 0 HB2 ALA A 128 3.099 17.471 19.032 1.00 1.00 H new ATOM 0 HB3 ALA A 128 3.086 15.806 19.660 1.00 1.00 H new ATOM 1540 N GLY A 129 5.295 14.434 20.336 1.00 1.00 N ATOM 1541 CA GLY A 129 5.898 13.448 21.218 1.00 1.00 C ATOM 1542 C GLY A 129 7.320 13.126 20.785 1.00 1.00 C ATOM 1543 O GLY A 129 8.257 13.213 21.579 1.00 1.00 O ATOM 0 H GLY A 129 4.500 14.094 19.796 1.00 1.00 H new ATOM 0 HA2 GLY A 129 5.902 13.824 22.241 1.00 1.00 H new ATOM 0 HA3 GLY A 129 5.298 12.538 21.216 1.00 1.00 H new ATOM 1547 N PHE A 130 7.475 12.755 19.518 1.00 1.00 N ATOM 1548 CA PHE A 130 8.792 12.421 18.988 1.00 1.00 C ATOM 1549 C PHE A 130 9.657 13.673 18.878 1.00 1.00 C ATOM 1550 O PHE A 130 10.839 13.656 19.215 1.00 1.00 O ATOM 1551 CB PHE A 130 8.654 11.772 17.609 1.00 1.00 C ATOM 1552 CG PHE A 130 7.760 10.558 17.714 1.00 1.00 C ATOM 1553 CD1 PHE A 130 8.205 9.412 18.385 1.00 1.00 C ATOM 1554 CD2 PHE A 130 6.482 10.581 17.141 1.00 1.00 C ATOM 1555 CE1 PHE A 130 7.373 8.291 18.483 1.00 1.00 C ATOM 1556 CE2 PHE A 130 5.651 9.461 17.239 1.00 1.00 C ATOM 1557 CZ PHE A 130 6.096 8.315 17.909 1.00 1.00 C ATOM 0 H PHE A 130 6.713 12.678 18.845 1.00 1.00 H new ATOM 0 HA PHE A 130 9.270 11.720 19.672 1.00 1.00 H new ATOM 0 HB2 PHE A 130 8.235 12.485 16.899 1.00 1.00 H new ATOM 0 HB3 PHE A 130 9.635 11.484 17.231 1.00 1.00 H new ATOM 0 HD1 PHE A 130 9.190 9.393 18.827 1.00 1.00 H new ATOM 0 HD2 PHE A 130 6.138 11.464 16.623 1.00 1.00 H new ATOM 0 HE1 PHE A 130 7.716 7.408 19.001 1.00 1.00 H new ATOM 0 HE2 PHE A 130 4.665 9.480 16.798 1.00 1.00 H new ATOM 0 HZ PHE A 130 5.454 7.449 17.983 1.00 1.00 H new ATOM 1567 N SER A 131 9.055 14.760 18.403 1.00 1.00 N ATOM 1568 CA SER A 131 9.772 16.013 18.244 1.00 1.00 C ATOM 1569 C SER A 131 10.342 16.476 19.574 1.00 1.00 C ATOM 1570 O SER A 131 9.817 16.144 20.636 1.00 1.00 O ATOM 1571 CB SER A 131 8.823 17.075 17.694 1.00 1.00 C ATOM 1572 OG SER A 131 7.630 17.074 18.455 1.00 1.00 O ATOM 0 H SER A 131 8.075 14.794 18.123 1.00 1.00 H new ATOM 0 HA SER A 131 10.597 15.860 17.548 1.00 1.00 H new ATOM 0 HB2 SER A 131 9.294 18.057 17.736 1.00 1.00 H new ATOM 0 HB3 SER A 131 8.600 16.873 16.646 1.00 1.00 H new ATOM 0 HG SER A 131 7.826 16.784 19.370 1.00 1.00 H new ATOM 1578 N ILE A 132 11.423 17.248 19.509 1.00 1.00 N ATOM 1579 CA ILE A 132 12.063 17.747 20.722 1.00 1.00 C ATOM 1580 C ILE A 132 11.471 19.073 21.115 1.00 1.00 C ATOM 1581 O ILE A 132 10.969 19.215 22.225 1.00 1.00 O ATOM 1582 CB ILE A 132 13.568 17.908 20.494 1.00 1.00 C ATOM 1583 CG1 ILE A 132 14.130 16.634 19.808 1.00 1.00 C ATOM 1584 CG2 ILE A 132 14.261 18.135 21.847 1.00 1.00 C ATOM 1585 CD1 ILE A 132 14.357 16.893 18.318 1.00 1.00 C ATOM 0 H ILE A 132 11.870 17.539 18.640 1.00 1.00 H new ATOM 0 HA ILE A 132 11.894 17.028 21.524 1.00 1.00 H new ATOM 0 HB ILE A 132 13.756 18.765 19.847 1.00 1.00 H new ATOM 0 HG12 ILE A 132 15.068 16.341 20.281 1.00 1.00 H new ATOM 0 HG13 ILE A 132 13.435 15.805 19.939 1.00 1.00 H new ATOM 0 HG21 ILE A 132 15.334 18.250 21.692 1.00 1.00 H new ATOM 0 HG22 ILE A 132 13.863 19.036 22.313 1.00 1.00 H new ATOM 0 HG23 ILE A 132 14.079 17.279 22.497 1.00 1.00 H new ATOM 0 HD11 ILE A 132 14.751 15.992 17.848 1.00 1.00 H new