USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1286 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 51 TYR OH : rot -142:sc= 0.312 USER MOD Set 1.2: A 173 THR OG1 : rot 110:sc= 0 USER MOD Set 2.1: A 127 TYR OH : rot -49:sc= -0.238 USER MOD Set 2.2: A 154 CYS SG : rot 153:sc= -0.747 USER MOD Set 2.3: A 162 CYS SG : rot 180:sc= 0.185 USER MOD Set 3.1: A 15 ASN : amide:sc= 0.589 K(o=2.1,f=-1.9!) USER MOD Set 3.2: A 19 LYS NZ :NH3+ -131:sc= 1.27 (180deg=0.146) USER MOD Set 3.3: A 150 TYR OH : rot 180:sc= 0.263 USER MOD Set 4.1: A 60 HIS : no HD1:sc= -0.0997 X(o=-0.32,f=-0.37) USER MOD Set 4.2: A 80 HIS : no HD1:sc= -0.161! K(o=-0.32!,f=-7.2) USER MOD Set 4.3: A 83 THR OG1 : rot -102:sc= 0.658 USER MOD Set 4.4: A 96 HIS : no HE2:sc= -0.723! C(o=-0.32!,f=-9.9!) USER MOD Set 5.1: A 70 THR OG1 : rot 125:sc= 0.47 USER MOD Set 5.2: A 100 GLN : amide:sc= -0.169 K(o=0.3,f=-0.86) USER MOD Set 6.1: A 43 SER OG : rot -126:sc= 0.483 USER MOD Set 6.2: A 156 TYR OH : rot 180:sc= 0.441 USER MOD Single : A 5 THR OG1 : rot 22:sc= 0.335 USER MOD Single : A 10 THR OG1 : rot 53:sc= 1.12 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 GLN : amide:sc= -0.275 X(o=-0.28,f=-0.77) USER MOD Single : A 24 SER OG : rot 76:sc= 0.644 USER MOD Single : A 26 HIS : no HD1:sc= -2.62! C(o=-2.6!,f=-4.5!) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 SER OG : rot 38:sc= 0.0391 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 50:sc= 0.214 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot 58:sc= 0.422 USER MOD Single : A 85 SER OG : rot 34:sc= 0.191 USER MOD Single : A 92 SER OG : rot 23:sc= 0.242 USER MOD Single : A 105 SER OG : rot -44:sc= 0.193 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ -112:sc= 0.176 (180deg=-0.752) USER MOD Single : A 116 THR OG1 : rot -81:sc= 0.631 USER MOD Single : A 117 THR OG1 : rot 79:sc= -0.233 USER MOD Single : A 119 GLN : amide:sc= -0.0171 X(o=-0.017,f=-0.34) USER MOD Single : A 120 GLN : amide:sc= -0.362 K(o=-0.36,f=-1.5) USER MOD Single : A 121 SER OG : rot -20:sc= 1.94 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 MET CE :methyl -154:sc= -0.188 (180deg=-1.59!) USER MOD Single : A 137 SER OG : rot 180:sc= -0.207 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN :FLIP amide:sc= -0.809 F(o=-1.9,f=-0.81) USER MOD Single : A 151 SER OG : rot -57:sc= 0.67 USER MOD Single : A 157 SER OG : rot -171:sc= -1.78! USER MOD Single : A 159 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 168 SER OG : rot -105:sc= 0.348 USER MOD Single : A 169 ASN : amide:sc= -1.06! C(o=-1.1!,f=-5.1!) USER MOD Single : A 176 THR OG1 : rot 43:sc= 0.197 USER MOD ----------------------------------------------------------------- ATOM 59 N THR A 5 -13.437 1.027 -16.340 1.00 33.32 N ATOM 60 CA THR A 5 -12.754 0.050 -15.478 1.00 13.32 C ATOM 61 C THR A 5 -11.500 -0.542 -16.165 1.00 40.31 C ATOM 62 O THR A 5 -10.554 -0.966 -15.488 1.00 41.34 O ATOM 63 CB THR A 5 -13.763 -1.083 -15.080 1.00 33.12 C ATOM 64 OG1 THR A 5 -15.015 -0.483 -14.700 1.00 3.13 O ATOM 65 CG2 THR A 5 -13.259 -1.964 -13.914 1.00 61.05 C ATOM 0 HA THR A 5 -12.410 0.561 -14.579 1.00 13.32 H new ATOM 0 HB THR A 5 -13.876 -1.730 -15.950 1.00 33.12 H new ATOM 0 HG1 THR A 5 -15.084 0.410 -15.098 1.00 3.13 H new ATOM 0 HG21 THR A 5 -14.003 -2.728 -13.688 1.00 61.05 H new ATOM 0 HG22 THR A 5 -12.322 -2.443 -14.198 1.00 61.05 H new ATOM 0 HG23 THR A 5 -13.097 -1.343 -13.033 1.00 61.05 H new ATOM 73 N GLU A 6 -11.490 -0.560 -17.519 1.00 55.01 N ATOM 74 CA GLU A 6 -10.323 -1.033 -18.295 1.00 51.03 C ATOM 75 C GLU A 6 -9.159 -0.042 -18.197 1.00 4.51 C ATOM 76 O GLU A 6 -8.012 -0.442 -18.341 1.00 5.01 O ATOM 77 CB GLU A 6 -10.680 -1.303 -19.778 1.00 45.40 C ATOM 78 CG GLU A 6 -11.006 -0.051 -20.603 1.00 14.05 C ATOM 79 CD GLU A 6 -11.382 -0.363 -22.058 1.00 5.20 C ATOM 80 OE1 GLU A 6 -12.497 -0.870 -22.297 1.00 13.50 O ATOM 81 OE2 GLU A 6 -10.560 -0.120 -22.969 1.00 32.25 O ATOM 0 H GLU A 6 -12.275 -0.253 -18.093 1.00 55.01 H new ATOM 0 HA GLU A 6 -10.013 -1.980 -17.854 1.00 51.03 H new ATOM 0 HB2 GLU A 6 -9.846 -1.823 -20.248 1.00 45.40 H new ATOM 0 HB3 GLU A 6 -11.536 -1.977 -19.813 1.00 45.40 H new ATOM 0 HG2 GLU A 6 -11.829 0.484 -20.129 1.00 14.05 H new ATOM 0 HG3 GLU A 6 -10.144 0.617 -20.593 1.00 14.05 H new ATOM 88 N ASP A 7 -9.466 1.247 -17.943 1.00 1.42 N ATOM 89 CA ASP A 7 -8.441 2.295 -17.745 1.00 65.03 C ATOM 90 C ASP A 7 -7.744 2.111 -16.381 1.00 12.14 C ATOM 91 O ASP A 7 -6.541 2.367 -16.246 1.00 23.24 O ATOM 92 CB ASP A 7 -9.073 3.701 -17.876 1.00 54.45 C ATOM 93 CG ASP A 7 -8.051 4.845 -17.731 1.00 74.24 C ATOM 94 OD1 ASP A 7 -7.233 5.047 -18.657 1.00 31.50 O ATOM 95 OD2 ASP A 7 -8.050 5.536 -16.691 1.00 70.14 O ATOM 0 H ASP A 7 -10.424 1.590 -17.870 1.00 1.42 H new ATOM 0 HA ASP A 7 -7.683 2.200 -18.522 1.00 65.03 H new ATOM 0 HB2 ASP A 7 -9.564 3.782 -18.846 1.00 54.45 H new ATOM 0 HB3 ASP A 7 -9.847 3.816 -17.117 1.00 54.45 H new ATOM 100 N TRP A 8 -8.519 1.692 -15.367 1.00 40.42 N ATOM 101 CA TRP A 8 -7.963 1.164 -14.103 1.00 42.42 C ATOM 102 C TRP A 8 -7.062 -0.065 -14.368 1.00 53.12 C ATOM 103 O TRP A 8 -6.009 -0.214 -13.748 1.00 71.41 O ATOM 104 CB TRP A 8 -9.106 0.814 -13.112 1.00 25.25 C ATOM 105 CG TRP A 8 -8.687 -0.026 -11.910 1.00 63.02 C ATOM 106 CD1 TRP A 8 -7.951 0.375 -10.824 1.00 21.11 C ATOM 107 CD2 TRP A 8 -8.982 -1.417 -11.690 1.00 12.42 C ATOM 108 NE1 TRP A 8 -7.799 -0.668 -9.949 1.00 64.54 N ATOM 109 CE2 TRP A 8 -8.416 -1.776 -10.456 1.00 24.03 C ATOM 110 CE3 TRP A 8 -9.677 -2.386 -12.419 1.00 12.42 C ATOM 111 CZ2 TRP A 8 -8.517 -3.063 -9.936 1.00 14.00 C ATOM 112 CZ3 TRP A 8 -9.783 -3.660 -11.898 1.00 35.34 C ATOM 113 CH2 TRP A 8 -9.204 -3.990 -10.666 1.00 54.23 C ATOM 0 H TRP A 8 -9.538 1.708 -15.396 1.00 40.42 H new ATOM 0 HA TRP A 8 -7.344 1.938 -13.650 1.00 42.42 H new ATOM 0 HB2 TRP A 8 -9.549 1.742 -12.750 1.00 25.25 H new ATOM 0 HB3 TRP A 8 -9.885 0.279 -13.655 1.00 25.25 H new ATOM 0 HD1 TRP A 8 -7.550 1.367 -10.680 1.00 21.11 H new ATOM 0 HE1 TRP A 8 -7.303 -0.624 -9.059 1.00 64.54 H new ATOM 0 HE3 TRP A 8 -10.123 -2.143 -13.372 1.00 12.42 H new ATOM 0 HZ2 TRP A 8 -8.068 -3.320 -8.988 1.00 14.00 H new ATOM 0 HZ3 TRP A 8 -10.322 -4.416 -12.450 1.00 35.34 H new ATOM 0 HH2 TRP A 8 -9.303 -4.996 -10.286 1.00 54.23 H new ATOM 124 N GLU A 9 -7.487 -0.944 -15.284 1.00 53.23 N ATOM 125 CA GLU A 9 -6.707 -2.146 -15.649 1.00 72.41 C ATOM 126 C GLU A 9 -5.507 -1.764 -16.574 1.00 74.53 C ATOM 127 O GLU A 9 -4.561 -2.548 -16.739 1.00 4.42 O ATOM 128 CB GLU A 9 -7.648 -3.205 -16.291 1.00 31.42 C ATOM 129 CG GLU A 9 -7.075 -4.636 -16.354 1.00 72.33 C ATOM 130 CD GLU A 9 -8.103 -5.666 -16.851 1.00 5.50 C ATOM 131 OE1 GLU A 9 -8.925 -6.147 -16.035 1.00 52.44 O ATOM 132 OE2 GLU A 9 -8.115 -5.981 -18.065 1.00 32.34 O ATOM 0 H GLU A 9 -8.368 -0.850 -15.790 1.00 53.23 H new ATOM 0 HA GLU A 9 -6.276 -2.591 -14.752 1.00 72.41 H new ATOM 0 HB2 GLU A 9 -8.581 -3.228 -15.728 1.00 31.42 H new ATOM 0 HB3 GLU A 9 -7.894 -2.884 -17.303 1.00 31.42 H new ATOM 0 HG2 GLU A 9 -6.208 -4.647 -17.014 1.00 72.33 H new ATOM 0 HG3 GLU A 9 -6.725 -4.927 -15.363 1.00 72.33 H new ATOM 139 N THR A 10 -5.550 -0.534 -17.145 1.00 12.31 N ATOM 140 CA THR A 10 -4.450 0.052 -17.943 1.00 73.05 C ATOM 141 C THR A 10 -3.314 0.528 -17.013 1.00 62.44 C ATOM 142 O THR A 10 -2.138 0.214 -17.252 1.00 52.43 O ATOM 143 CB THR A 10 -4.951 1.260 -18.819 1.00 20.31 C ATOM 144 OG1 THR A 10 -5.966 0.830 -19.742 1.00 74.12 O ATOM 145 CG2 THR A 10 -3.820 1.951 -19.608 1.00 2.24 C ATOM 0 H THR A 10 -6.358 0.083 -17.062 1.00 12.31 H new ATOM 0 HA THR A 10 -4.078 -0.725 -18.611 1.00 73.05 H new ATOM 0 HB THR A 10 -5.358 1.988 -18.117 1.00 20.31 H new ATOM 0 HG1 THR A 10 -6.678 0.367 -19.253 1.00 74.12 H new ATOM 0 HG21 THR A 10 -4.233 2.774 -20.191 1.00 2.24 H new ATOM 0 HG22 THR A 10 -3.074 2.337 -18.913 1.00 2.24 H new ATOM 0 HG23 THR A 10 -3.352 1.231 -20.279 1.00 2.24 H new ATOM 153 N GLN A 11 -3.658 1.318 -15.965 1.00 51.03 N ATOM 154 CA GLN A 11 -2.670 1.711 -14.939 1.00 51.51 C ATOM 155 C GLN A 11 -2.130 0.456 -14.226 1.00 30.55 C ATOM 156 O GLN A 11 -0.961 0.412 -13.869 1.00 55.22 O ATOM 157 CB GLN A 11 -3.238 2.723 -13.889 1.00 21.25 C ATOM 158 CG GLN A 11 -4.269 2.138 -12.904 1.00 5.32 C ATOM 159 CD GLN A 11 -4.519 3.003 -11.668 1.00 21.43 C ATOM 160 OE1 GLN A 11 -3.818 2.872 -10.664 1.00 71.25 O ATOM 161 NE2 GLN A 11 -5.520 3.866 -11.717 1.00 42.34 N ATOM 0 H GLN A 11 -4.596 1.688 -15.813 1.00 51.03 H new ATOM 0 HA GLN A 11 -1.862 2.225 -15.460 1.00 51.51 H new ATOM 0 HB2 GLN A 11 -2.406 3.134 -13.317 1.00 21.25 H new ATOM 0 HB3 GLN A 11 -3.700 3.554 -14.422 1.00 21.25 H new ATOM 0 HG2 GLN A 11 -5.213 1.993 -13.428 1.00 5.32 H new ATOM 0 HG3 GLN A 11 -3.929 1.154 -12.582 1.00 5.32 H new ATOM 0 HE21 GLN A 11 -6.081 3.949 -12.565 1.00 42.34 H new ATOM 0 HE22 GLN A 11 -5.731 4.449 -10.907 1.00 42.34 H new ATOM 170 N LEU A 12 -3.004 -0.562 -14.050 1.00 43.25 N ATOM 171 CA LEU A 12 -2.664 -1.832 -13.384 1.00 22.11 C ATOM 172 C LEU A 12 -1.591 -2.610 -14.163 1.00 52.43 C ATOM 173 O LEU A 12 -0.603 -3.041 -13.566 1.00 33.32 O ATOM 174 CB LEU A 12 -3.946 -2.691 -13.206 1.00 3.00 C ATOM 175 CG LEU A 12 -3.761 -4.192 -12.807 1.00 51.51 C ATOM 176 CD1 LEU A 12 -3.037 -4.356 -11.450 1.00 73.54 C ATOM 177 CD2 LEU A 12 -5.120 -4.930 -12.842 1.00 45.22 C ATOM 0 H LEU A 12 -3.972 -0.520 -14.370 1.00 43.25 H new ATOM 0 HA LEU A 12 -2.248 -1.603 -12.403 1.00 22.11 H new ATOM 0 HB2 LEU A 12 -4.567 -2.215 -12.447 1.00 3.00 H new ATOM 0 HB3 LEU A 12 -4.505 -2.658 -14.141 1.00 3.00 H new ATOM 0 HG LEU A 12 -3.109 -4.656 -13.547 1.00 51.51 H new ATOM 0 HD11 LEU A 12 -2.933 -5.416 -11.219 1.00 73.54 H new ATOM 0 HD12 LEU A 12 -2.049 -3.899 -11.507 1.00 73.54 H new ATOM 0 HD13 LEU A 12 -3.618 -3.869 -10.667 1.00 73.54 H new ATOM 0 HD21 LEU A 12 -4.975 -5.973 -12.562 1.00 45.22 H new ATOM 0 HD22 LEU A 12 -5.808 -4.458 -12.141 1.00 45.22 H new ATOM 0 HD23 LEU A 12 -5.536 -4.879 -13.848 1.00 45.22 H new ATOM 189 N GLN A 13 -1.789 -2.804 -15.490 1.00 21.01 N ATOM 190 CA GLN A 13 -0.826 -3.567 -16.324 1.00 0.42 C ATOM 191 C GLN A 13 0.553 -2.874 -16.331 1.00 41.14 C ATOM 192 O GLN A 13 1.586 -3.541 -16.414 1.00 31.02 O ATOM 193 CB GLN A 13 -1.370 -3.799 -17.767 1.00 35.44 C ATOM 194 CG GLN A 13 -1.497 -2.532 -18.634 1.00 41.23 C ATOM 195 CD GLN A 13 -2.140 -2.746 -20.014 1.00 25.23 C ATOM 196 OE1 GLN A 13 -2.788 -1.841 -20.544 1.00 21.43 O ATOM 197 NE2 GLN A 13 -1.948 -3.915 -20.618 1.00 62.04 N ATOM 0 H GLN A 13 -2.596 -2.448 -16.001 1.00 21.01 H new ATOM 0 HA GLN A 13 -0.700 -4.553 -15.878 1.00 0.42 H new ATOM 0 HB2 GLN A 13 -0.713 -4.504 -18.276 1.00 35.44 H new ATOM 0 HB3 GLN A 13 -2.350 -4.271 -17.697 1.00 35.44 H new ATOM 0 HG2 GLN A 13 -2.085 -1.794 -18.087 1.00 41.23 H new ATOM 0 HG3 GLN A 13 -0.503 -2.107 -18.776 1.00 41.23 H new ATOM 0 HE21 GLN A 13 -1.407 -4.646 -20.155 1.00 62.04 H new ATOM 0 HE22 GLN A 13 -2.341 -4.081 -21.544 1.00 62.04 H new ATOM 206 N ALA A 14 0.540 -1.531 -16.181 1.00 64.45 N ATOM 207 CA ALA A 14 1.760 -0.718 -16.055 1.00 44.12 C ATOM 208 C ALA A 14 2.413 -0.900 -14.662 1.00 71.23 C ATOM 209 O ALA A 14 3.628 -1.102 -14.577 1.00 21.01 O ATOM 210 CB ALA A 14 1.442 0.762 -16.340 1.00 1.22 C ATOM 0 H ALA A 14 -0.320 -0.984 -16.144 1.00 64.45 H new ATOM 0 HA ALA A 14 2.483 -1.060 -16.795 1.00 44.12 H new ATOM 0 HB1 ALA A 14 2.352 1.355 -16.244 1.00 1.22 H new ATOM 0 HB2 ALA A 14 1.049 0.861 -17.352 1.00 1.22 H new ATOM 0 HB3 ALA A 14 0.700 1.119 -15.626 1.00 1.22 H new ATOM 216 N ASN A 15 1.589 -0.831 -13.580 1.00 31.20 N ATOM 217 CA ASN A 15 2.049 -1.011 -12.172 1.00 54.43 C ATOM 218 C ASN A 15 2.744 -2.371 -11.984 1.00 41.41 C ATOM 219 O ASN A 15 3.897 -2.433 -11.567 1.00 4.42 O ATOM 220 CB ASN A 15 0.869 -0.891 -11.132 1.00 54.43 C ATOM 221 CG ASN A 15 0.538 0.553 -10.701 1.00 52.03 C ATOM 222 OD1 ASN A 15 1.213 1.110 -9.837 1.00 22.25 O ATOM 223 ND2 ASN A 15 -0.535 1.128 -11.218 1.00 74.24 N ATOM 0 H ASN A 15 0.588 -0.649 -13.658 1.00 31.20 H new ATOM 0 HA ASN A 15 2.758 -0.205 -11.982 1.00 54.43 H new ATOM 0 HB2 ASN A 15 -0.025 -1.342 -11.563 1.00 54.43 H new ATOM 0 HB3 ASN A 15 1.123 -1.472 -10.245 1.00 54.43 H new ATOM 0 HD21 ASN A 15 -0.820 2.055 -10.901 1.00 74.24 H new ATOM 0 HD22 ASN A 15 -1.078 0.645 -11.934 1.00 74.24 H new ATOM 230 N ARG A 16 2.023 -3.451 -12.316 1.00 4.35 N ATOM 231 CA ARG A 16 2.486 -4.842 -12.111 1.00 11.33 C ATOM 232 C ARG A 16 3.749 -5.155 -12.953 1.00 65.43 C ATOM 233 O ARG A 16 4.527 -6.035 -12.596 1.00 22.11 O ATOM 234 CB ARG A 16 1.322 -5.833 -12.431 1.00 51.13 C ATOM 235 CG ARG A 16 0.989 -5.975 -13.932 1.00 21.11 C ATOM 236 CD ARG A 16 -0.409 -6.569 -14.202 1.00 14.05 C ATOM 237 NE ARG A 16 -0.624 -7.891 -13.587 1.00 72.54 N ATOM 238 CZ ARG A 16 -1.829 -8.487 -13.447 1.00 45.11 C ATOM 239 NH1 ARG A 16 -2.951 -7.892 -13.878 1.00 30.12 N ATOM 240 NH2 ARG A 16 -1.900 -9.689 -12.898 1.00 73.41 N ATOM 0 H ARG A 16 1.096 -3.390 -12.737 1.00 4.35 H new ATOM 0 HA ARG A 16 2.772 -4.964 -11.066 1.00 11.33 H new ATOM 0 HB2 ARG A 16 1.581 -6.815 -12.036 1.00 51.13 H new ATOM 0 HB3 ARG A 16 0.427 -5.503 -11.904 1.00 51.13 H new ATOM 0 HG2 ARG A 16 1.055 -4.995 -14.404 1.00 21.11 H new ATOM 0 HG3 ARG A 16 1.741 -6.608 -14.404 1.00 21.11 H new ATOM 0 HD2 ARG A 16 -1.165 -5.878 -13.829 1.00 14.05 H new ATOM 0 HD3 ARG A 16 -0.556 -6.652 -15.279 1.00 14.05 H new ATOM 0 HE ARG A 16 0.195 -8.392 -13.242 1.00 72.54 H new ATOM 0 HH11 ARG A 16 -2.904 -6.974 -14.320 1.00 30.12 H new ATOM 0 HH12 ARG A 16 -3.851 -8.357 -13.764 1.00 30.12 H new ATOM 0 HH21 ARG A 16 -1.050 -10.158 -12.585 1.00 73.41 H new ATOM 0 HH22 ARG A 16 -2.805 -10.147 -12.788 1.00 73.41 H new ATOM 254 N ASP A 17 3.925 -4.416 -14.064 1.00 3.21 N ATOM 255 CA ASP A 17 5.101 -4.518 -14.952 1.00 24.04 C ATOM 256 C ASP A 17 6.344 -3.864 -14.300 1.00 4.21 C ATOM 257 O ASP A 17 7.367 -4.532 -14.083 1.00 42.21 O ATOM 258 CB ASP A 17 4.763 -3.843 -16.311 1.00 72.44 C ATOM 259 CG ASP A 17 5.890 -3.916 -17.357 1.00 2.25 C ATOM 260 OD1 ASP A 17 5.980 -4.932 -18.080 1.00 62.44 O ATOM 261 OD2 ASP A 17 6.687 -2.954 -17.457 1.00 12.51 O ATOM 0 H ASP A 17 3.246 -3.722 -14.375 1.00 3.21 H new ATOM 0 HA ASP A 17 5.340 -5.568 -15.120 1.00 24.04 H new ATOM 0 HB2 ASP A 17 3.870 -4.313 -16.724 1.00 72.44 H new ATOM 0 HB3 ASP A 17 4.518 -2.796 -16.132 1.00 72.44 H new ATOM 266 N GLU A 18 6.231 -2.562 -13.972 1.00 3.01 N ATOM 267 CA GLU A 18 7.355 -1.753 -13.444 1.00 22.24 C ATOM 268 C GLU A 18 7.776 -2.213 -12.031 1.00 25.13 C ATOM 269 O GLU A 18 8.952 -2.125 -11.658 1.00 5.11 O ATOM 270 CB GLU A 18 6.971 -0.244 -13.438 1.00 71.13 C ATOM 271 CG GLU A 18 5.790 0.111 -12.504 1.00 33.15 C ATOM 272 CD GLU A 18 5.285 1.552 -12.650 1.00 11.43 C ATOM 273 OE1 GLU A 18 4.596 1.850 -13.657 1.00 72.13 O ATOM 274 OE2 GLU A 18 5.575 2.400 -11.771 1.00 53.33 O ATOM 0 H GLU A 18 5.360 -2.039 -14.064 1.00 3.01 H new ATOM 0 HA GLU A 18 8.212 -1.900 -14.102 1.00 22.24 H new ATOM 0 HB2 GLU A 18 7.842 0.339 -13.140 1.00 71.13 H new ATOM 0 HB3 GLU A 18 6.718 0.058 -14.454 1.00 71.13 H new ATOM 0 HG2 GLU A 18 4.965 -0.573 -12.703 1.00 33.15 H new ATOM 0 HG3 GLU A 18 6.097 -0.052 -11.471 1.00 33.15 H new ATOM 281 N LYS A 19 6.800 -2.723 -11.259 1.00 45.14 N ATOM 282 CA LYS A 19 7.016 -3.158 -9.864 1.00 74.35 C ATOM 283 C LYS A 19 7.387 -4.649 -9.786 1.00 11.32 C ATOM 284 O LYS A 19 7.779 -5.121 -8.720 1.00 73.32 O ATOM 285 CB LYS A 19 5.776 -2.810 -8.990 1.00 21.05 C ATOM 286 CG LYS A 19 5.466 -1.291 -8.969 1.00 12.43 C ATOM 287 CD LYS A 19 4.253 -0.889 -8.096 1.00 10.51 C ATOM 288 CE LYS A 19 3.944 0.616 -8.234 1.00 31.31 C ATOM 289 NZ LYS A 19 2.857 1.062 -7.322 1.00 50.24 N ATOM 0 H LYS A 19 5.840 -2.846 -11.582 1.00 45.14 H new ATOM 0 HA LYS A 19 7.868 -2.610 -9.461 1.00 74.35 H new ATOM 0 HB2 LYS A 19 4.907 -3.349 -9.368 1.00 21.05 H new ATOM 0 HB3 LYS A 19 5.947 -3.156 -7.971 1.00 21.05 H new ATOM 0 HG2 LYS A 19 6.347 -0.759 -8.609 1.00 12.43 H new ATOM 0 HG3 LYS A 19 5.287 -0.957 -9.991 1.00 12.43 H new ATOM 0 HD2 LYS A 19 3.380 -1.471 -8.391 1.00 10.51 H new ATOM 0 HD3 LYS A 19 4.457 -1.127 -7.052 1.00 10.51 H new ATOM 0 HE2 LYS A 19 4.847 1.189 -8.025 1.00 31.31 H new ATOM 0 HE3 LYS A 19 3.661 0.832 -9.264 1.00 31.31 H new ATOM 0 HZ1 LYS A 19 2.158 1.615 -7.859 1.00 50.24 H new ATOM 0 HZ2 LYS A 19 2.393 0.231 -6.903 1.00 50.24 H new ATOM 0 HZ3 LYS A 19 3.259 1.653 -6.566 1.00 50.24 H new ATOM 303 N ASP A 20 7.275 -5.384 -10.914 1.00 5.13 N ATOM 304 CA ASP A 20 7.805 -6.769 -11.008 1.00 23.40 C ATOM 305 C ASP A 20 9.332 -6.736 -11.160 1.00 1.21 C ATOM 306 O ASP A 20 10.054 -7.488 -10.491 1.00 65.33 O ATOM 307 CB ASP A 20 7.162 -7.551 -12.178 1.00 74.53 C ATOM 308 CG ASP A 20 7.550 -9.040 -12.201 1.00 41.43 C ATOM 309 OD1 ASP A 20 7.323 -9.727 -11.183 1.00 71.42 O ATOM 310 OD2 ASP A 20 8.071 -9.533 -13.229 1.00 45.51 O ATOM 0 H ASP A 20 6.827 -5.048 -11.767 1.00 5.13 H new ATOM 0 HA ASP A 20 7.546 -7.290 -10.087 1.00 23.40 H new ATOM 0 HB2 ASP A 20 6.077 -7.466 -12.110 1.00 74.53 H new ATOM 0 HB3 ASP A 20 7.459 -7.091 -13.120 1.00 74.53 H new ATOM 315 N ARG A 21 9.817 -5.806 -12.012 1.00 5.33 N ATOM 316 CA ARG A 21 11.270 -5.612 -12.228 1.00 52.21 C ATOM 317 C ARG A 21 11.882 -4.804 -11.076 1.00 22.22 C ATOM 318 O ARG A 21 13.094 -4.640 -10.999 1.00 13.05 O ATOM 319 CB ARG A 21 11.586 -4.911 -13.573 1.00 35.14 C ATOM 320 CG ARG A 21 11.112 -3.445 -13.665 1.00 50.12 C ATOM 321 CD ARG A 21 11.882 -2.635 -14.715 1.00 21.55 C ATOM 322 NE ARG A 21 13.330 -2.531 -14.398 1.00 50.03 N ATOM 323 CZ ARG A 21 14.343 -2.693 -15.277 1.00 33.44 C ATOM 324 NH1 ARG A 21 14.104 -2.977 -16.555 1.00 32.14 N ATOM 325 NH2 ARG A 21 15.598 -2.562 -14.861 1.00 75.22 N ATOM 0 H ARG A 21 9.227 -5.180 -12.560 1.00 5.33 H new ATOM 0 HA ARG A 21 11.713 -6.607 -12.261 1.00 52.21 H new ATOM 0 HB2 ARG A 21 12.663 -4.941 -13.738 1.00 35.14 H new ATOM 0 HB3 ARG A 21 11.124 -5.479 -14.380 1.00 35.14 H new ATOM 0 HG2 ARG A 21 10.049 -3.426 -13.906 1.00 50.12 H new ATOM 0 HG3 ARG A 21 11.226 -2.969 -12.691 1.00 50.12 H new ATOM 0 HD2 ARG A 21 11.759 -3.102 -15.692 1.00 21.55 H new ATOM 0 HD3 ARG A 21 11.455 -1.635 -14.784 1.00 21.55 H new ATOM 0 HE ARG A 21 13.581 -2.319 -13.432 1.00 50.03 H new ATOM 0 HH11 ARG A 21 13.144 -3.076 -16.885 1.00 32.14 H new ATOM 0 HH12 ARG A 21 14.881 -3.096 -17.205 1.00 32.14 H new ATOM 0 HH21 ARG A 21 15.791 -2.341 -13.884 1.00 75.22 H new ATOM 0 HH22 ARG A 21 16.368 -2.683 -15.518 1.00 75.22 H new ATOM 339 N PHE A 22 11.021 -4.251 -10.218 1.00 74.32 N ATOM 340 CA PHE A 22 11.445 -3.609 -8.970 1.00 64.43 C ATOM 341 C PHE A 22 11.903 -4.677 -7.957 1.00 35.24 C ATOM 342 O PHE A 22 12.764 -4.420 -7.123 1.00 21.45 O ATOM 343 CB PHE A 22 10.285 -2.766 -8.397 1.00 71.40 C ATOM 344 CG PHE A 22 10.701 -1.775 -7.324 1.00 74.10 C ATOM 345 CD1 PHE A 22 10.777 -2.153 -5.987 1.00 52.03 C ATOM 346 CD2 PHE A 22 11.031 -0.466 -7.661 1.00 30.42 C ATOM 347 CE1 PHE A 22 11.168 -1.255 -5.026 1.00 64.53 C ATOM 348 CE2 PHE A 22 11.421 0.432 -6.696 1.00 45.50 C ATOM 349 CZ PHE A 22 11.491 0.039 -5.376 1.00 63.01 C ATOM 0 H PHE A 22 10.012 -4.235 -10.368 1.00 74.32 H new ATOM 0 HA PHE A 22 12.287 -2.947 -9.170 1.00 64.43 H new ATOM 0 HB2 PHE A 22 9.810 -2.221 -9.213 1.00 71.40 H new ATOM 0 HB3 PHE A 22 9.534 -3.438 -7.982 1.00 71.40 H new ATOM 0 HD1 PHE A 22 10.526 -3.164 -5.703 1.00 52.03 H new ATOM 0 HD2 PHE A 22 10.980 -0.152 -8.693 1.00 30.42 H new ATOM 0 HE1 PHE A 22 11.223 -1.563 -3.992 1.00 64.53 H new ATOM 0 HE2 PHE A 22 11.673 1.445 -6.972 1.00 45.50 H new ATOM 0 HZ PHE A 22 11.798 0.744 -4.618 1.00 63.01 H new ATOM 359 N PHE A 23 11.288 -5.867 -8.036 1.00 43.41 N ATOM 360 CA PHE A 23 11.620 -7.015 -7.167 1.00 51.54 C ATOM 361 C PHE A 23 12.618 -7.971 -7.860 1.00 72.43 C ATOM 362 O PHE A 23 13.104 -8.916 -7.233 1.00 43.33 O ATOM 363 CB PHE A 23 10.331 -7.770 -6.749 1.00 15.34 C ATOM 364 CG PHE A 23 9.414 -7.033 -5.746 1.00 25.51 C ATOM 365 CD1 PHE A 23 8.992 -5.720 -5.968 1.00 31.22 C ATOM 366 CD2 PHE A 23 8.970 -7.668 -4.587 1.00 43.24 C ATOM 367 CE1 PHE A 23 8.162 -5.073 -5.067 1.00 61.42 C ATOM 368 CE2 PHE A 23 8.142 -7.025 -3.688 1.00 1.35 C ATOM 369 CZ PHE A 23 7.738 -5.730 -3.926 1.00 32.52 C ATOM 0 H PHE A 23 10.544 -6.064 -8.705 1.00 43.41 H new ATOM 0 HA PHE A 23 12.101 -6.630 -6.268 1.00 51.54 H new ATOM 0 HB2 PHE A 23 9.753 -7.989 -7.647 1.00 15.34 H new ATOM 0 HB3 PHE A 23 10.618 -8.727 -6.314 1.00 15.34 H new ATOM 0 HD1 PHE A 23 9.318 -5.201 -6.857 1.00 31.22 H new ATOM 0 HD2 PHE A 23 9.280 -8.683 -4.388 1.00 43.24 H new ATOM 0 HE1 PHE A 23 7.847 -4.057 -5.255 1.00 61.42 H new ATOM 0 HE2 PHE A 23 7.811 -7.538 -2.797 1.00 1.35 H new ATOM 0 HZ PHE A 23 7.091 -5.228 -3.222 1.00 32.52 H new ATOM 379 N SER A 24 12.905 -7.739 -9.157 1.00 11.32 N ATOM 380 CA SER A 24 13.868 -8.565 -9.918 1.00 30.03 C ATOM 381 C SER A 24 15.200 -7.816 -10.158 1.00 62.23 C ATOM 382 O SER A 24 16.274 -8.302 -9.783 1.00 23.32 O ATOM 383 CB SER A 24 13.242 -8.981 -11.265 1.00 23.00 C ATOM 384 OG SER A 24 11.983 -9.622 -11.084 1.00 23.45 O ATOM 0 H SER A 24 12.484 -6.986 -9.701 1.00 11.32 H new ATOM 0 HA SER A 24 14.093 -9.453 -9.327 1.00 30.03 H new ATOM 0 HB2 SER A 24 13.115 -8.101 -11.895 1.00 23.00 H new ATOM 0 HB3 SER A 24 13.921 -9.653 -11.790 1.00 23.00 H new ATOM 0 HG SER A 24 11.300 -8.950 -10.881 1.00 23.45 H new ATOM 390 N GLU A 25 15.120 -6.614 -10.756 1.00 61.33 N ATOM 391 CA GLU A 25 16.298 -5.885 -11.285 1.00 10.11 C ATOM 392 C GLU A 25 16.740 -4.760 -10.334 1.00 43.10 C ATOM 393 O GLU A 25 17.938 -4.582 -10.091 1.00 24.22 O ATOM 394 CB GLU A 25 15.973 -5.292 -12.689 1.00 72.14 C ATOM 395 CG GLU A 25 15.538 -6.330 -13.744 1.00 60.12 C ATOM 396 CD GLU A 25 16.597 -7.420 -13.995 1.00 33.21 C ATOM 397 OE1 GLU A 25 17.635 -7.115 -14.628 1.00 52.20 O ATOM 398 OE2 GLU A 25 16.412 -8.577 -13.554 1.00 45.42 O ATOM 0 H GLU A 25 14.239 -6.117 -10.889 1.00 61.33 H new ATOM 0 HA GLU A 25 17.119 -6.597 -11.370 1.00 10.11 H new ATOM 0 HB2 GLU A 25 15.181 -4.551 -12.581 1.00 72.14 H new ATOM 0 HB3 GLU A 25 16.853 -4.766 -13.058 1.00 72.14 H new ATOM 0 HG2 GLU A 25 14.610 -6.802 -13.420 1.00 60.12 H new ATOM 0 HG3 GLU A 25 15.324 -5.818 -14.682 1.00 60.12 H new ATOM 405 N HIS A 26 15.761 -4.003 -9.797 1.00 23.14 N ATOM 406 CA HIS A 26 16.040 -2.827 -8.950 1.00 44.15 C ATOM 407 C HIS A 26 16.482 -3.275 -7.543 1.00 12.15 C ATOM 408 O HIS A 26 17.615 -3.029 -7.127 1.00 64.44 O ATOM 409 CB HIS A 26 14.797 -1.903 -8.883 1.00 71.00 C ATOM 410 CG HIS A 26 15.012 -0.654 -8.062 1.00 65.12 C ATOM 411 ND1 HIS A 26 14.591 -0.574 -6.761 1.00 32.33 N ATOM 412 CD2 HIS A 26 15.642 0.502 -8.387 1.00 34.12 C ATOM 413 CE1 HIS A 26 14.972 0.606 -6.323 1.00 31.14 C ATOM 414 NE2 HIS A 26 15.613 1.296 -7.271 1.00 32.45 N ATOM 0 H HIS A 26 14.767 -4.187 -9.936 1.00 23.14 H new ATOM 0 HA HIS A 26 16.857 -2.257 -9.393 1.00 44.15 H new ATOM 0 HB2 HIS A 26 14.513 -1.617 -9.896 1.00 71.00 H new ATOM 0 HB3 HIS A 26 13.961 -2.463 -8.464 1.00 71.00 H new ATOM 0 HD2 HIS A 26 16.082 0.749 -9.342 1.00 34.12 H new ATOM 0 HE1 HIS A 26 14.790 