ATOM 0 HD12 ILE A 132 13.412 17.164 17.848 1.00 1.00 H new ATOM 0 HD13 ILE A 132 15.070 17.708 18.195 1.00 1.00 H new ATOM 1597 N PHE A 133 11.541 20.030 20.199 1.00 1.00 N ATOM 1598 CA PHE A 133 11.007 21.364 20.439 1.00 1.00 C ATOM 1599 C PHE A 133 11.766 22.075 21.548 1.00 1.00 C ATOM 1600 O PHE A 133 11.920 23.285 21.475 1.00 1.00 O ATOM 1601 CB PHE A 133 9.501 21.301 20.787 1.00 1.00 C ATOM 1602 CG PHE A 133 9.019 22.638 21.328 1.00 1.00 C ATOM 1603 CD1 PHE A 133 9.214 23.808 20.583 1.00 1.00 C ATOM 1604 CD2 PHE A 133 8.388 22.708 22.581 1.00 1.00 C ATOM 1605 CE1 PHE A 133 8.776 25.036 21.084 1.00 1.00 C ATOM 1606 CE2 PHE A 133 7.953 23.936 23.080 1.00 1.00 C ATOM 1607 CZ PHE A 133 8.146 25.102 22.332 1.00 1.00 C ATOM 0 H PHE A 133 11.964 19.906 19.279 1.00 1.00 H new ATOM 0 HA PHE A 133 11.133 21.934 19.518 1.00 1.00 H new ATOM 0 HB2 PHE A 133 8.928 21.034 19.899 1.00 1.00 H new ATOM 0 HB3 PHE A 133 9.326 20.519 21.526 1.00 1.00 H new ATOM 0 HD1 PHE A 133 9.703 23.761 19.621 1.00 1.00 H new ATOM 0 HD2 PHE A 133 8.239 21.808 23.160 1.00 1.00 H new ATOM 0 HE1 PHE A 133 8.924 25.937 20.507 1.00 1.00 H new ATOM 0 HE2 PHE A 133 7.467 23.986 24.043 1.00 1.00 H new ATOM 0 HZ PHE A 133 7.809 26.053 22.717 1.00 1.00 H new ATOM 1617 N ILE A 134 12.196 21.305 22.565 1.00 1.00 N ATOM 1618 CA ILE A 134 12.914 21.815 23.738 1.00 1.00 C ATOM 1619 C ILE A 134 12.714 20.864 24.926 1.00 1.00 C ATOM 1620 O ILE A 134 13.685 20.407 25.525 1.00 1.00 O ATOM 1621 CB ILE A 134 12.426 23.243 24.104 1.00 1.00 C ATOM 1622 CG1 ILE A 134 13.320 24.289 23.400 1.00 1.00 C ATOM 1623 CG2 ILE A 134 12.457 23.480 25.645 1.00 1.00 C ATOM 1624 CD1 ILE A 134 14.521 24.648 24.268 1.00 1.00 C ATOM 0 H ILE A 134 12.050 20.296 22.591 1.00 1.00 H new ATOM 0 HA ILE A 134 13.976 21.869 23.499 1.00 1.00 H new ATOM 0 HB ILE A 134 11.394 23.346 23.768 1.00 1.00 H new ATOM 0 HG12 ILE A 134 13.662 23.896 22.443 1.00 1.00 H new ATOM 0 HG13 ILE A 134 12.739 25.186 23.187 1.00 1.00 H new ATOM 0 HG21 ILE A 134 12.109 24.489 25.865 1.00 1.00 H new ATOM 0 HG22 ILE A 134 11.807 22.757 26.137 1.00 1.00 H new ATOM 0 HG23 ILE A 134 13.477 23.360 26.011 1.00 1.00 H new ATOM 0 HD11 ILE A 134 15.136 25.386 23.752 1.00 1.00 H new ATOM 0 HD12 ILE A 134 14.175 25.063 25.215 1.00 1.00 H new ATOM 0 HD13 ILE A 134 15.113 23.753 24.459 1.00 1.00 H new ATOM 1636 N PRO A 135 11.483 20.590 25.300 1.00 1.00 N ATOM 1637 CA PRO A 135 11.184 19.717 26.470 1.00 1.00 C ATOM 1638 C PRO A 135 11.786 18.325 26.313 1.00 1.00 C ATOM 1639 O PRO A 135 12.442 17.872 27.241 1.00 1.00 O ATOM 1640 CB PRO A 135 9.638 19.680 26.509 1.00 1.00 C ATOM 1641 CG PRO A 135 9.205 20.065 25.135 1.00 1.00 C ATOM 1642 CD PRO A 135 10.240 21.054 24.652 1.00 1.00 C ATOM 1643 OXT PRO A 135 11.587 17.732 25.268 1.00 1.00 O ATOM 0 HA PRO A 135 11.618 20.094 27.396 1.00 1.00 H new ATOM 0 HB2 PRO A 135 9.274 18.687 26.773 1.00 1.00 H new ATOM 0 HB3 PRO A 135 9.246 20.372 27.254 1.00 1.00 H new ATOM 0 HG2 PRO A 135 9.157 19.195 24.480 1.00 1.00 H new ATOM 0 HG3 PRO A 135 8.210 20.511 25.147 1.00 1.00 H new ATOM 0 HD2 PRO A 135 10.326 21.047 23.565 1.00 1.00 H new ATOM 0 HD3 PRO A 135 9.990 22.073 24.946 1.00 1.00 H new TER 1651 PRO A 135