0.971 -5.323 1.00 31.14 H new ATOM 0 HE2 HIS A 26 16.005 2.233 -7.181 1.00 32.45 H new ATOM 422 N ARG A 27 15.585 -3.971 -6.842 1.00 64.13 N ATOM 423 CA ARG A 27 15.833 -4.555 -5.509 1.00 33.12 C ATOM 424 C ARG A 27 15.574 -6.059 -5.607 1.00 42.00 C ATOM 425 O ARG A 27 14.834 -6.494 -6.482 1.00 21.40 O ATOM 426 CB ARG A 27 14.916 -3.916 -4.418 1.00 45.30 C ATOM 427 CG ARG A 27 15.184 -2.418 -4.157 1.00 31.25 C ATOM 428 CD ARG A 27 16.617 -2.140 -3.648 1.00 3.23 C ATOM 429 NE ARG A 27 17.007 -0.721 -3.790 1.00 53.32 N ATOM 430 CZ ARG A 27 17.944 -0.255 -4.646 1.00 45.30 C ATOM 431 NH1 ARG A 27 18.596 -1.076 -5.450 1.00 72.22 N ATOM 432 NH2 ARG A 27 18.211 1.033 -4.703 1.00 51.44 N ATOM 0 H ARG A 27 14.642 -4.152 -7.187 1.00 64.13 H new ATOM 0 HA ARG A 27 16.862 -4.356 -5.210 1.00 33.12 H new ATOM 0 HB2 ARG A 27 13.875 -4.040 -4.718 1.00 45.30 H new ATOM 0 HB3 ARG A 27 15.046 -4.464 -3.485 1.00 45.30 H new ATOM 0 HG2 ARG A 27 15.017 -1.859 -5.078 1.00 31.25 H new ATOM 0 HG3 ARG A 27 14.466 -2.048 -3.425 1.00 31.25 H new ATOM 0 HD2 ARG A 27 16.688 -2.429 -2.599 1.00 3.23 H new ATOM 0 HD3 ARG A 27 17.321 -2.763 -4.199 1.00 3.23 H new ATOM 0 HE ARG A 27 16.532 -0.041 -3.196 1.00 53.32 H new ATOM 0 HH11 ARG A 27 18.395 -2.076 -5.430 1.00 72.22 H new ATOM 0 HH12 ARG A 27 19.300 -0.710 -6.091 1.00 72.22 H new ATOM 0 HH21 ARG A 27 17.710 1.685 -4.099 1.00 51.44 H new ATOM 0 HH22 ARG A 27 18.919 1.379 -5.351 1.00 51.44 H new ATOM 446 N GLN A 28 16.227 -6.846 -4.754 1.00 14.23 N ATOM 447 CA GLN A 28 16.032 -8.304 -4.701 1.00 32.43 C ATOM 448 C GLN A 28 14.671 -8.633 -4.056 1.00 61.03 C ATOM 449 O GLN A 28 14.251 -7.942 -3.122 1.00 73.20 O ATOM 450 CB GLN A 28 17.203 -8.945 -3.910 1.00 2.22 C ATOM 451 CG GLN A 28 18.602 -8.580 -4.454 1.00 12.14 C ATOM 452 CD GLN A 28 18.844 -9.053 -5.889 1.00 33.42 C ATOM 453 OE1 GLN A 28 19.352 -10.152 -6.109 1.00 4.44 O ATOM 454 NE2 GLN A 28 18.474 -8.236 -6.868 1.00 31.54 N ATOM 0 H GLN A 28 16.907 -6.497 -4.078 1.00 14.23 H new ATOM 0 HA GLN A 28 16.027 -8.716 -5.710 1.00 32.43 H new ATOM 0 HB2 GLN A 28 17.137 -8.634 -2.867 1.00 2.22 H new ATOM 0 HB3 GLN A 28 17.089 -10.029 -3.927 1.00 2.22 H new ATOM 0 HG2 GLN A 28 18.729 -7.498 -4.411 1.00 12.14 H new ATOM 0 HG3 GLN A 28 19.361 -9.016 -3.804 1.00 12.14 H new ATOM 0 HE21 GLN A 28 18.056 -7.332 -6.647 1.00 31.54 H new ATOM 0 HE22 GLN A 28 18.608 -8.512 -7.841 1.00 31.54 H new ATOM 463 N SER A 29 13.973 -9.654 -4.597 1.00 45.14 N ATOM 464 CA SER A 29 12.666 -10.101 -4.093 1.00 61.14 C ATOM 465 C SER A 29 12.749 -10.550 -2.611 1.00 40.21 C ATOM 466 O SER A 29 13.597 -11.385 -2.275 1.00 74.34 O ATOM 467 CB SER A 29 12.115 -11.232 -5.002 1.00 72.43 C ATOM 468 OG SER A 29 13.032 -12.308 -5.124 1.00 51.23 O ATOM 0 H SER A 29 14.305 -10.190 -5.398 1.00 45.14 H new ATOM 0 HA SER A 29 11.974 -9.260 -4.125 1.00 61.14 H new ATOM 0 HB2 SER A 29 11.175 -11.601 -4.592 1.00 72.43 H new ATOM 0 HB3 SER A 29 11.895 -10.829 -5.990 1.00 72.43 H new ATOM 0 HG SER A 29 13.478 -12.457 -4.264 1.00 51.23 H new ATOM 474 N PRO A 30 11.873 -9.991 -1.702 1.00 64.11 N ATOM 475 CA PRO A 30 11.864 -10.332 -0.253 1.00 22.13 C ATOM 476 C PRO A 30 11.493 -11.801 -0.004 1.00 14.35 C ATOM 477 O PRO A 30 11.693 -12.312 1.089 1.00 33.20 O ATOM 478 CB PRO A 30 10.789 -9.387 0.333 1.00 31.11 C ATOM 479 CG PRO A 30 9.892 -9.090 -0.823 1.00 11.11 C ATOM 480 CD PRO A 30 10.822 -8.985 -2.005 1.00 52.12 C ATOM 0 HA PRO A 30 12.846 -10.209 0.203 1.00 22.13 H new ATOM 0 HB2 PRO A 30 10.243 -9.862 1.149 1.00 31.11 H new ATOM 0 HB3 PRO A 30 11.235 -8.477 0.735 1.00 31.11 H new ATOM 0 HG2 PRO A 30 9.155 -9.880 -0.967 1.00 11.11 H new ATOM 0 HG3 PRO A 30 9.340 -8.163 -0.669 1.00 11.11 H new ATOM 0 HD2 PRO A 30 10.310 -9.208 -2.941 1.00 52.12 H new ATOM 0 HD3 PRO A 30 11.240 -7.983 -2.101 1.00 52.12 H new ATOM 488 N ILE A 31 10.913 -12.443 -1.026 1.00 71.53 N ATOM 489 CA ILE A 31 10.659 -13.890 -1.023 1.00 23.12 C ATOM 490 C ILE A 31 12.049 -14.601 -0.971 1.00 74.32 C ATOM 491 O ILE A 31 12.765 -14.569 -1.975 1.00 12.24 O ATOM 492 CB ILE A 31 9.846 -14.347 -2.318 1.00 62.35 C ATOM 493 CG1 ILE A 31 8.793 -13.272 -2.771 1.00 61.33 C ATOM 494 CG2 ILE A 31 9.161 -15.715 -2.091 1.00 70.00 C ATOM 495 CD1 ILE A 31 7.646 -13.012 -1.807 1.00 5.44 C ATOM 0 H ILE A 31 10.606 -11.974 -1.878 1.00 71.53 H new ATOM 0 HA ILE A 31 10.048 -14.159 -0.161 1.00 23.12 H new ATOM 0 HB ILE A 31 10.572 -14.450 -3.124 1.00 62.35 H new ATOM 0 HG12 ILE A 31 9.316 -12.331 -2.944 1.00 61.33 H new ATOM 0 HG13 ILE A 31 8.373 -13.584 -3.727 1.00 61.33 H new ATOM 0 HG21 ILE A 31 8.614 -16.002 -2.989 1.00 70.00 H new ATOM 0 HG22 ILE A 31 9.917 -16.468 -1.870 1.00 70.00 H new ATOM 0 HG23 ILE A 31 8.468 -15.640 -1.253 1.00 70.00 H new ATOM 0 HD11 ILE A 31 6.984 -12.253 -2.225 1.00 5.44 H new ATOM 0 HD12 ILE A 31 7.087 -13.934 -1.650 1.00 5.44 H new ATOM 0 HD13 ILE A 31 8.044 -12.662 -0.854 1.00 5.44 H new ATOM 507 N PRO A 32 12.471 -15.191 0.211 1.00 22.32 N ATOM 508 CA PRO A 32 13.868 -15.678 0.427 1.00 32.11 C ATOM 509 C PRO A 32 14.305 -16.744 -0.614 1.00 61.03 C ATOM 510 O PRO A 32 13.444 -17.442 -1.124 1.00 74.02 O ATOM 511 CB PRO A 32 13.844 -16.254 1.877 1.00 60.51 C ATOM 512 CG PRO A 32 12.397 -16.449 2.221 1.00 43.34 C ATOM 513 CD PRO A 32 11.623 -15.431 1.412 1.00 21.35 C ATOM 0 HA PRO A 32 14.599 -14.879 0.302 1.00 32.11 H new ATOM 0 HB2 PRO A 32 14.388 -17.197 1.931 1.00 60.51 H new ATOM 0 HB3 PRO A 32 14.322 -15.569 2.577 1.00 60.51 H new ATOM 0 HG2 PRO A 32 12.074 -17.462 1.981 1.00 43.34 H new ATOM 0 HG3 PRO A 32 12.229 -16.305 3.288 1.00 43.34 H new ATOM 0 HD2 PRO A 32 10.639 -15.809 1.135 1.00 21.35 H new ATOM 0 HD3 PRO A 32 11.464 -14.512 1.977 1.00 21.35 H new ATOM 521 N PRO A 33 15.647 -16.869 -0.937 1.00 51.40 N ATOM 522 CA PRO A 33 16.178 -17.792 -1.989 1.00 40.41 C ATOM 523 C PRO A 33 15.548 -19.210 -1.984 1.00 74.40 C ATOM 524 O PRO A 33 15.247 -19.768 -3.051 1.00 34.01 O ATOM 525 CB PRO A 33 17.716 -17.826 -1.710 1.00 53.31 C ATOM 526 CG PRO A 33 17.937 -17.014 -0.456 1.00 61.23 C ATOM 527 CD PRO A 33 16.758 -16.079 -0.348 1.00 32.12 C ATOM 0 HA PRO A 33 15.927 -17.432 -2.987 1.00 40.41 H new ATOM 0 HB2 PRO A 33 18.064 -18.850 -1.577 1.00 53.31 H new ATOM 0 HB3 PRO A 33 18.273 -17.407 -2.548 1.00 53.31 H new ATOM 0 HG2 PRO A 33 18.003 -17.660 0.420 1.00 61.23 H new ATOM 0 HG3 PRO A 33 18.872 -16.457 -0.513 1.00 61.23 H new ATOM 0 HD2 PRO A 33 16.554 -15.806 0.687 1.00 32.12 H new ATOM 0 HD3 PRO A 33 16.927 -15.152 -0.895 1.00 32.12 H new ATOM 535 N GLU A 34 15.317 -19.761 -0.779 1.00 40.42 N ATOM 536 CA GLU A 34 14.655 -21.075 -0.597 1.00 31.14 C ATOM 537 C GLU A 34 13.168 -21.004 -1.003 1.00 32.30 C ATOM 538 O GLU A 34 12.670 -21.871 -1.726 1.00 2.12 O ATOM 539 CB GLU A 34 14.786 -21.527 0.884 1.00 43.12 C ATOM 540 CG GLU A 34 16.239 -21.704 1.370 1.00 3.21 C ATOM 541 CD GLU A 34 16.343 -22.024 2.873 1.00 64.14 C ATOM 542 OE1 GLU A 34 15.945 -21.165 3.693 1.00 33.35 O ATOM 543 OE2 GLU A 34 16.835 -23.114 3.242 1.00 61.42 O ATOM 0 H GLU A 34 15.582 -19.312 0.098 1.00 40.42 H new ATOM 0 HA GLU A 34 15.147 -21.804 -1.241 1.00 31.14 H new ATOM 0 HB2 GLU A 34 14.290 -20.794 1.520 1.00 43.12 H new ATOM 0 HB3 GLU A 34 14.256 -22.471 1.011 1.00 43.12 H new ATOM 0 HG2 GLU A 34 16.710 -22.506 0.801 1.00 3.21 H new ATOM 0 HG3 GLU A 34 16.799 -20.793 1.160 1.00 3.21 H new ATOM 550 N GLU A 35 12.482 -19.952 -0.529 1.00 43.13 N ATOM 551 CA GLU A 35 11.031 -19.774 -0.724 1.00 12.45 C ATOM 552 C GLU A 35 10.682 -19.477 -2.188 1.00 44.41 C ATOM 553 O GLU A 35 9.734 -20.051 -2.723 1.00 74.22 O ATOM 554 CB GLU A 35 10.498 -18.628 0.172 1.00 43.51 C ATOM 555 CG GLU A 35 8.964 -18.552 0.317 1.00 71.44 C ATOM 556 CD GLU A 35 8.373 -19.703 1.151 1.00 21.20 C ATOM 557 OE1 GLU A 35 8.212 -20.824 0.622 1.00 21.33 O ATOM 558 OE2 GLU A 35 8.078 -19.494 2.350 1.00 42.35 O ATOM 0 H GLU A 35 12.918 -19.198 0.002 1.00 43.13 H new ATOM 0 HA GLU A 35 10.555 -20.713 -0.442 1.00 12.45 H new ATOM 0 HB2 GLU A 35 10.934 -18.735 1.165 1.00 43.51 H new ATOM 0 HB3 GLU A 35 10.854 -17.680 -0.232 1.00 43.51 H new ATOM 0 HG2 GLU A 35 8.697 -17.602 0.780 1.00 71.44 H new ATOM 0 HG3 GLU A 35 8.511 -18.562 -0.675 1.00 71.44 H new ATOM 565 N ARG A 36 11.466 -18.587 -2.839 1.00 51.43 N ATOM 566 CA ARG A 36 11.187 -18.109 -4.209 1.00 31.51 C ATOM 567 C ARG A 36 11.516 -19.166 -5.271 1.00 33.44 C ATOM 568 O ARG A 36 11.224 -18.984 -6.459 1.00 72.25 O ATOM 569 CB ARG A 36 11.954 -16.789 -4.498 1.00 72.34 C ATOM 570 CG ARG A 36 13.491 -16.897 -4.434 1.00 4.31 C ATOM 571 CD ARG A 36 14.196 -15.594 -4.854 1.00 64.33 C ATOM 572 NE ARG A 36 13.831 -15.197 -6.228 1.00 74.22 N ATOM 573 CZ ARG A 36 14.595 -14.489 -7.071 1.00 44.01 C ATOM 574 NH1 ARG A 36 15.808 -14.068 -6.716 1.00 55.13 N ATOM 575 NH2 ARG A 36 14.130 -14.208 -8.279 1.00 52.32 N ATOM 0 H ARG A 36 12.307 -18.182 -2.429 1.00 51.43 H new ATOM 0 HA ARG A 36 10.116 -17.914 -4.267 1.00 31.51 H new ATOM 0 HB2 ARG A 36 11.671 -16.432 -5.489 1.00 72.34 H new ATOM 0 HB3 ARG A 36 11.628 -16.034 -3.783 1.00 72.34 H new ATOM 0 HG2 ARG A 36 13.791 -17.157 -3.419 1.00 4.31 H new ATOM 0 HG3 ARG A 36 13.821 -17.709 -5.082 1.00 4.31 H new ATOM 0 HD2 ARG A 36 13.929 -14.796 -4.161 1.00 64.33 H new ATOM 0 HD3 ARG A 36 15.276 -15.726 -4.788 1.00 64.33 H new ATOM 0 HE ARG A 36 12.914 -15.488 -6.567 1.00 74.22 H new ATOM 0 HH11 ARG A 36 16.171 -14.283 -5.787 1.00 55.13 H new ATOM 0 HH12 ARG A 36 16.374 -13.530 -7.373 1.00 55.13 H new ATOM 0 HH21 ARG A 36 13.202 -14.530 -8.556 1.00 52.32 H new ATOM 0 HH22 ARG A 36 14.699 -13.670 -8.932 1.00 52.32 H new ATOM 589 N ASP A 37 12.154 -20.256 -4.832 1.00 72.05 N ATOM 590 CA ASP A 37 12.351 -21.454 -5.657 1.00 33.12 C ATOM 591 C ASP A 37 10.983 -22.126 -5.912 1.00 73.51 C ATOM 592 O ASP A 37 10.723 -22.637 -7.010 1.00 43.23 O ATOM 593 CB ASP A 37 13.333 -22.420 -4.940 1.00 1.11 C ATOM 594 CG ASP A 37 13.590 -23.732 -5.712 1.00 14.00 C ATOM 595 OD1 ASP A 37 14.408 -23.725 -6.655 1.00 41.43 O ATOM 596 OD2 ASP A 37 12.963 -24.767 -5.382 1.00 64.14 O ATOM 0 H ASP A 37 12.549 -20.333 -3.895 1.00 72.05 H new ATOM 0 HA ASP A 37 12.785 -21.184 -6.620 1.00 33.12 H new ATOM 0 HB2 ASP A 37 14.283 -21.908 -4.785 1.00 1.11 H new ATOM 0 HB3 ASP A 37 12.936 -22.661 -3.954 1.00 1.11 H new ATOM 601 N ASP A 38 10.118 -22.109 -4.875 1.00 3.31 N ATOM 602 CA ASP A 38 8.736 -22.633 -4.968 1.00 23.03 C ATOM 603 C ASP A 38 7.739 -21.546 -5.429 1.00 71.05 C ATOM 604 O ASP A 38 6.807 -21.842 -6.185 1.00 10.44 O ATOM 605 CB ASP A 38 8.303 -23.220 -3.601 1.00 22.22 C ATOM 606 CG ASP A 38 6.855 -23.760 -3.592 1.00 14.15 C ATOM 607 OD1 ASP A 38 6.610 -24.849 -4.156 1.00 20.20 O ATOM 608 OD2 ASP A 38 5.953 -23.096 -3.027 1.00 62.05 O ATOM 0 H ASP A 38 10.354 -21.735 -3.956 1.00 3.31 H new ATOM 0 HA ASP A 38 8.726 -23.422 -5.720 1.00 23.03 H new ATOM 0 HB2 ASP A 38 8.984 -24.026 -3.329 1.00 22.22 H new ATOM 0 HB3 ASP A 38 8.399 -22.449 -2.837 1.00 22.22 H new ATOM 613 N PHE A 39 7.944 -20.289 -4.988 1.00 51.41 N ATOM 614 CA PHE A 39 7.101 -19.149 -5.408 1.00 25.04 C ATOM 615 C PHE A 39 7.942 -18.199 -6.274 1.00 31.32 C ATOM 616 O PHE A 39 8.683 -17.363 -5.752 1.00 14.23 O ATOM 617 CB PHE A 39 6.555 -18.366 -4.168 1.00 60.24 C ATOM 618 CG PHE A 39 5.709 -19.182 -3.188 1.00 72.01 C ATOM 619 CD1 PHE A 39 4.412 -19.555 -3.516 1.00 24.11 C ATOM 620 CD2 PHE A 39 6.199 -19.558 -1.937 1.00 50.14 C ATOM 621 CE1 PHE A 39 3.631 -20.277 -2.633 1.00 42.20 C ATOM 622 CE2 PHE A 39 5.413 -20.277 -1.050 1.00 13.23 C ATOM 623 CZ PHE A 39 4.129 -20.635 -1.399 1.00 34.12 C ATOM 0 H PHE A 39 8.689 -20.036 -4.339 1.00 51.41 H new ATOM 0 HA PHE A 39 6.252 -19.533 -5.974 1.00 25.04 H new ATOM 0 HB2 PHE A 39 7.402 -17.945 -3.626 1.00 60.24 H new ATOM 0 HB3 PHE A 39 5.957 -17.528 -4.525 1.00 60.24 H new ATOM 0 HD1 PHE A 39 4.007 -19.276 -4.477 1.00 24.11 H new ATOM 0 HD2 PHE A 39 7.205 -19.285 -1.656 1.00 50.14 H new ATOM 0 HE1 PHE A 39 2.627 -20.562 -2.911 1.00 42.20 H new ATOM 0 HE2 PHE A 39 5.807 -20.557 -0.084 1.00 13.23 H new ATOM 0 HZ PHE A 39 3.515 -21.194 -0.708 1.00 34.12 H new ATOM 633 N ASP A 40 7.784 -18.275 -7.600 1.00 75.04 N ATOM 634 CA ASP A 40 8.519 -17.401 -8.528 1.00 5.44 C ATOM 635 C ASP A 40 7.566 -16.321 -9.036 1.00 2.04 C ATOM 636 O ASP A 40 6.843 -16.522 -10.019 1.00 63.13 O ATOM 637 CB ASP A 40 9.147 -18.213 -9.691 1.00 31.03 C ATOM 638 CG ASP A 40 10.022 -17.355 -10.624 1.00 73.11 C ATOM 639 OD1 ASP A 40 11.119 -16.923 -10.195 1.00 11.14 O ATOM 640 OD2 ASP A 40 9.619 -17.085 -11.779 1.00 44.13 O ATOM 0 H ASP A 40 7.153 -18.933 -8.058 1.00 75.04 H new ATOM 0 HA ASP A 40 9.350 -16.927 -8.006 1.00 5.44 H new ATOM 0 HB2 ASP A 40 9.751 -19.021 -9.278 1.00 31.03 H new ATOM 0 HB3 ASP A 40 8.351 -18.676 -10.274 1.00 31.03 H new ATOM 645 N GLY A 41 7.493 -15.225 -8.274 1.00 22.21 N ATOM 646 CA GLY A 41 6.652 -14.087 -8.613 1.00 20.25 C ATOM 647 C GLY A 41 6.203 -13.332 -7.376 1.00 11.55 C ATOM 648 O GLY A 41 6.422 -13.791 -6.243 1.00 43.40 O ATOM 0 H GLY A 41 8.017 -15.108 -7.407 1.00 22.21 H new ATOM 0 HA2 GLY A 41 7.200 -13.413 -9.272 1.00 20.25 H new ATOM 0 HA3 GLY A 41 5.778 -14.432 -9.166 1.00 20.25 H new ATOM 652 N LEU A 42 5.592 -12.157 -7.600 1.00 12.41 N ATOM 653 CA LEU A 42 4.971 -11.346 -6.537 1.00 21.15 C ATOM 654 C LEU A 42 3.767 -12.089 -5.934 1.00 72.30 C ATOM 655 O LEU A 42 2.705 -12.120 -6.554 1.00 54.41 O ATOM 656 CB LEU A 42 4.511 -9.958 -7.102 1.00 4.15 C ATOM 657 CG LEU A 42 5.572 -9.154 -7.918 1.00 32.32 C ATOM 658 CD1 LEU A 42 5.036 -7.765 -8.349 1.00 10.43 C ATOM 659 CD2 LEU A 42 6.897 -9.050 -7.147 1.00 21.30 C ATOM 0 H LEU A 42 5.514 -11.740 -8.528 1.00 12.41 H new ATOM 0 HA LEU A 42 5.713 -11.179 -5.756 1.00 21.15 H new ATOM 0 HB2 LEU A 42 3.641 -10.120 -7.739 1.00 4.15 H new ATOM 0 HB3 LEU A 42 4.183 -9.340 -6.266 1.00 4.15 H new ATOM 0 HG LEU A 42 5.773 -9.706 -8.836 1.00 32.32 H new ATOM 0 HD11 LEU A 42 5.805 -7.238 -8.914 1.00 10.43 H new ATOM 0 HD12 LEU A 42 4.151 -7.894 -8.973 1.00 10.43 H new ATOM 0 HD13 LEU A 42 4.775 -7.185 -7.464 1.00 10.43 H new ATOM 0 HD21 LEU A 42 7.618 -8.485 -7.738 1.00 21.30 H new ATOM 0 HD22 LEU A 42 6.727 -8.541 -6.198 1.00 21.30 H new ATOM 0 HD23 LEU A 42 7.287 -10.050 -6.957 1.00 21.30 H new ATOM 671 N SER A 43 3.947 -12.752 -4.772 1.00 72.44 N ATOM 672 CA SER A 43 2.816 -13.347 -4.040 1.00 21.31 C ATOM 673 C SER A 43 1.964 -12.219 -3.422 1.00 50.20 C ATOM 674 O SER A 43 2.392 -11.563 -2.461 1.00 63.22 O ATOM 675 CB SER A 43 3.357 -14.301 -2.939 1.00 12.23 C ATOM 676 OG SER A 43 2.310 -14.858 -2.159 1.00 11.22 O ATOM 0 H SER A 43 4.855 -12.886 -4.327 1.00 72.44 H new ATOM 0 HA SER A 43 2.190 -13.926 -4.719 1.00 21.31 H new ATOM 0 HB2 SER A 43 3.930 -15.104 -3.404 1.00 12.23 H new ATOM 0 HB3 SER A 43 4.042 -13.755 -2.290 1.00 12.23 H new ATOM 0 HG SER A 43 2.484 -14.689 -1.210 1.00 11.22 H new ATOM 682 N TYR A 44 0.742 -12.030 -3.954 1.00 63.50 N ATOM 683 CA TYR A 44 -0.151 -10.933 -3.524 1.00 65.11 C ATOM 684 C TYR A 44 -1.599 -11.207 -3.954 1.00 53.24 C ATOM 685 O TYR A 44 -1.906 -12.281 -4.492 1.00 22.23 O ATOM 686 CB TYR A 44 0.363 -9.541 -4.056 1.00 51.11 C ATOM 687 CG TYR A 44 0.104 -9.206 -5.557 1.00 42.22 C ATOM 688 CD1 TYR A 44 0.454 -10.091 -6.576 1.00 53.15 C ATOM 689 CD2 TYR A 44 -0.493 -7.990 -5.943 1.00 43.01 C ATOM 690 CE1 TYR A 44 0.226 -9.788 -7.910 1.00 4.41 C ATOM 691 CE2 TYR A 44 -0.724 -7.687 -7.276 1.00 74.54 C ATOM 692 CZ TYR A 44 -0.362 -8.587 -8.254 1.00 44.53 C ATOM 693 OH TYR A 44 -0.590 -8.286 -9.585 1.00 13.13 O ATOM 0 H TYR A 44 0.348 -12.623 -4.684 1.00 63.50 H new ATOM 0 HA TYR A 44 -0.135 -10.888 -2.435 1.00 65.11 H new ATOM 0 HB2 TYR A 44 -0.097 -8.759 -3.452 1.00 51.11 H new ATOM 0 HB3 TYR A 44 1.437 -9.489 -3.880 1.00 51.11 H new ATOM 0 HD1 TYR A 44 0.913 -11.034 -6.320 1.00 53.15 H new ATOM 0 HD2 TYR A 44 -0.777 -7.277 -5.183 1.00 43.01 H new ATOM 0 HE1 TYR A 44 0.508 -10.491 -8.680 1.00 4.41 H new ATOM 0 HE2 TYR A 44 -1.186 -6.749 -7.547 1.00 74.54 H new ATOM 0 HH TYR A 44 -1.011 -7.404 -9.653 1.00 13.13 H new ATOM 703 N PHE A 45 -2.469 -10.217 -3.712 1.00 51.02 N ATOM 704 CA PHE A 45 -3.906 -10.317 -3.985 1.00 2.44 C ATOM 705 C PHE A 45 -4.178 -9.987 -5.462 1.00 12.45 C ATOM 706 O PHE A 45 -3.527 -9.096 -6.029 1.00 30.51 O ATOM 707 CB PHE A 45 -4.683 -9.352 -3.044 1.00 61.04 C ATOM 708 CG PHE A 45 -4.379 -9.586 -1.559 1.00 42.35 C ATOM 709 CD1 PHE A 45 -4.812 -10.745 -0.918 1.00 71.51 C ATOM 710 CD2 PHE A 45 -3.639 -8.662 -0.816 1.00 22.14 C ATOM 711 CE1 PHE A 45 -4.512 -10.976 0.413 1.00 62.21 C ATOM 712 CE2 PHE A 45 -3.345 -8.891 0.520 1.00 5.13 C ATOM 713 CZ PHE A 45 -3.782 -10.051 1.133 1.00 1.14 C ATOM 0 H PHE A 45 -2.191 -9.318 -3.318 1.00 51.02 H new ATOM 0 HA PHE A 45 -4.248 -11.334 -3.794 1.00 2.44 H new ATOM 0 HB2 PHE A 45 -4.433 -8.323 -3.302 1.00 61.04 H new ATOM 0 HB3 PHE A 45 -5.753 -9.472 -3.213 1.00 61.04 H new ATOM 0 HD1 PHE A 45 -5.390 -11.473 -1.468 1.00 71.51 H new ATOM 0 HD2 PHE A 45 -3.291 -7.756 -1.289 1.00 22.14 H new ATOM 0 HE1 PHE A 45 -4.850 -11.884 0.891 1.00 62.21 H new ATOM 0 HE2 PHE A 45 -2.776 -8.164 1.081 1.00 5.13 H new ATOM 0 HZ PHE A 45 -3.553 -10.233 2.173 1.00 1.14 H new ATOM 723 N ASP A 46 -5.128 -10.715 -6.085 1.00 43.10 N ATOM 724 CA ASP A 46 -5.506 -10.492 -7.498 1.00 33.31 C ATOM 725 C ASP A 46 -6.406 -9.249 -7.614 1.00 11.52 C ATOM 726 O ASP A 46 -7.142 -8.946 -6.665 1.00 33.05 O ATOM 727 CB ASP A 46 -6.246 -11.716 -8.107 1.00 20.31 C ATOM 728 CG ASP A 46 -5.336 -12.933 -8.313 1.00 10.32 C ATOM 729 OD1 ASP A 46 -4.499 -12.909 -9.245 1.00 63.21 O ATOM 730 OD2 ASP A 46 -5.460 -13.928 -7.566 1.00 2.15 O ATOM 0 H ASP A 46 -5.649 -11.465 -5.631 1.00 43.10 H new ATOM 0 HA ASP A 46 -4.583 -10.342 -8.057 1.00 33.31 H new ATOM 0 HB2 ASP A 46 -7.072 -11.995 -7.453 1.00 20.31 H new ATOM 0 HB3 ASP A 46 -6.681 -11.430 -9.065 1.00 20.31 H new ATOM 735 N PRO A 47 -6.362 -8.501 -8.775 1.00 33.11 N ATOM 736 CA PRO A 47 -7.281 -7.363 -9.036 1.00 62.42 C ATOM 737 C PRO A 47 -8.757 -7.783 -8.908 1.00 62.23 C ATOM 738 O PRO A 47 -9.302 -8.474 -9.778 1.00 62.02 O ATOM 739 CB PRO A 47 -6.928 -6.942 -10.494 1.00 52.53 C ATOM 740 CG PRO A 47 -6.135 -8.081 -11.063 1.00 40.03 C ATOM 741 CD PRO A 47 -5.400 -8.677 -9.891 1.00 32.14 C ATOM 0 HA PRO A 47 -7.161 -6.550 -8.320 1.00 62.42 H new ATOM 0 HB2 PRO A 47 -7.830 -6.762 -11.079 1.00 52.53 H new ATOM 0 HB3 PRO A 47 -6.350 -6.018 -10.506 1.00 52.53 H new ATOM 0 HG2 PRO A 47 -6.786 -8.817 -11.535 1.00 40.03 H new ATOM 0 HG3 PRO A 47 -5.440 -7.734 -11.828 1.00 40.03 H new ATOM 0 HD2 PRO A 47 -5.160 -9.727 -10.056 1.00 32.14 H new ATOM 0 HD3 PRO A 47 -4.459 -8.161 -9.699 1.00 32.14 H new ATOM 749 N ASP A 48 -9.376 -7.378 -7.796 1.00 22.05 N ATOM 750 CA ASP A 48 -10.739 -7.774 -7.434 1.00 50.44 C ATOM 751 C ASP A 48 -11.590 -6.494 -7.263 1.00 53.41 C ATOM 752 O ASP A 48 -11.536 -5.851 -6.208 1.00 62.21 O ATOM 753 CB ASP A 48 -10.698 -8.625 -6.128 1.00 0.42 C ATOM 754 CG ASP A 48 -11.829 -9.659 -6.020 1.00 65.12 C ATOM 755 OD1 ASP A 48 -12.973 -9.279 -5.735 1.00 45.01 O ATOM 756 OD2 ASP A 48 -11.568 -10.868 -6.237 1.00 31.42 O ATOM 0 H ASP A 48 -8.939 -6.758 -7.114 1.00 22.05 H new ATOM 0 HA ASP A 48 -11.191 -8.388 -8.213 1.00 50.44 H new ATOM 0 HB2 ASP A 48 -9.740 -9.142 -6.074 1.00 0.42 H new ATOM 0 HB3 ASP A 48 -10.748 -7.956 -5.269 1.00 0.42 H new ATOM 761 N PRO A 49 -12.340 -6.068 -8.330 1.00 32.33 N ATOM 762 CA PRO A 49 -13.208 -4.860 -8.288 1.00 42.31 C ATOM 763 C PRO A 49 -14.263 -4.888 -7.154 1.00 73.53 C ATOM 764 O PRO A 49 -14.746 -3.832 -6.732 1.00 43.34 O ATOM 765 CB PRO A 49 -13.883 -4.851 -9.684 1.00 73.03 C ATOM 766 CG PRO A 49 -12.966 -5.642 -10.563 1.00 74.12 C ATOM 767 CD PRO A 49 -12.366 -6.706 -9.671 1.00 24.22 C ATOM 0 HA PRO A 49 -12.628 -3.963 -8.074 1.00 42.31 H new ATOM 0 HB2 PRO A 49 -14.876 -5.299 -9.645 1.00 73.03 H new ATOM 0 HB3 PRO A 49 -14.006 -3.834 -10.056 1.00 73.03 H new ATOM 0 HG2 PRO A 49 -13.510 -6.089 -11.395 1.00 74.12 H new ATOM 0 HG3 PRO A 49 -12.191 -5.008 -10.993 1.00 74.12 H new ATOM 0 HD2 PRO A 49 -12.968 -7.614 -9.671 1.00 24.22 H new ATOM 0 HD3 PRO A 49 -11.366 -6.987 -10.000 1.00 24.22 H new ATOM 775 N ASP A 50 -14.613 -6.107 -6.684 1.00 2.42 N ATOM 776 CA ASP A 50 -15.556 -6.299 -5.560 1.00 11.33 C ATOM 777 C ASP A 50 -15.007 -5.712 -4.243 1.00 22.12 C ATOM 778 O ASP A 50 -15.771 -5.159 -3.445 1.00 30.50 O ATOM 779 CB ASP A 50 -15.903 -7.803 -5.394 1.00 64.25 C ATOM 780 CG ASP A 50 -16.848 -8.108 -4.208 1.00 72.55 C ATOM 781 OD1 ASP A 50 -18.054 -7.778 -4.299 1.00 20.41 O ATOM 782 OD2 ASP A 50 -16.385 -8.658 -3.179 1.00 40.43 O ATOM 0 H ASP A 50 -14.252 -6.979 -7.070 1.00 2.42 H new ATOM 0 HA ASP A 50 -16.470 -5.755 -5.799 1.00 11.33 H new ATOM 0 HB2 ASP A 50 -16.365 -8.161 -6.314 1.00 64.25 H new ATOM 0 HB3 ASP A 50 -14.979 -8.365 -5.262 1.00 64.25 H new ATOM 787 N TYR A 51 -13.683 -5.805 -4.033 1.00 50.12 N ATOM 788 CA TYR A 51 -13.054 -5.331 -2.774 1.00 53.02 C ATOM 789 C TYR A 51 -12.508 -3.885 -2.934 1.00 2.45 C ATOM 790 O TYR A 51 -12.030 -3.279 -1.968 1.00 32.24 O ATOM 791 CB TYR A 51 -11.930 -6.313 -2.306 1.00 42.23 C ATOM 792 CG TYR A 51 -11.705 -6.297 -0.780 1.00 52.40 C ATOM 793 CD1 TYR A 51 -10.867 -5.358 -0.170 1.00 35.23 C ATOM 794 CD2 TYR A 51 -12.380 -7.192 0.053 1.00 23.53 C ATOM 795 CE1 TYR A 51 -10.715 -5.320 1.201 1.00 63.15 C ATOM 796 CE2 TYR A 51 -12.234 -7.143 1.421 1.00 11.53 C ATOM 797 CZ TYR A 51 -11.403 -6.206 1.990 1.00 10.05 C ATOM 798 OH TYR A 51 -11.273 -6.143 3.361 1.00 72.34 O ATOM 0 H TYR A 51 -13.027 -6.199 -4.708 1.00 50.12 H new ATOM 0 HA TYR A 51 -13.822 -5.312 -2.000 1.00 53.02 H new ATOM 0 HB2 TYR A 51 -12.188 -7.325 -2.618 1.00 42.23 H new ATOM 0 HB3 TYR A 51 -10.998 -6.053 -2.807 1.00 42.23 H new ATOM 0 HD1 TYR A 51 -10.329 -4.650 -0.783 1.00 35.23 H new ATOM 0 HD2 TYR A 51 -13.029 -7.937 -0.384 1.00 23.53 H new ATOM 0 HE1 TYR A 51 -10.055 -4.594 1.652 1.00 63.15 H new ATOM 0 HE2 TYR A 51 -12.772 -7.840 2.047 1.00 11.53 H new ATOM 0 HH TYR A 51 -11.260 -7.051 3.730 1.00 72.34 H new ATOM 808 N ARG A 52 -12.592 -3.337 -4.159 1.00 4.13 N ATOM 809 CA ARG A 52 -12.133 -1.964 -4.460 1.00 15.33 C ATOM 810 C ARG A 52 -13.040 -0.923 -3.765 1.00 63.12 C ATOM 811 O ARG A 52 -14.269 -0.969 -3.906 1.00 62.12 O ATOM 812 CB ARG A 52 -12.115 -1.733 -6.002 1.00 1.22 C ATOM 813 CG ARG A 52 -11.470 -0.403 -6.458 1.00 64.45 C ATOM 814 CD ARG A 52 -11.458 -0.215 -8.000 1.00 51.22 C ATOM 815 NE ARG A 52 -10.467 0.797 -8.409 1.00 2.33 N ATOM 816 CZ ARG A 52 -10.672 1.825 -9.247 1.00 65.01 C ATOM 817 NH1 ARG A 52 -11.852 2.032 -9.814 1.00 42.22 N ATOM 818 NH2 ARG A 52 -9.675 2.660 -9.499 1.00 2.34 N ATOM 0 H ARG A 52 -12.977 -3.828 -4.966 1.00 4.13 H new ATOM 0 HA ARG A 52 -11.120 -1.842 -4.076 1.00 15.33 H new ATOM 0 HB2 ARG A 52 -11.580 -2.558 -6.471 1.00 1.22 H new ATOM 0 HB3 ARG A 52 -13.140 -1.767 -6.371 1.00 1.22 H new ATOM 0 HG2 ARG A 52 -12.010 0.428 -6.003 1.00 64.45 H new ATOM 0 HG3 ARG A 52 -10.446 -0.359 -6.087 1.00 64.45 H new ATOM 0 HD2 ARG A 52 -11.230 -1.166 -8.483 1.00 51.22 H new ATOM 0 HD3 ARG A 52 -12.449 0.086 -8.339 1.00 51.22 H new ATOM 0 HE ARG A 52 -9.530 0.707 -8.015 1.00 2.33 H new ATOM 0 HH11 ARG A 52 -12.630 1.403 -9.617 1.00 42.22 H new ATOM 0 HH12 ARG A 52 -11.982 2.821 -10.447 1.00 42.22 H new ATOM 0 HH21 ARG A 52 -8.766 2.517 -9.058 1.00 2.34 H new ATOM 0 HH22 ARG A 52 -9.816 3.446 -10.134 1.00 2.34 H new ATOM 832 N VAL A 53 -12.427 0.009 -3.001 1.00 53.31 N ATOM 833 CA VAL A 53 -13.150 1.113 -2.329 1.00 14.20 C ATOM 834 C VAL A 53 -12.421 2.439 -2.605 1.00 11.35 C ATOM 835 O VAL A 53 -11.378 2.451 -3.263 1.00 44.34 O ATOM 836 CB VAL A 53 -13.294 0.902 -0.771 1.00 4.02 C ATOM 837 CG1 VAL A 53 -14.054 -0.399 -0.431 1.00 63.43 C ATOM 838 CG2 VAL A 53 -11.924 0.955 -0.056 1.00 33.52 C ATOM 0 H VAL A 53 -11.421 0.018 -2.833 1.00 53.31 H new ATOM 0 HA VAL A 53 -14.160 1.133 -2.739 1.00 14.20 H new ATOM 0 HB VAL A 53 -13.892 1.733 -0.396 1.00 4.02 H new ATOM 0 HG11 VAL A 53 -14.130 -0.504 0.651 1.00 63.43 H new ATOM 0 HG12 VAL A 53 -15.054 -0.360 -0.863 1.00 63.43 H new ATOM 0 HG13 VAL A 53 -13.515 -1.253 -0.841 1.00 63.43 H new ATOM 0 HG21 VAL A 53 -12.066 0.806 1.014 1.00 33.52 H new ATOM 0 HG22 VAL A 53 -11.278 0.170 -0.449 1.00 33.52 H new ATOM 0 HG23 VAL A 53 -11.461 1.927 -0.228 1.00 33.52 H new ATOM 848 N GLU A 54 -12.986 3.551 -2.111 1.00 42.44 N ATOM 849 CA GLU A 54 -12.399 4.894 -2.260 1.00 41.04 C ATOM 850 C GLU A 54 -12.653 5.750 -0.996 1.00 11.53 C ATOM 851 O GLU A 54 -13.682 5.596 -0.336 1.00 41.31 O ATOM 852 CB GLU A 54 -12.947 5.557 -3.550 1.00 5.21 C ATOM 853 CG GLU A 54 -14.486 5.575 -3.672 1.00 54.52 C ATOM 854 CD GLU A 54 -14.974 6.056 -5.046 1.00 12.35 C ATOM 855 OE1 GLU A 54 -14.786 5.318 -6.039 1.00 4.30 O ATOM 856 OE2 GLU A 54 -15.517 7.184 -5.149 1.00 64.50 O ATOM 0 H GLU A 54 -13.866 3.546 -1.595 1.00 42.44 H new ATOM 0 HA GLU A 54 -11.317 4.812 -2.361 1.00 41.04 H new ATOM 0 HB2 GLU A 54 -12.582 6.583 -3.596 1.00 5.21 H new ATOM 0 HB3 GLU A 54 -12.535 5.033 -4.413 1.00 5.21 H new ATOM 0 HG2 GLU A 54 -14.871 4.572 -3.486 1.00 54.52 H new ATOM 0 HG3 GLU A 54 -14.899 6.223 -2.899 1.00 54.52 H new ATOM 863 N ALA A 55 -11.712 6.658 -0.679 1.00 12.22 N ATOM 864 CA ALA A 55 -11.696 7.432 0.573 1.00 70.24 C ATOM 865 C ALA A 55 -11.616 8.945 0.321 1.00 2.32 C ATOM 866 O ALA A 55 -11.250 9.393 -0.769 1.00 63.30 O ATOM 867 CB ALA A 55 -10.502 6.985 1.424 1.00 1.25 C ATOM 0 H ALA A 55 -10.930 6.877 -1.296 1.00 12.22 H new ATOM 0 HA ALA A 55 -12.632 7.241 1.097 1.00 70.24 H new ATOM 0 HB1 ALA A 55 -10.484 7.554 2.353 1.00 1.25 H new ATOM 0 HB2 ALA A 55 -10.594 5.923 1.651 1.00 1.25 H new ATOM 0 HB3 ALA A 55 -9.577 7.159 0.874 1.00 1.25 H new ATOM 873 N THR A 56 -11.958 9.716 1.363 1.00 31.43 N ATOM 874 CA THR A 56 -11.827 11.175 1.387 1.00 25.54 C ATOM 875 C THR A 56 -10.553 11.539 2.179 1.00 14.25 C ATOM 876 O THR A 56 -10.316 10.996 3.266 1.00 4.03 O ATOM 877 CB THR A 56 -13.079 11.827 2.062 1.00 45.34 C ATOM 878 OG1 THR A 56 -14.282 11.294 1.476 1.00 54.13 O ATOM 879 CG2 THR A 56 -13.082 13.361 1.916 1.00 24.45 C ATOM 0 H THR A 56 -12.340 9.333 2.228 1.00 31.43 H new ATOM 0 HA THR A 56 -11.756 11.552 0.367 1.00 25.54 H new ATOM 0 HB THR A 56 -13.037 11.589 3.125 1.00 45.34 H new ATOM 0 HG1 THR A 56 -15.063 11.704 1.903 1.00 54.13 H new ATOM 0 HG21 THR A 56 -13.969 13.771 2.399 1.00 24.45 H new ATOM 0 HG22 THR A 56 -12.189 13.773 2.387 1.00 24.45 H new ATOM 0 HG23 THR A 56 -13.090 13.626 0.859 1.00 24.45 H new ATOM 887 N VAL A 57 -9.756 12.455 1.628 1.00 75.11 N ATOM 888 CA VAL A 57 -8.439 12.824 2.164 1.00 25.01 C ATOM 889 C VAL A 57 -8.570 13.864 3.295 1.00 52.32 C ATOM 890 O VAL A 57 -9.338 14.824 3.185 1.00 1.34 O ATOM 891 CB VAL A 57 -7.525 13.388 1.013 1.00 75.31 C ATOM 892 CG1 VAL A 57 -6.080 13.615 1.500 1.00 52.22 C ATOM 893 CG2 VAL A 57 -7.555 12.458 -0.222 1.00 30.54 C ATOM 0 H VAL A 57 -10.008 12.971 0.785 1.00 75.11 H new ATOM 0 HA VAL A 57 -7.979 11.928 2.580 1.00 25.01 H new ATOM 0 HB VAL A 57 -7.927 14.357 0.717 1.00 75.31 H new ATOM 0 HG11 VAL A 57 -5.477 14.005 0.680 1.00 52.22 H new ATOM 0 HG12 VAL A 57 -6.081 14.331 2.322 1.00 52.22 H new ATOM 0 HG13 VAL A 57 -5.659 12.670 1.843 1.00 52.22 H new ATOM 0 HG21 VAL A 57 -6.916 12.870 -1.003 1.00 30.54 H new ATOM 0 HG22 VAL A 57 -7.194 11.469 0.059 1.00 30.54 H new ATOM 0 HG23 VAL A 57 -8.577 12.379 -0.593 1.00 30.54 H new ATOM 903 N THR A 58 -7.801 13.650 4.369 1.00 71.02 N ATOM 904 CA THR A 58 -7.732 14.544 5.524 1.00 73.52 C ATOM 905 C THR A 58 -6.257 14.918 5.752 1.00 64.34 C ATOM 906 O THR A 58 -5.514 14.189 6.423 1.00 21.10 O ATOM 907 CB THR A 58 -8.362 13.852 6.780 1.00 1.21 C ATOM 908 OG1 THR A 58 -9.721 13.486 6.489 1.00 44.24 O ATOM 909 CG2 THR A 58 -8.333 14.746 8.028 1.00 31.40 C ATOM 0 H THR A 58 -7.198 12.832 4.458 1.00 71.02 H new ATOM 0 HA THR A 58 -8.304 15.454 5.344 1.00 73.52 H new ATOM 0 HB THR A 58 -7.761 12.970 7.000 1.00 1.21 H new ATOM 0 HG1 THR A 58 -10.118 13.051 7.273 1.00 44.24 H new ATOM 0 HG21 THR A 58 -8.782 14.215 8.867 1.00 31.40 H new ATOM 0 HG22 THR A 58 -7.301 14.999 8.270 1.00 31.40 H new ATOM 0 HG23 THR A 58 -8.895 15.660 7.834 1.00 31.40 H new ATOM 917 N VAL A 59 -5.833 16.045 5.158 1.00 23.24 N ATOM 918 CA VAL A 59 -4.420 16.442 5.139 1.00 51.10 C ATOM 919 C VAL A 59 -4.072 17.190 6.428 1.00 1.34 C ATOM 920 O VAL A 59 -4.778 18.118 6.825 1.00 64.11 O ATOM 921 CB VAL A 59 -4.047 17.310 3.867 1.00 45.43 C ATOM 922 CG1 VAL A 59 -2.675 18.020 4.012 1.00 50.50 C ATOM 923 CG2 VAL A 59 -4.058 16.437 2.592 1.00 4.33 C ATOM 0 H VAL A 59 -6.454 16.699 4.683 1.00 23.24 H new ATOM 0 HA VAL A 59 -3.825 15.531 5.077 1.00 51.10 H new ATOM 0 HB VAL A 59 -4.807 18.086 3.783 1.00 45.43 H new ATOM 0 HG11 VAL A 59 -2.469 18.601 3.113 1.00 50.50 H new ATOM 0 HG12 VAL A 59 -2.699 18.685 4.876 1.00 50.50 H new ATOM 0 HG13 VAL A 59 -1.892 17.274 4.150 1.00 50.50 H new ATOM 0 HG21 VAL A 59 -3.800 17.050 1.729 1.00 4.33 H new ATOM 0 HG22 VAL A 59 -3.331 15.632 2.696 1.00 4.33 H new ATOM 0 HG23 VAL A 59 -5.052 16.012 2.451 1.00 4.33 H new ATOM 933 N HIS A 60 -2.981 16.754 7.073 1.00 64.44 N ATOM 934 CA HIS A 60 -2.416 17.420 8.238 1.00 2.01 C ATOM 935 C HIS A 60 -1.396 18.441 7.739 1.00 41.22 C ATOM 936 O HIS A 60 -0.266 18.087 7.373 1.00 74.45 O ATOM 937 CB HIS A 60 -1.803 16.374 9.204 1.00 41.11 C ATOM 938 CG HIS A 60 -2.859 15.434 9.737 1.00 22.10 C ATOM 939 ND1 HIS A 60 -3.306 14.328 9.037 1.00 64.20 N ATOM 940 CD2 HIS A 60 -3.635 15.503 10.851 1.00 3.04 C ATOM 941 CE1 HIS A 60 -4.310 13.773 9.688 1.00 0.05 C ATOM 942 NE2 HIS A 60 -4.530 14.464 10.789 1.00 5.34 N ATOM 0 H HIS A 60 -2.466 15.920 6.792 1.00 64.44 H new ATOM 0 HA HIS A 60 -3.182 17.945 8.809 1.00 2.01 H new ATOM 0 HB2 HIS A 60 -1.034 15.803 8.684 1.00 41.11 H new ATOM 0 HB3 HIS A 60 -1.315 16.885 10.034 1.00 41.11 H new ATOM 0 HD2 HIS A 60 -3.561 16.238 11.638 1.00 3.04 H new ATOM 0 HE1 HIS A 60 -4.860 12.899 9.372 1.00 0.05 H new ATOM 0 HE2 HIS A 60 -5.249 14.260 11.483 1.00 5.34 H new ATOM 951 N GLU A 61 -1.869 19.702 7.661 1.00 64.55 N ATOM 952 CA GLU A 61 -1.086 20.853 7.158 1.00 22.24 C ATOM 953 C GLU A 61 0.181 21.096 8.010 1.00 15.35 C ATOM 954 O GLU A 61 1.112 21.774 7.573 1.00 34.31 O ATOM 955 CB GLU A 61 -1.975 22.123 7.088 1.00 1.00 C ATOM 956 CG GLU A 61 -2.496 22.644 8.440 1.00 74.44 C ATOM 957 CD GLU A 61 -3.509 23.788 8.282 1.00 63.23 C ATOM 958 OE1 GLU A 61 -3.088 24.936 8.013 1.00 54.11 O ATOM 959 OE2 GLU A 61 -4.734 23.544 8.409 1.00 23.21 O ATOM 0 H GLU A 61 -2.815 19.954 7.948 1.00 64.55 H new ATOM 0 HA GLU A 61 -0.749 20.617 6.149 1.00 22.24 H new ATOM 0 HB2 GLU A 61 -1.405 22.918 6.608 1.00 1.00 H new ATOM 0 HB3 GLU A 61 -2.830 21.911 6.446 1.00 1.00 H new ATOM 0 HG2 GLU A 61 -2.962 21.824 8.986 1.00 74.44 H new ATOM 0 HG3 GLU A 61 -1.655 22.989 9.041 1.00 74.44 H new ATOM 966 N THR A 62 0.187 20.535 9.228 1.00 34.45 N ATOM 967 CA THR A 62 1.373 20.405 10.075 1.00 11.53 C ATOM 968 C THR A 62 1.707 18.886 10.198 1.00 64.12 C ATOM 969 O THR A 62 1.160 18.197 11.070 1.00 41.11 O ATOM 970 CB THR A 62 1.112 21.066 11.478 1.00 62.10 C ATOM 971 OG1 THR A 62 -0.139 20.599 12.020 1.00 24.11 O ATOM 972 CG2 THR A 62 1.080 22.608 11.406 1.00 45.23 C ATOM 0 H THR A 62 -0.655 20.151 9.658 1.00 34.45 H new ATOM 0 HA THR A 62 2.225 20.924 9.637 1.00 11.53 H new ATOM 0 HB THR A 62 1.941 20.774 12.123 1.00 62.10 H new ATOM 0 HG1 THR A 62 -0.170 19.621 11.974 1.00 24.11 H new ATOM 0 HG21 THR A 62 0.897 23.015 12.400 1.00 45.23 H new ATOM 0 HG22 THR A 62 2.037 22.975 11.034 1.00 45.23 H new ATOM 0 HG23 THR A 62 0.284 22.924 10.732 1.00 45.23 H new ATOM 980 N PRO A 63 2.548 18.314 9.261 1.00 53.32 N ATOM 981 CA PRO A 63 2.804 16.850 9.194 1.00 62.44 C ATOM 982 C PRO A 63 3.822 16.347 10.254 1.00 21.20 C ATOM 983 O PRO A 63 4.933 16.886 10.359 1.00 13.23 O ATOM 984 CB PRO A 63 3.347 16.671 7.752 1.00 72.24 C ATOM 985 CG PRO A 63 4.042 17.960 7.433 1.00 31.23 C ATOM 986 CD PRO A 63 3.295 19.047 8.192 1.00 55.01 C ATOM 0 HA PRO A 63 1.910 16.265 9.411 1.00 62.44 H new ATOM 0 HB2 PRO A 63 4.034 15.827 7.692 1.00 72.24 H new ATOM 0 HB3 PRO A 63 2.538 16.474 7.048 1.00 72.24 H new ATOM 0 HG2 PRO A 63 5.088 17.923 7.736 1.00 31.23 H new ATOM 0 HG3 PRO A 63 4.028 18.155 6.361 1.00 31.23 H new ATOM 0 HD2 PRO A 63 3.983 19.777 8.618 1.00 55.01 H new ATOM 0 HD3 PRO A 63 2.616 19.593 7.537 1.00 55.01 H new ATOM 994 N GLU A 64 3.431 15.313 11.038 1.00 42.43 N ATOM 995 CA GLU A 64 4.322 14.698 12.057 1.00 23.22 C ATOM 996 C GLU A 64 5.286 13.680 11.417 1.00 53.32 C ATOM 997 O GLU A 64 5.208 13.406 10.223 1.00 74.22 O ATOM 998 CB GLU A 64 3.504 14.014 13.186 1.00 12.44 C ATOM 999 CG GLU A 64 2.613 12.839 12.724 1.00 33.33 C ATOM 1000 CD GLU A 64 1.978 12.045 13.877 1.00 54.23 C ATOM 1001 OE1 GLU A 64 1.251 12.649 14.693 1.00 24.12 O ATOM 1002 OE2 GLU A 64 2.178 10.810 13.959 1.00 14.34 O ATOM 0 H GLU A 64 2.506 14.887 10.986 1.00 42.43 H new ATOM 0 HA GLU A 64 4.909 15.505 12.496 1.00 23.22 H new ATOM 0 HB2 GLU A 64 4.195 13.650 13.946 1.00 12.44 H new ATOM 0 HB3 GLU A 64 2.873 14.764 13.663 1.00 12.44 H new ATOM 0 HG2 GLU A 64 1.821 13.227 12.084 1.00 33.33 H new ATOM 0 HG3 GLU A 64 3.211 12.161 12.115 1.00 33.33 H new ATOM 1009 N SER A 65 6.179 13.113 12.239 1.00 21.05 N ATOM 1010 CA SER A 65 7.205 12.157 11.795 1.00 31.24 C ATOM 1011 C SER A 65 6.859 10.731 12.274 1.00 34.43 C ATOM 1012 O SER A 65 6.723 10.493 13.475 1.00 5.22 O ATOM 1013 CB SER A 65 8.569 12.612 12.339 1.00 73.05 C ATOM 1014 OG SER A 65 8.877 13.920 11.874 1.00 3.24 O ATOM 0 H SER A 65 6.211 13.306 13.240 1.00 21.05 H new ATOM 0 HA SER A 65 7.244 12.132 10.706 1.00 31.24 H new ATOM 0 HB2 SER A 65 8.555 12.601 13.429 1.00 73.05 H new ATOM 0 HB3 SER A 65 9.345 11.915 12.023 1.00 73.05 H new ATOM 0 HG SER A 65 9.747 14.197 12.230 1.00 3.24 H new ATOM 1020 N VAL A 66 6.676 9.800 11.314 1.00 2.45 N ATOM 1021 CA VAL A 66 6.379 8.375 11.583 1.00 14.42 C ATOM 1022 C VAL A 66 7.418 7.510 10.841 1.00 41.35 C ATOM 1023 O VAL A 66 7.491 7.573 9.614 1.00 33.15 O ATOM 1024 CB VAL A 66 4.925 7.985 11.090 1.00 54.43 C ATOM 1025 CG1 VAL A 66 4.511 6.569 11.575 1.00 53.41 C ATOM 1026 CG2 VAL A 66 3.887 9.063 11.490 1.00 21.23 C ATOM 0 H VAL A 66 6.731 10.018 10.319 1.00 2.45 H new ATOM 0 HA VAL A 66 6.427 8.203 12.658 1.00 14.42 H new ATOM 0 HB VAL A 66 4.948 7.948 10.001 1.00 54.43 H new ATOM 0 HG11 VAL A 66 3.508 6.340 11.216 1.00 53.41 H new ATOM 0 HG12 VAL A 66 5.213 5.831 11.186 1.00 53.41 H new ATOM 0 HG13 VAL A 66 4.521 6.540 12.665 1.00 53.41 H new ATOM 0 HG21 VAL A 66 2.899 8.766 11.137 1.00 21.23 H new ATOM 0 HG22 VAL A 66 3.869 9.166 12.575 1.00 21.23 H new ATOM 0 HG23 VAL A 66 4.161 10.017 11.040 1.00 21.23 H new ATOM 1036 N ASP A 67 8.199 6.695 11.572 1.00 53.13 N ATOM 1037 CA ASP A 67 9.263 5.872 10.965 1.00 65.43 C ATOM 1038 C ASP A 67 8.661 4.577 10.403 1.00 21.54 C ATOM 1039 O ASP A 67 8.113 3.758 11.153 1.00 13.11 O ATOM 1040 CB ASP A 67 10.386 5.556 11.987 1.00 24.44 C ATOM 1041 CG ASP A 67 11.175 6.813 12.410 1.00 52.23 C ATOM 1042 OD1 ASP A 67 11.909 7.381 11.566 1.00 12.02 O ATOM 1043 OD2 ASP A 67 11.056 7.249 13.578 1.00 42.55 O ATOM 0 H ASP A 67 8.114 6.588 12.583 1.00 53.13 H new ATOM 0 HA ASP A 67 9.713 6.439 10.150 1.00 65.43 H new ATOM 0 HB2 ASP A 67 9.948 5.092 12.871 1.00 24.44 H new ATOM 0 HB3 ASP A 67 11.073 4.829 11.553 1.00 24.44 H new ATOM 1048 N LEU A 68 8.747 4.425 9.071 1.00 24.22 N ATOM 1049 CA LEU A 68 8.279 3.229 8.334 1.00 55.13 C ATOM 1050 C LEU A 68 9.442 2.734 7.456 1.00 11.21 C ATOM 1051 O LEU A 68 10.456 3.436 7.310 1.00 62.31 O ATOM 1052 CB LEU A 68 7.046 3.567 7.438 1.00 3.21 C ATOM 1053 CG LEU A 68 5.872 4.327 8.122 1.00 62.11 C ATOM 1054 CD1 LEU A 68 4.834 4.779 7.080 1.00 2.32 C ATOM 1055 CD2 LEU A 68 5.211 3.482 9.236 1.00 42.13 C ATOM 0 H LEU A 68 9.149 5.138 8.462 1.00 24.22 H new ATOM 0 HA LEU A 68 7.970 2.460 9.042 1.00 55.13 H new ATOM 0 HB2 LEU A 68 7.392 4.164 6.594 1.00 3.21 H new ATOM 0 HB3 LEU A 68 6.656 2.634 7.030 1.00 3.21 H new ATOM 0 HG LEU A 68 6.289 5.215 8.597 1.00 62.11 H new ATOM 0 HD11 LEU A 68 4.023 5.308 7.580 1.00 2.32 H new ATOM 0 HD12 LEU A 68 5.309 5.443 6.358 1.00 2.32 H new ATOM 0 HD13 LEU A 68 4.434 3.907 6.563 1.00 2.32 H new ATOM 0 HD21 LEU A 68 4.397 4.049 9.688 1.00 42.13 H new ATOM 0 HD22 LEU A 68 4.818 2.560 8.808 1.00 42.13 H new ATOM 0 HD23 LEU A 68 5.952 3.241 9.998 1.00 42.13 H new ATOM 1067 N GLU A 69 9.316 1.533 6.877 1.00 21.22 N ATOM 1068 CA GLU A 69 10.287 1.060 5.878 1.00 54.02 C ATOM 1069 C GLU A 69 9.928 1.622 4.501 1.00 35.44 C ATOM 1070 O GLU A 69 8.757 1.909 4.210 1.00 15.32 O ATOM 1071 CB GLU A 69 10.358 -0.484 5.794 1.00 35.42 C ATOM 1072 CG GLU A 69 9.073 -1.180 5.305 1.00 64.43 C ATOM 1073 CD GLU A 69 9.268 -2.680 5.041 1.00 71.45 C ATOM 1074 OE1 GLU A 69 9.707 -3.041 3.930 1.00 5.32 O ATOM 1075 OE2 GLU A 69 8.971 -3.501 5.932 1.00 1.32 O ATOM 0 H GLU A 69 8.561 0.877 7.079 1.00 21.22 H new ATOM 0 HA GLU A 69 11.267 1.416 6.196 1.00 54.02 H new ATOM 0 HB2 GLU A 69 11.175 -0.757 5.127 1.00 35.42 H new ATOM 0 HB3 GLU A 69 10.609 -0.873 6.781 1.00 35.42 H new ATOM 0 HG2 GLU A 69 8.288 -1.047 6.049 1.00 64.43 H new ATOM 0 HG3 GLU A 69 8.730 -0.697 4.390 1.00 64.43 H new ATOM 1082 N THR A 70 10.957 1.772 3.680 1.00 31.15 N ATOM 1083 CA THR A 70 10.826 2.099 2.261 1.00 52.24 C ATOM 1084 C THR A 70 11.044 0.814 1.435 1.00 73.22 C ATOM 1085 O THR A 70 11.423 -0.240 1.978 1.00 0.42 O ATOM 1086 CB THR A 70 11.856 3.222 1.874 1.00 65.54 C ATOM 1087 OG1 THR A 70 11.811 3.524 0.477 1.00 62.31 O ATOM 1088 CG2 THR A 70 13.290 2.839 2.259 1.00 3.23 C ATOM 0 H THR A 70 11.925 1.669 3.983 1.00 31.15 H new ATOM 0 HA THR A 70 9.829 2.484 2.048 1.00 52.24 H new ATOM 0 HB THR A 70 11.564 4.108 2.438 1.00 65.54 H new ATOM 0 HG1 THR A 70 11.659 4.484 0.355 1.00 62.31 H new ATOM 0 HG21 THR A 70 13.970 3.642 1.974 1.00 3.23 H new ATOM 0 HG22 THR A 70 13.347 2.680 3.336 1.00 3.23 H new ATOM 0 HG23 THR A 70 13.573 1.923 1.741 1.00 3.23 H new ATOM 1096 N SER A 71 10.863 0.922 0.116 1.00 13.54 N ATOM 1097 CA SER A 71 10.978 -0.209 -0.828 1.00 11.40 C ATOM 1098 C SER A 71 12.454 -0.420 -1.276 1.00 61.30 C ATOM 1099 O SER A 71 12.727 -1.064 -2.291 1.00 3.04 O ATOM 1100 CB SER A 71 10.055 0.069 -2.026 1.00 23.53 C ATOM 1101 OG SER A 71 8.726 0.356 -1.608 1.00 43.43 O ATOM 0 H SER A 71 10.630 1.805 -0.338 1.00 13.54 H new ATOM 0 HA SER A 71 10.670 -1.134 -0.340 1.00 11.40 H new ATOM 0 HB2 SER A 71 10.446 0.909 -2.600 1.00 23.53 H new ATOM 0 HB3 SER A 71 10.049 -0.795 -2.690 1.00 23.53 H new ATOM 0 HG SER A 71 8.166 0.530 -2.394 1.00 43.43 H new ATOM 1107 N ASP A 72 13.388 0.080 -0.456 1.00 23.15 N ATOM 1108 CA ASP A 72 14.812 0.251 -0.808 1.00 74.25 C ATOM 1109 C ASP A 72 15.723 -0.530 0.184 1.00 74.24 C ATOM 1110 O ASP A 72 16.952 -0.354 0.206 1.00 63.23 O ATOM 1111 CB ASP A 72 15.097 1.788 -0.813 1.00 54.31 C ATOM 1112 CG ASP A 72 16.548 2.183 -1.128 1.00 31.55 C ATOM 1113 OD1 ASP A 72 17.009 1.934 -2.257 1.00 61.04 O ATOM 1114 OD2 ASP A 72 17.236 2.744 -0.242 1.00 21.12 O ATOM 0 H ASP A 72 13.174 0.385 0.493 1.00 23.15 H new ATOM 0 HA ASP A 72 15.034 -0.162 -1.792 1.00 74.25 H new ATOM 0 HB2 ASP A 72 14.442 2.260 -1.545 1.00 54.31 H new ATOM 0 HB3 ASP A 72 14.830 2.194 0.163 1.00 54.31 H new ATOM 1119 N ASP A 73 15.097 -1.448 0.965 1.00 43.22 N ATOM 1120 CA ASP A 73 15.767 -2.238 2.032 1.00 52.45 C ATOM 1121 C ASP A 73 16.367 -1.303 3.103 1.00 74.34 C ATOM 1122 O ASP A 73 17.467 -1.540 3.621 1.00 4.32 O ATOM 1123 CB ASP A 73 16.865 -3.184 1.448 1.00 2.13 C ATOM 1124 CG ASP A 73 16.343 -4.229 0.445 1.00 63.22 C ATOM 1125 OD1 ASP A 73 15.866 -3.835 -0.646 1.00 45.13 O ATOM 1126 OD2 ASP A 73 16.458 -5.447 0.709 1.00 42.45 O ATOM 0 H ASP A 73 14.104 -1.663 0.871 1.00 43.22 H new ATOM 0 HA ASP A 73 15.010 -2.866 2.501 1.00 52.45 H new ATOM 0 HB2 ASP A 73 17.626 -2.577 0.957 1.00 2.13 H new ATOM 0 HB3 ASP A 73 17.354 -3.703 2.272 1.00 2.13 H new ATOM 1131 N ARG A 74 15.623 -0.239 3.446 1.00 34.31 N ATOM 1132 CA ARG A 74 16.094 0.788 4.393 1.00 41.04 C ATOM 1133 C ARG A 74 14.941 1.170 5.360 1.00 60.20 C ATOM 1134 O ARG A 74 13.787 0.776 5.144 1.00 1.13 O ATOM 1135 CB ARG A 74 16.614 2.029 3.584 1.00 14.35 C ATOM 1136 CG ARG A 74 17.598 2.945 4.344 1.00 12.22 C ATOM 1137 CD ARG A 74 17.960 4.228 3.567 1.00 33.12 C ATOM 1138 NE ARG A 74 18.526 3.964 2.225 1.00 2.13 N ATOM 1139 CZ ARG A 74 19.250 4.843 1.498 1.00 11.34 C ATOM 1140 NH1 ARG A 74 19.524 6.061 1.968 1.00 61.53 N ATOM 1141 NH2 ARG A 74 19.666 4.506 0.285 1.00 1.21 N ATOM 0 H ARG A 74 14.687 -0.066 3.080 1.00 34.31 H new ATOM 0 HA ARG A 74 16.918 0.405 4.996 1.00 41.04 H new ATOM 0 HB2 ARG A 74 17.102 1.672 2.677 1.00 14.35 H new ATOM 0 HB3 ARG A 74 15.756 2.624 3.272 1.00 14.35 H new ATOM 0 HG2 ARG A 74 17.160 3.221 5.303 1.00 12.22 H new ATOM 0 HG3 ARG A 74 18.510 2.388 4.558 1.00 12.22 H new ATOM 0 HD2 ARG A 74 17.067 4.844 3.461 1.00 33.12 H new ATOM 0 HD3 ARG A 74 18.678 4.805 4.149 1.00 33.12 H new ATOM 0 HE ARG A 74 18.356 3.045 1.816 1.00 2.13 H new ATOM 0 HH11 ARG A 74 19.186 6.340 2.889 1.00 61.53 H new ATOM 0 HH12 ARG A 74 20.072 6.713 1.407 1.00 61.53 H new ATOM 0 HH21 ARG A 74 19.439 3.587 -0.095 1.00 1.21 H new ATOM 0 HH22 ARG A 74 20.213 5.166 -0.268 1.00 1.21 H new ATOM 1155 N THR A 75 15.261 1.970 6.388 1.00 22.42 N ATOM 1156 CA THR A 75 14.297 2.474 7.376 1.00 12.30 C ATOM 1157 C THR A 75 14.392 3.994 7.334 1.00 34.15 C ATOM 1158 O THR A 75 15.493 4.541 7.443 1.00 15.42 O ATOM 1159 CB THR A 75 14.622 1.967 8.814 1.00 54.40 C ATOM 1160 OG1 THR A 75 14.785 0.548 8.793 1.00 2.45 O ATOM 1161 CG2 THR A 75 13.515 2.342 9.819 1.00 70.21 C ATOM 0 H THR A 75 16.214 2.290 6.559 1.00 22.42 H new ATOM 0 HA THR A 75 13.295 2.118 7.136 1.00 12.30 H new ATOM 0 HB THR A 75 15.544 2.449 9.138 1.00 54.40 H new ATOM 0 HG1 THR A 75 14.991 0.229 9.696 1.00 2.45 H new ATOM 0 HG21 THR A 75 13.781 1.970 10.809 1.00 70.21 H new ATOM 0 HG22 THR A 75 13.409 3.426 9.855 1.00 70.21 H new ATOM 0 HG23 THR A 75 12.572 1.895 9.505 1.00 70.21 H new ATOM 1169 N VAL A 76 13.261 4.670 7.174 1.00 12.31 N ATOM 1170 CA VAL A 76 13.237 6.115 6.897 1.00 21.24 C ATOM 1171 C VAL A 76 12.040 6.786 7.579 1.00 40.31 C ATOM 1172 O VAL A 76 11.007 6.152 7.838 1.00 64.42 O ATOM 1173 CB VAL A 76 13.213 6.426 5.345 1.00 63.13 C ATOM 1174 CG1 VAL A 76 14.591 6.191 4.679 1.00 15.22 C ATOM 1175 CG2 VAL A 76 12.120 5.609 4.636 1.00 61.24 C ATOM 0 H VAL A 76 12.337 4.243 7.231 1.00 12.31 H new ATOM 0 HA VAL A 76 14.159 6.526 7.307 1.00 21.24 H new ATOM 0 HB VAL A 76 12.979 7.485 5.238 1.00 63.13 H new ATOM 0 HG11 VAL A 76 14.524 6.418 3.615 1.00 15.22 H new ATOM 0 HG12 VAL A 76 15.334 6.840 5.142 1.00 15.22 H new ATOM 0 HG13 VAL A 76 14.886 5.150 4.810 1.00 15.22 H new ATOM 0 HG21 VAL A 76 12.125 5.842 3.571 1.00 61.24 H new ATOM 0 HG22 VAL A 76 12.312 4.545 4.776 1.00 61.24 H new ATOM 0 HG23 VAL A 76 11.147 5.860 5.058 1.00 61.24 H new ATOM 1185 N ARG A 77 12.214 8.077 7.869 1.00 31.04 N ATOM 1186 CA ARG A 77 11.174 8.917 8.450 1.00 73.20 C ATOM 1187 C ARG A 77 10.203 9.339 7.345 1.00 14.12 C ATOM 1188 O ARG A 77 10.622 9.872 6.312 1.00 64.12 O ATOM 1189 CB ARG A 77 11.832 10.145 9.147 1.00 10.41 C ATOM 1190 CG ARG A 77 10.863 11.137 9.851 1.00 72.55 C ATOM 1191 CD ARG A 77 10.371 12.283 8.953 1.00 23.40 C ATOM 1192 NE ARG A 77 11.480 13.158 8.518 1.00 23.24 N ATOM 1193 CZ ARG A 77 11.547 13.820 7.352 1.00 74.13 C ATOM 1194 NH1 ARG A 77 10.577 13.724 6.448 1.00 63.14 N ATOM 1195 NH2 ARG A 77 12.595 14.581 7.093 1.00 70.33 N ATOM 0 H ARG A 77 13.091 8.570 7.704 1.00 31.04 H new ATOM 0 HA ARG A 77 10.611 8.369 9.206 1.00 73.20 H new ATOM 0 HB2 ARG A 77 12.543 9.778 9.887 1.00 10.41 H new ATOM 0 HB3 ARG A 77 12.404 10.696 8.401 1.00 10.41 H new ATOM 0 HG2 ARG A 77 10.000 10.583 10.220 1.00 72.55 H new ATOM 0 HG3 ARG A 77 11.365 11.562 10.721 1.00 72.55 H new ATOM 0 HD2 ARG A 77 9.871 11.869 8.078 1.00 23.40 H new ATOM 0 HD3 ARG A 77 9.632 12.875 9.492 1.00 23.40 H new ATOM 0 HE ARG A 77 12.264 13.269 9.161 1.00 23.24 H new ATOM 0 HH11 ARG A 77 9.762 13.139 6.634 1.00 63.14 H new ATOM 0 HH12 ARG A 77 10.647 14.235 5.568 1.00 63.14 H new ATOM 0 HH21 ARG A 77 13.347 14.663 7.777 1.00 70.33 H new ATOM 0 HH22 ARG A 77 12.652 15.087 6.209 1.00 70.33 H new ATOM 1209 N TYR A 78 8.924 9.062 7.575 1.00 42.12 N ATOM 1210 CA TYR A 78 7.813 9.528 6.736 1.00 75.14 C ATOM 1211 C TYR A 78 7.126 10.706 7.425 1.00 62.23 C ATOM 1212 O TYR A 78 7.165 10.823 8.650 1.00 21.30 O ATOM 1213 CB TYR A 78 6.787 8.386 6.495 1.00 73.22 C ATOM 1214 CG TYR A 78 7.240 7.318 5.486 1.00 42.33 C ATOM 1215 CD1 TYR A 78 8.328 6.484 5.741 1.00 72.45 C ATOM 1216 CD2 TYR A 78 6.579 7.157 4.271 1.00 12.22 C ATOM 1217 CE1 TYR A 78 8.724 5.535 4.824 1.00 21.24 C ATOM 1218 CE2 TYR A 78 6.978 6.213 3.357 1.00 40.52 C ATOM 1219 CZ TYR A 78 8.049 5.403 3.638 1.00 61.45 C ATOM 1220 OH TYR A 78 8.449 4.462 2.727 1.00 75.43 O ATOM 0 H TYR A 78 8.619 8.495 8.366 1.00 42.12 H new ATOM 0 HA TYR A 78 8.207 9.842 5.769 1.00 75.14 H new ATOM 0 HB2 TYR A 78 6.575 7.900 7.447 1.00 73.22 H new ATOM 0 HB3 TYR A 78 5.852 8.824 6.145 1.00 73.22 H new ATOM 0 HD1 TYR A 78 8.868 6.583 6.671 1.00 72.45 H new ATOM 0 HD2 TYR A 78 5.733 7.789 4.042 1.00 12.22 H new ATOM 0 HE1 TYR A 78 9.567 4.895 5.040 1.00 21.24 H new ATOM 0 HE2 TYR A 78 6.451 6.109 2.420 1.00 40.52 H new ATOM 0 HH TYR A 78 8.426 3.574 3.142 1.00 75.43 H new ATOM 1230 N LEU A 79 6.524 11.584 6.631 1.00 20.21 N ATOM 1231 CA LEU A 79 5.680 12.670 7.139 1.00 13.03 C ATOM 1232 C LEU A 79 4.221 12.264 6.991 1.00 30.24 C ATOM 1233 O LEU A 79 3.803 11.821 5.911 1.00 51.30 O ATOM 1234 CB LEU A 79 5.982 14.001 6.395 1.00 3.20 C ATOM 1235 CG LEU A 79 7.383 14.624 6.688 1.00 40.12 C ATOM 1236 CD1 LEU A 79 7.623 15.907 5.855 1.00 23.41 C ATOM 1237 CD2 LEU A 79 7.568 14.889 8.207 1.00 44.55 C ATOM 0 H LEU A 79 6.605 11.567 5.614 1.00 20.21 H new ATOM 0 HA LEU A 79 5.896 12.843 8.193 1.00 13.03 H new ATOM 0 HB2 LEU A 79 5.897 13.826 5.322 1.00 3.20 H new ATOM 0 HB3 LEU A 79 5.216 14.729 6.661 1.00 3.20 H new ATOM 0 HG LEU A 79 8.137 13.898 6.383 1.00 40.12 H new ATOM 0 HD11 LEU A 79 8.608 16.312 6.086 1.00 23.41 H new ATOM 0 HD12 LEU A 79 7.569 15.667 4.793 1.00 23.41 H new ATOM 0 HD13 LEU A 79 6.861 16.647 6.099 1.00 23.41 H new ATOM 0 HD21 LEU A 79 8.552 15.323 8.383 1.00 44.55 H new ATOM 0 HD22 LEU A 79 6.799 15.581 8.552 1.00 44.55 H new ATOM 0 HD23 LEU A 79 7.483 13.950 8.753 1.00 44.55 H new ATOM 1249 N HIS A 80 3.456 12.376 8.092 1.00 24.52 N ATOM 1250 CA HIS A 80 2.027 12.099 8.073 1.00 61.34 C ATOM 1251 C HIS A 80 1.326 13.291 7.436 1.00 60.11 C ATOM 1252 O HIS A 80 1.048 14.307 8.090 1.00 72.13 O ATOM 1253 CB HIS A 80 1.512 11.829 9.509 1.00 30.01 C ATOM 1254 CG HIS A 80 0.050 11.479 9.602 1.00 51.11 C ATOM 1255 ND1 HIS A 80 -0.714 11.851 10.685 1.00 31.24 N ATOM 1256 CD2 HIS A 80 -0.726 10.791 8.736 1.00 34.45 C ATOM 1257 CE1 HIS A 80 -1.922 11.389 10.447 1.00 22.11 C ATOM 1258 NE2 HIS A 80 -1.975 10.743 9.278 1.00 61.50 N ATOM 0 H HIS A 80 3.815 12.658 9.004 1.00 24.52 H new ATOM 0 HA HIS A 80 1.815 11.204 7.488 1.00 61.34 H new ATOM 0 HB2 HIS A 80 2.094 11.015 9.941 1.00 30.01 H new ATOM 0 HB3 HIS A 80 1.699 12.713 10.119 1.00 30.01 H new ATOM 0 HD2 HIS A 80 -0.416 10.362 7.795 1.00 34.45 H new ATOM 0 HE1 HIS A 80 -2.764 11.515 11.111 1.00 22.11 H new ATOM 0 HE2 HIS A 80 -2.796 10.298 8.869 1.00 61.50 H new ATOM 1266 N VAL A 81 1.059 13.142 6.140 1.00 2.54 N ATOM 1267 CA VAL A 81 0.514 14.219 5.316 1.00 40.42 C ATOM 1268 C VAL A 81 -0.998 14.118 5.197 1.00 53.14 C ATOM 1269 O VAL A 81 -1.652 15.130 5.022 1.00 41.33 O ATOM 1270 CB VAL A 81 1.168 14.240 3.891 1.00 75.44 C ATOM 1271 CG1 VAL A 81 2.688 14.495 3.997 1.00 30.51 C ATOM 1272 CG2 VAL A 81 0.861 12.941 3.105 1.00 44.53 C ATOM 0 H VAL A 81 1.214 12.271 5.632 1.00 2.54 H new ATOM 0 HA VAL A 81 0.757 15.156 5.818 1.00 40.42 H new ATOM 0 HB VAL A 81 0.727 15.063 3.328 1.00 75.44 H new ATOM 0 HG11 VAL A 81 3.126 14.506 2.999 1.00 30.51 H new ATOM 0 HG12 VAL A 81 2.863 15.456 4.481 1.00 30.51 H new ATOM 0 HG13 VAL A 81 3.150 13.703 4.586 1.00 30.51 H new ATOM 0 HG21 VAL A 81 1.330 12.991 2.122 1.00 44.53 H new ATOM 0 HG22 VAL A 81 1.254 12.084 3.651 1.00 44.53 H new ATOM 0 HG23 VAL A 81 -0.217 12.833 2.987 1.00 44.53 H new ATOM 1282 N ALA A 82 -1.549 12.895 5.290 1.00 52.44 N ATOM 1283 CA ALA A 82 -2.988 12.670 5.088 1.00 73.42 C ATOM 1284 C ALA A 82 -3.503 11.474 5.893 1.00 42.43 C ATOM 1285 O ALA A 82 -2.732 10.648 6.368 1.00 72.42 O ATOM 1286 CB ALA A 82 -3.290 12.476 3.589 1.00 51.43 C ATOM 0 H ALA A 82 -1.019 12.050 5.503 1.00 52.44 H new ATOM 0 HA ALA A 82 -3.512 13.555 5.451 1.00 73.42 H new ATOM 0 HB1 ALA A 82 -4.359 12.310 3.452 1.00 51.43 H new ATOM 0 HB2 ALA A 82 -2.987 13.367 3.039 1.00 51.43 H new ATOM 0 HB3 ALA A 82 -2.738 11.614 3.215 1.00 51.43 H new ATOM 1292 N THR A 83 -4.829 11.428 6.058 1.00 31.21 N ATOM 1293 CA THR A 83 -5.561 10.258 6.553 1.00 21.02 C ATOM 1294 C THR A 83 -6.776 10.059 5.636 1.00 74.32 C ATOM 1295 O THR A 83 -7.562 10.981 5.421 1.00 33.22 O ATOM 1296 CB THR A 83 -6.013 10.422 8.039 1.00 72.11 C ATOM 1297 OG1 THR A 83 -4.857 10.663 8.863 1.00 43.02 O ATOM 1298 CG2 THR A 83 -6.771 9.172 8.556 1.00 32.41 C ATOM 0 H THR A 83 -5.436 12.220 5.847 1.00 31.21 H new ATOM 0 HA THR A 83 -4.906 9.387 6.534 1.00 21.02 H new ATOM 0 HB THR A 83 -6.699 11.268 8.091 1.00 72.11 H new ATOM 0 HG1 THR A 83 -4.611 9.838 9.330 1.00 43.02 H new ATOM 0 HG21 THR A 83 -7.067 9.329 9.593 1.00 32.41 H new ATOM 0 HG22 THR A 83 -7.659 9.007 7.946 1.00 32.41 H new ATOM 0 HG23 THR A 83 -6.120 8.300 8.492 1.00 32.41 H new ATOM 1306 N LEU A 84 -6.889 8.860 5.084 1.00 2.04 N ATOM 1307 CA LEU A 84 -7.870 8.517 4.053 1.00 31.33 C ATOM 1308 C LEU A 84 -9.059 7.798 4.729 1.00 10.23 C ATOM 1309 O LEU A 84 -8.951 6.631 5.108 1.00 0.32 O ATOM 1310 CB LEU A 84 -7.173 7.634 2.967 1.00 44.12 C ATOM 1311 CG LEU A 84 -5.795 8.168 2.430 1.00 61.24 C ATOM 1312 CD1 LEU A 84 -5.218 7.249 1.325 1.00 74.34 C ATOM 1313 CD2 LEU A 84 -5.885 9.644 1.957 1.00 3.45 C ATOM 0 H LEU A 84 -6.289 8.077 5.343 1.00 2.04 H new ATOM 0 HA LEU A 84 -8.257 9.405 3.554 1.00 31.33 H new ATOM 0 HB2 LEU A 84 -7.018 6.638 3.381 1.00 44.12 H new ATOM 0 HB3 LEU A 84 -7.853 7.526 2.122 1.00 44.12 H new ATOM 0 HG LEU A 84 -5.099 8.146 3.268 1.00 61.24 H new ATOM 0 HD11 LEU A 84 -4.266 7.650 0.979 1.00 74.34 H new ATOM 0 HD12 LEU A 84 -5.065 6.248 1.728 1.00 74.34 H new ATOM 0 HD13 LEU A 84 -5.917 7.201 0.490 1.00 74.34 H new ATOM 0 HD21 LEU A 84 -4.910 9.970 1.595 1.00 3.45 H new ATOM 0 HD22 LEU A 84 -6.617 9.724 1.153 1.00 3.45 H new ATOM 0 HD23 LEU A 84 -6.192 10.275 2.791 1.00 3.45 H new ATOM 1325 N SER A 85 -10.170 8.530 4.919 1.00 54.04 N ATOM 1326 CA SER A 85 -11.362 8.035 5.621 1.00 63.21 C ATOM 1327 C SER A 85 -12.406 7.521 4.612 1.00 73.41 C ATOM 1328 O SER A 85 -12.849 8.264 3.739 1.00 52.15 O ATOM 1329 CB SER A 85 -11.933 9.171 6.489 1.00 70.51 C ATOM 1330 OG SER A 85 -12.185 10.334 5.712 1.00 21.00 O ATOM 0 H SER A 85 -10.265 9.490 4.586 1.00 54.04 H new ATOM 0 HA SER A 85 -11.094 7.197 6.264 1.00 63.21 H new ATOM 0 HB2 SER A 85 -12.857 8.840 6.964 1.00 70.51 H new ATOM 0 HB3 SER A 85 -11.231 9.409 7.288 1.00 70.51 H new ATOM 0 HG SER A 85 -12.466 10.071 4.811 1.00 21.00 H new ATOM 1336 N PHE A 86 -12.795 6.255 4.763 1.00 34.05 N ATOM 1337 CA PHE A 86 -13.708 5.546 3.851 1.00 31.05 C ATOM 1338 C PHE A 86 -14.649 4.629 4.642 1.00 73.24 C ATOM 1339 O PHE A 86 -14.700 4.686 5.868 1.00 41.31 O ATOM 1340 CB PHE A 86 -12.900 4.718 2.802 1.00 33.12 C ATOM 1341 CG PHE A 86 -11.858 3.747 3.378 1.00 73.24 C ATOM 1342 CD1 PHE A 86 -10.627 4.214 3.836 1.00 70.22 C ATOM 1343 CD2 PHE A 86 -12.103 2.379 3.446 1.00 51.15 C ATOM 1344 CE1 PHE A 86 -9.683 3.351 4.348 1.00 34.42 C ATOM 1345 CE2 PHE A 86 -11.154 1.514 3.958 1.00 71.34 C ATOM 1346 CZ PHE A 86 -9.947 2.000 4.409 1.00 2.13 C ATOM 0 H PHE A 86 -12.479 5.675 5.540 1.00 34.05 H new ATOM 0 HA PHE A 86 -14.307 6.286 3.321 1.00 31.05 H new ATOM 0 HB2 PHE A 86 -13.604 4.148 2.196 1.00 33.12 H new ATOM 0 HB3 PHE A 86 -12.392 5.412 2.132 1.00 33.12 H new ATOM 0 HD1 PHE A 86 -10.409 5.271 3.789 1.00 70.22 H new ATOM 0 HD2 PHE A 86 -13.046 1.988 3.094 1.00 51.15 H new ATOM 0 HE1 PHE A 86 -8.737 3.733 4.701 1.00 34.42 H new ATOM 0 HE2 PHE A 86 -11.360 0.455 4.004 1.00 71.34 H new ATOM 0 HZ PHE A 86 -9.208 1.323 4.810 1.00 2.13 H new ATOM 1356 N ASP A 87 -15.412 3.813 3.903 1.00 33.14 N ATOM 1357 CA ASP A 87 -16.252 2.738 4.449 1.00 22.01 C ATOM 1358 C ASP A 87 -15.757 1.407 3.867 1.00 5.53 C ATOM 1359 O ASP A 87 -15.470 1.322 2.666 1.00 21.41 O ATOM 1360 CB ASP A 87 -17.746 2.969 4.095 1.00 35.34 C ATOM 1361 CG ASP A 87 -18.661 1.815 4.554 1.00 34.52 C ATOM 1362 OD1 ASP A 87 -18.910 1.692 5.769 1.00 23.31 O ATOM 1363 OD2 ASP A 87 -19.110 1.016 3.699 1.00 5.52 O ATOM 0 H ASP A 87 -15.464 3.883 2.887 1.00 33.14 H new ATOM 0 HA ASP A 87 -16.176 2.723 5.536 1.00 22.01 H new ATOM 0 HB2 ASP A 87 -18.083 3.898 4.556 1.00 35.34 H new ATOM 0 HB3 ASP A 87 -17.843 3.095 3.017 1.00 35.34 H new ATOM 1368 N LEU A 88 -15.659 0.394 4.731 1.00 33.22 N ATOM 1369 CA LEU A 88 -15.217 -0.962 4.362 1.00 43.42 C ATOM 1370 C LEU A 88 -15.734 -1.933 5.433 1.00 52.41 C ATOM 1371 O LEU A 88 -15.805 -1.558 6.617 1.00 73.23 O ATOM 1372 CB LEU A 88 -13.662 -1.041 4.243 1.00 71.41 C ATOM 1373 CG LEU A 88 -13.061 -2.426 3.844 1.00 21.43 C ATOM 1374 CD1 LEU A 88 -13.390 -2.792 2.377 1.00 13.00 C ATOM 1375 CD2 LEU A 88 -11.538 -2.478 4.117 1.00 31.33 C ATOM 0 H LEU A 88 -15.886 0.489 5.721 1.00 33.22 H new ATOM 0 HA LEU A 88 -15.619 -1.228 3.385 1.00 43.42 H new ATOM 0 HB2 LEU A 88 -13.339 -0.305 3.507 1.00 71.41 H new ATOM 0 HB3 LEU A 88 -13.232 -0.746 5.200 1.00 71.41 H new ATOM 0 HG LEU A 88 -13.533 -3.179 4.475 1.00 21.43 H new ATOM 0 HD11 LEU A 88 -12.955 -3.762 2.138 1.00 13.00 H new ATOM 0 HD12 LEU A 88 -14.471 -2.837 2.247 1.00 13.00 H new ATOM 0 HD13 LEU A 88 -12.976 -2.034 1.711 1.00 13.00 H new ATOM 0 HD21 LEU A 88 -11.150 -3.455 3.829 1.00 31.33 H new ATOM 0 HD22 LEU A 88 -11.038 -1.703 3.536 1.00 31.33 H new ATOM 0 HD23 LEU A 88 -11.353 -2.313 5.178 1.00 31.33 H new ATOM 1387 N ASP A 89 -16.109 -3.149 4.995 1.00 34.54 N ATOM 1388 CA ASP A 89 -16.633 -4.241 5.851 1.00 22.43 C ATOM 1389 C ASP A 89 -18.097 -3.967 6.267 1.00 74.01 C ATOM 1390 O ASP A 89 -19.019 -4.649 5.820 1.00 14.21 O ATOM 1391 CB ASP A 89 -15.708 -4.493 7.085 1.00 61.33 C ATOM 1392 CG ASP A 89 -16.207 -5.601 8.014 1.00 25.34 C ATOM 1393 OD1 ASP A 89 -16.207 -6.775 7.597 1.00 25.32 O ATOM 1394 OD2 ASP A 89 -16.587 -5.303 9.168 1.00 64.30 O ATOM 0 H ASP A 89 -16.056 -3.411 4.011 1.00 34.54 H new ATOM 0 HA ASP A 89 -16.631 -5.159 5.263 1.00 22.43 H new ATOM 0 HB2 ASP A 89 -14.709 -4.750 6.732 1.00 61.33 H new ATOM 0 HB3 ASP A 89 -15.617 -3.568 7.654 1.00 61.33 H new ATOM 1399 N GLY A 90 -18.287 -2.950 7.110 1.00 12.11 N ATOM 1400 CA GLY A 90 -19.616 -2.531 7.566 1.00 20.23 C ATOM 1401 C GLY A 90 -19.595 -1.238 8.374 1.00 24.42 C ATOM 1402 O GLY A 90 -20.621 -0.847 8.939 1.00 23.41 O ATOM 0 H GLY A 90 -17.525 -2.393 7.496 1.00 12.11 H new ATOM 0 HA2 GLY A 90 -20.265 -2.400 6.700 1.00 20.23 H new ATOM 0 HA3 GLY A 90 -20.051 -3.324 8.174 1.00 20.23 H new ATOM 1406 N GLU A 91 -18.429 -0.557 8.409 1.00 24.34 N ATOM 1407 CA GLU A 91 -18.234 0.667 9.193 1.00 75.02 C ATOM 1408 C GLU A 91 -17.170 1.555 8.538 1.00 2.21 C ATOM 1409 O GLU A 91 -16.446 1.116 7.629 1.00 51.00 O ATOM 1410 CB GLU A 91 -17.830 0.320 10.649 1.00 21.12 C ATOM 1411 CG GLU A 91 -16.496 -0.444 10.782 1.00 23.25 C ATOM 1412 CD GLU A 91 -16.068 -0.659 12.239 1.00 12.31 C ATOM 1413 OE1 GLU A 91 -16.604 -1.571 12.902 1.00 40.04 O ATOM 1414 OE2 GLU A 91 -15.196 0.088 12.728 1.00 55.31 O ATOM 0 H GLU A 91 -17.599 -0.847 7.891 1.00 24.34 H new ATOM 0 HA GLU A 91 -19.175 1.216 9.219 1.00 75.02 H new ATOM 0 HB2 GLU A 91 -17.763 1.244 11.223 1.00 21.12 H new ATOM 0 HB3 GLU A 91 -18.622 -0.278 11.099 1.00 21.12 H new ATOM 0 HG2 GLU A 91 -16.588 -1.412 10.290 1.00 23.25 H new ATOM 0 HG3 GLU A 91 -15.715 0.107 10.258 1.00 23.25 H new ATOM 1421 N SER A 92 -17.082 2.804 9.028 1.00 13.24 N ATOM 1422 CA SER A 92 -16.125 3.789 8.525 1.00 64.32 C ATOM 1423 C SER A 92 -14.712 3.406 8.998 1.00 4.23 C ATOM 1424 O SER A 92 -14.435 3.382 10.197 1.00 3.40 O ATOM 1425 CB SER A 92 -16.508 5.220 8.982 1.00 65.33 C ATOM 1426 OG SER A 92 -15.668 6.202 8.383 1.00 33.13 O ATOM 0 H SER A 92 -17.674 3.153 9.782 1.00 13.24 H new ATOM 0 HA SER A 92 -16.145 3.788 7.435 1.00 64.32 H new ATOM 0 HB2 SER A 92 -17.547 5.420 8.721 1.00 65.33 H new ATOM 0 HB3 SER A 92 -16.433 5.289 10.067 1.00 65.33 H new ATOM 0 HG SER A 92 -15.284 5.843 7.556 1.00 33.13 H new ATOM 1432 N ARG A 93 -13.852 3.065 8.035 1.00 51.12 N ATOM 1433 CA ARG A 93 -12.450 2.685 8.274 1.00 72.01 C ATOM 1434 C ARG A 93 -11.550 3.862 7.841 1.00 10.24 C ATOM 1435 O ARG A 93 -11.966 4.684 7.024 1.00 43.01 O ATOM 1436 CB ARG A 93 -12.110 1.413 7.452 1.00 61.43 C ATOM 1437 CG ARG A 93 -13.023 0.179 7.688 1.00 54.44 C ATOM 1438 CD ARG A 93 -12.912 -0.429 9.093 1.00 55.42 C ATOM 1439 NE ARG A 93 -13.685 -1.687 9.208 1.00 73.30 N ATOM 1440 CZ ARG A 93 -13.648 -2.527 10.258 1.00 24.41 C ATOM 1441 NH1 ARG A 93 -12.903 -2.257 11.325 1.00 10.43 N ATOM 1442 NH2 ARG A 93 -14.377 -3.632 10.249 1.00 54.33 N ATOM 0 H ARG A 93 -14.111 3.044 7.049 1.00 51.12 H new ATOM 0 HA ARG A 93 -12.287 2.467 9.329 1.00 72.01 H new ATOM 0 HB2 ARG A 93 -12.148 1.669 6.393 1.00 61.43 H new ATOM 0 HB3 ARG A 93 -11.082 1.126 7.674 1.00 61.43 H new ATOM 0 HG2 ARG A 93 -14.059 0.469 7.511 1.00 54.44 H new ATOM 0 HG3 ARG A 93 -12.776 -0.587 6.953 1.00 54.44 H new ATOM 0 HD2 ARG A 93 -11.865 -0.623 9.324 1.00 55.42 H new ATOM 0 HD3 ARG A 93 -13.273 0.289 9.830 1.00 55.42 H new ATOM 0 HE ARG A 93 -14.294 -1.936 8.429 1.00 73.30 H new ATOM 0 HH11 ARG A 93 -12.348 -1.402 11.356 1.00 10.43 H new ATOM 0 HH12 ARG A 93 -12.886 -2.905 12.113 1.00 10.43 H new ATOM 0 HH21 ARG A 93 -14.967 -3.847 9.445 1.00 54.33 H new ATOM 0 HH22 ARG A 93 -14.348 -4.268 11.046 1.00 54.33 H new ATOM 1456 N ASP A 94 -10.330 3.953 8.386 1.00 20.21 N ATOM 1457 CA ASP A 94 -9.362 5.002 8.000 1.00 43.24 C ATOM 1458 C ASP A 94 -7.951 4.415 7.910 1.00 75.31 C ATOM 1459 O ASP A 94 -7.561 3.584 8.733 1.00 32.40 O ATOM 1460 CB ASP A 94 -9.400 6.210 8.982 1.00 54.31 C ATOM 1461 CG ASP A 94 -8.891 5.891 10.408 1.00 71.11 C ATOM 1462 OD1 ASP A 94 -9.657 5.300 11.205 1.00 30.53 O ATOM 1463 OD2 ASP A 94 -7.730 6.244 10.739 1.00 44.42 O ATOM 0 H ASP A 94 -9.984 3.312 9.100 1.00 20.21 H new ATOM 0 HA ASP A 94 -9.648 5.376 7.017 1.00 43.24 H new ATOM 0 HB2 ASP A 94 -8.798 7.019 8.567 1.00 54.31 H new ATOM 0 HB3 ASP A 94 -10.424 6.576 9.049 1.00 54.31 H new ATOM 1468 N LEU A 95 -7.219 4.838 6.867 1.00 11.34 N ATOM 1469 CA LEU A 95 -5.810 4.467 6.640 1.00 23.35 C ATOM 1470 C LEU A 95 -5.011 5.733 6.392 1.00 3.20 C ATOM 1471 O LEU A 95 -5.377 6.526 5.535 1.00 33.21 O ATOM 1472 CB LEU A 95 -5.669 3.519 5.425 1.00 73.21 C ATOM 1473 CG LEU A 95 -6.382 2.148 5.553 1.00 41.33 C ATOM 1474 CD1 LEU A 95 -6.161 1.304 4.290 1.00 2.33 C ATOM 1475 CD2 LEU A 95 -5.933 1.405 6.825 1.00 54.23 C ATOM 0 H LEU A 95 -7.593 5.456 6.147 1.00 11.34 H new ATOM 0 HA LEU A 95 -5.436 3.943 7.520 1.00 23.35 H new ATOM 0 HB2 LEU A 95 -6.058 4.029 4.543 1.00 73.21 H new ATOM 0 HB3 LEU A 95 -4.608 3.341 5.248 1.00 73.21 H new ATOM 0 HG LEU A 95 -7.453 2.325 5.648 1.00 41.33 H new ATOM 0 HD11 LEU A 95 -6.669 0.346 4.399 1.00 2.33 H new ATOM 0 HD12 LEU A 95 -6.563 1.831 3.425 1.00 2.33 H new ATOM 0 HD13 LEU A 95 -5.094 1.135 4.148 1.00 2.33 H new ATOM 0 HD21 LEU A 95 -6.449 0.447 6.888 1.00 54.23 H new ATOM 0 HD22 LEU A 95 -4.857 1.235 6.787 1.00 54.23 H new ATOM 0 HD23 LEU A 95 -6.174 2.006 7.702 1.00 54.23 H new ATOM 1487 N HIS A 96 -3.893 5.898 7.087 1.00 23.41 N ATOM 1488 CA HIS A 96 -3.133 7.149 7.053 1.00 41.14 C ATOM 1489 C HIS A 96 -2.126 7.096 5.897 1.00 14.25 C ATOM 1490 O HIS A 96 -1.427 6.093 5.721 1.00 20.41 O ATOM 1491 CB HIS A 96 -2.417 7.363 8.410 1.00 70.24 C ATOM 1492 CG HIS A 96 -3.343 7.418 9.620 1.00 23.42 C ATOM 1493 ND1 HIS A 96 -3.335 8.487 10.483 1.00 2.45 N ATOM 1494 CD2 HIS A 96 -4.239 6.499 10.080 1.00 65.13 C ATOM 1495 CE1 HIS A 96 -4.209 8.201 11.434 1.00 64.43 C ATOM 1496 NE2 HIS A 96 -4.784 7.007 11.231 1.00 2.11 N ATOM 0 H HIS A 96 -3.487 5.179 7.686 1.00 23.41 H new ATOM 0 HA HIS A 96 -3.805 7.991 6.890 1.00 41.14 H new ATOM 0 HB2 HIS A 96 -1.698 6.557 8.557 1.00 70.24 H new ATOM 0 HB3 HIS A 96 -1.849 8.292 8.362 1.00 70.24 H new ATOM 0 HD1 HIS A 96 -2.769 9.332 10.406 1.00 2.45 H new ATOM 0 HD2 HIS A 96 -4.475 5.549 9.623 1.00 65.13 H new ATOM 0 HE1 HIS A 96 -4.431 8.848 12.269 1.00 64.43 H new ATOM 1504 N ALA A 97 -2.067 8.181 5.111 1.00 33.43 N ATOM 1505 CA ALA A 97 -1.199 8.284 3.934 1.00 61.53 C ATOM 1506 C ALA A 97 0.031 9.113 4.286 1.00 1.43 C ATOM 1507 O ALA A 97 -0.086 10.228 4.819 1.00 71.55 O ATOM 1508 CB ALA A 97 -1.952 8.914 2.754 1.00 53.14 C ATOM 0 H ALA A 97 -2.626 9.018 5.278 1.00 33.43 H new ATOM 0 HA ALA A 97 -0.887 7.284 3.634 1.00 61.53 H new ATOM 0 HB1 ALA A 97 -1.288 8.980 1.892 1.00 53.14 H new ATOM 0 HB2 ALA A 97 -2.814 8.297 2.501 1.00 53.14 H new ATOM 0 HB3 ALA A 97 -2.289 9.913 3.029 1.00 53.14 H new ATOM 1514 N PHE A 98 1.203 8.545 4.002 1.00 41.34 N ATOM 1515 CA PHE A 98 2.496 9.173 4.287 1.00 34.21 C ATOM 1516 C PHE A 98 3.312 9.275 2.995 1.00 11.01 C ATOM 1517 O PHE A 98 2.919 8.749 1.949 1.00 62.53 O ATOM 1518 CB PHE A 98 3.301 8.330 5.317 1.00 71.23 C ATOM 1519 CG PHE A 98 2.534 7.869 6.551 1.00 4.13 C ATOM 1520 CD1 PHE A 98 1.857 6.654 6.557 1.00 40.24 C ATOM 1521 CD2 PHE A 98 2.501 8.639 7.699 1.00 20.14 C ATOM 1522 CE1 PHE A 98 1.171 6.228 7.673 1.00 15.31 C ATOM 1523 CE2 PHE A 98 1.812 8.214 8.816 1.00 41.43 C ATOM 1524 CZ PHE A 98 1.150 7.010 8.803 1.00 13.51 C ATOM 0 H PHE A 98 1.284 7.628 3.564 1.00 41.34 H new ATOM 0 HA PHE A 98 2.312 10.165 4.700 1.00 34.21 H new ATOM 0 HB2 PHE A 98 3.693 7.450 4.808 1.00 71.23 H new ATOM 0 HB3 PHE A 98 4.159 8.917 5.645 1.00 71.23 H new ATOM 0 HD1 PHE A 98 1.869 6.035 5.672 1.00 40.24 H new ATOM 0 HD2 PHE A 98 3.021 9.585 7.721 1.00 20.14 H new ATOM 0 HE1 PHE A 98 0.651 5.282 7.660 1.00 15.31 H new ATOM 0 HE2 PHE A 98 1.793 8.829 9.703 1.00 41.43 H new ATOM 0 HZ PHE A 98 0.614 6.679 9.680 1.00 13.51 H new ATOM 1534 N ARG A 99 4.456 9.947 3.108 1.00 25.11 N ATOM 1535 CA ARG A 99 5.489 10.014 2.065 1.00 60.03 C ATOM 1536 C ARG A 99 6.768 10.539 2.730 1.00 45.03 C ATOM 1537 O ARG A 99 6.677 11.412 3.607 1.00 65.45 O ATOM 1538 CB ARG A 99 5.024 10.891 0.873 1.00 12.33 C ATOM 1539 CG ARG A 99 4.647 12.349 1.229 1.00 74.40 C ATOM 1540 CD ARG A 99 3.396 12.848 0.483 1.00 55.33 C ATOM 1541 NE ARG A 99 3.520 12.773 -0.984 1.00 42.12 N ATOM 1542 CZ ARG A 99 2.727 13.415 -1.858 1.00 44.21 C ATOM 1543 NH1 ARG A 99 1.742 14.202 -1.437 1.00 72.33 N ATOM 1544 NH2 ARG A 99 2.919 13.250 -3.155 1.00 14.13 N ATOM 0 H ARG A 99 4.700 10.474 3.946 1.00 25.11 H new ATOM 0 HA ARG A 99 5.682 9.030 1.637 1.00 60.03 H new ATOM 0 HB2 ARG A 99 5.818 10.911 0.127 1.00 12.33 H new ATOM 0 HB3 ARG A 99 4.162 10.414 0.408 1.00 12.33 H new ATOM 0 HG2 ARG A 99 4.476 12.422 2.303 1.00 74.40 H new ATOM 0 HG3 ARG A 99 5.487 13.003 0.995 1.00 74.40 H new ATOM 0 HD2 ARG A 99 2.535 12.258 0.798 1.00 55.33 H new ATOM 0 HD3 ARG A 99 3.198 13.880 0.771 1.00 55.33 H new ATOM 0 HE ARG A 99 4.265 12.189 -1.365 1.00 42.12 H new ATOM 0 HH11 ARG A 99 1.580 14.325 -0.438 1.00 72.33 H new ATOM 0 HH12 ARG A 99 1.149 14.683 -2.113 1.00 72.33 H new ATOM 0 HH21 ARG A 99 3.665 12.639 -3.486 1.00 14.13 H new ATOM 0 HH22 ARG A 99 2.321 13.734 -3.825 1.00 14.13 H new ATOM 1558 N GLN A 100 7.934 9.983 2.330 1.00 51.52 N ATOM 1559 CA GLN A 100 9.203 10.085 3.090 1.00 21.24 C ATOM 1560 C GLN A 100 9.537 11.531 3.539 1.00 51.00 C ATOM 1561 O GLN A 100 9.349 11.870 4.717 1.00 62.14 O ATOM 1562 CB GLN A 100 10.374 9.471 2.271 1.00 52.34 C ATOM 1563 CG GLN A 100 10.209 7.966 1.950 1.00 63.41 C ATOM 1564 CD GLN A 100 11.438 7.322 1.295 1.00 21.31 C ATOM 1565 OE1 GLN A 100 11.307 6.427 0.459 1.00 41.33 O ATOM 1566 NE2 GLN A 100 12.642 7.716 1.715 1.00 70.41 N ATOM 0 H GLN A 100 8.023 9.448 1.466 1.00 51.52 H new ATOM 0 HA GLN A 100 9.066 9.511 4.007 1.00 21.24 H new ATOM 0 HB2 GLN A 100 10.474 10.021 1.335 1.00 52.34 H new ATOM 0 HB3 GLN A 100 11.302 9.612 2.825 1.00 52.34 H new ATOM 0 HG2 GLN A 100 9.982 7.432 2.873 1.00 63.41 H new ATOM 0 HG3 GLN A 100 9.351 7.839 1.289 1.00 63.41 H new ATOM 0 HE21 GLN A 100 12.722 8.460 2.408 1.00 70.41 H new ATOM 0 HE22 GLN A 100 13.482 7.273 1.343 1.00 70.41 H new ATOM 1575 N ALA A 101 9.991 12.384 2.609 1.00 34.02 N ATOM 1576 CA ALA A 101 10.272 13.795 2.913 1.00 30.02 C ATOM 1577 C ALA A 101 9.355 14.732 2.105 1.00 1.11 C ATOM 1578 O ALA A 101 8.345 15.214 2.622 1.00 71.11 O ATOM 1579 CB ALA A 101 11.764 14.101 2.678 1.00 25.31 C ATOM 0 H ALA A 101 10.171 12.121 1.640 1.00 34.02 H new ATOM 0 HA ALA A 101 10.056 13.977 3.966 1.00 30.02 H new ATOM 0 HB1 ALA A 101 11.961 15.149 2.906 1.00 25.31 H new ATOM 0 HB2 ALA A 101 12.371 13.468 3.325 1.00 25.31 H new ATOM 0 HB3 ALA A 101 12.016 13.903 1.636 1.00 25.31 H new ATOM 1585 N ALA A 102 9.674 14.930 0.813 1.00 1.43 N ATOM 1586 CA ALA A 102 9.027 15.951 -0.034 1.00 32.43 C ATOM 1587 C ALA A 102 8.541 15.361 -1.366 1.00 63.42 C ATOM 1588 O ALA A 102 8.600 16.037 -2.402 1.00 74.14 O ATOM 1589 CB ALA A 102 10.034 17.097 -0.271 1.00 41.43 C ATOM 0 H ALA A 102 10.387 14.387 0.326 1.00 1.43 H new ATOM 0 HA ALA A 102 8.143 16.332 0.477 1.00 32.43 H new ATOM 0 HB1 ALA A 102 9.574 17.862 -0.896 1.00 41.43 H new ATOM 0 HB2 ALA A 102 10.320 17.533 0.686 1.00 41.43 H new ATOM 0 HB3 ALA A 102 10.920 16.705 -0.771 1.00 41.43 H new ATOM 1595 N ASP A 103 8.035 14.112 -1.321 1.00 11.15 N ATOM 1596 CA ASP A 103 7.609 13.358 -2.523 1.00 61.23 C ATOM 1597 C ASP A 103 6.588 14.146 -3.377 1.00 51.22 C ATOM 1598 O ASP A 103 5.530 14.541 -2.885 1.00 34.45 O ATOM 1599 CB ASP A 103 7.016 11.980 -2.099 1.00 10.55 C ATOM 1600 CG ASP A 103 6.241 11.250 -3.219 1.00 74.32 C ATOM 1601 OD1 ASP A 103 6.871 10.708 -4.147 1.00 25.43 O ATOM 1602 OD2 ASP A 103 4.994 11.237 -3.184 1.00 60.43 O ATOM 0 H ASP A 103 7.909 13.595 -0.451 1.00 11.15 H new ATOM 0 HA ASP A 103 8.490 13.201 -3.145 1.00 61.23 H new ATOM 0 HB2 ASP A 103 7.828 11.338 -1.757 1.00 10.55 H new ATOM 0 HB3 ASP A 103 6.349 12.130 -1.250 1.00 10.55 H new ATOM 1607 N GLU A 104 6.945 14.370 -4.645 1.00 24.14 N ATOM 1608 CA GLU A 104 6.066 15.000 -5.654 1.00 63.44 C ATOM 1609 C GLU A 104 5.695 13.963 -6.737 1.00 54.50 C ATOM 1610 O GLU A 104 4.921 14.258 -7.652 1.00 2.23 O ATOM 1611 CB GLU A 104 6.772 16.239 -6.279 1.00 61.13 C ATOM 1612 CG GLU A 104 8.146 15.940 -6.910 1.00 44.14 C ATOM 1613 CD GLU A 104 8.865 17.192 -7.434 1.00 62.30 C ATOM 1614 OE1 GLU A 104 9.254 18.050 -6.614 1.00 61.32 O ATOM 1615 OE2 GLU A 104 9.052 17.323 -8.666 1.00 23.53 O ATOM 0 H GLU A 104 7.863 14.118 -5.012 1.00 24.14 H new ATOM 0 HA GLU A 104 5.148 15.343 -5.176 1.00 63.44 H new ATOM 0 HB2 GLU A 104 6.121 16.666 -7.042 1.00 61.13 H new ATOM 0 HB3 GLU A 104 6.898 16.998 -5.507 1.00 61.13 H new ATOM 0 HG2 GLU A 104 8.778 15.451 -6.169 1.00 44.14 H new ATOM 0 HG3 GLU A 104 8.014 15.236 -7.731 1.00 44.14 H new ATOM 1622 N SER A 105 6.242 12.734 -6.595 1.00 31.43 N ATOM 1623 CA SER A 105 6.048 11.624 -7.546 1.00 73.10 C ATOM 1624 C SER A 105 4.791 10.787 -7.186 1.00 24.43 C ATOM 1625 O SER A 105 4.644 9.641 -7.641 1.00 1.02 O ATOM 1626 CB SER A 105 7.330 10.753 -7.569 1.00 73.31 C ATOM 1627 OG SER A 105 7.350 9.863 -8.676 1.00 73.10 O ATOM 0 H SER A 105 6.838 12.486 -5.805 1.00 31.43 H new ATOM 0 HA SER A 105 5.876 12.027 -8.544 1.00 73.10 H new ATOM 0 HB2 SER A 105 8.207 11.400 -7.608 1.00 73.31 H new ATOM 0 HB3 SER A 105 7.396 10.181 -6.643 1.00 73.31 H new ATOM 0 HG SER A 105 6.471 9.439 -8.771 1.00 73.10 H new ATOM 1633 N ARG A 106 3.911 11.380 -6.334 1.00 72.44 N ATOM 1634 CA ARG A 106 2.550 10.860 -6.006 1.00 63.45 C ATOM 1635 C ARG A 106 2.594 9.562 -5.172 1.00 62.03 C ATOM 1636 O ARG A 106 1.545 8.982 -4.898 1.00 32.13 O ATOM 1637 CB ARG A 106 1.695 10.628 -7.298 1.00 34.33 C ATOM 1638 CG ARG A 106 1.578 11.835 -8.254 1.00 63.22 C ATOM 1639 CD ARG A 106 0.934 13.072 -7.619 1.00 32.35 C ATOM 1640 NE ARG A 106 0.741 14.142 -8.620 1.00 14.34 N ATOM 1641 CZ ARG A 106 1.171 15.414 -8.519 1.00 51.01 C ATOM 1642 NH1 ARG A 106 1.847 15.826 -7.448 1.00 21.53 N ATOM 1643 NH2 ARG A 106 0.900 16.274 -9.492 1.00 21.13 N ATOM 0 H ARG A 106 4.130 12.249 -5.846 1.00 72.44 H new ATOM 0 HA ARG A 106 2.076 11.631 -5.399 1.00 63.45 H new ATOM 0 HB2 ARG A 106 2.125 9.792 -7.850 1.00 34.33 H new ATOM 0 HB3 ARG A 106 0.691 10.329 -6.997 1.00 34.33 H new ATOM 0 HG2 ARG A 106 2.573 12.099 -8.612 1.00 63.22 H new ATOM 0 HG3 ARG A 106 0.993 11.540 -9.125 1.00 63.22 H new ATOM 0 HD2 ARG A 106 -0.027 12.802 -7.181 1.00 32.35 H new ATOM 0 HD3 ARG A 106 1.563 13.438 -6.807 1.00 32.35 H new ATOM 0 HE ARG A 106 0.233 13.893 -9.469 1.00 14.34 H new ATOM 0 HH11 ARG A 106 2.046 15.175 -6.689 1.00 21.53 H new ATOM 0 HH12 ARG A 106 2.166 16.793 -7.387 1.00 21.53 H new ATOM 0 HH21 ARG A 106 0.370 15.970 -10.308 1.00 21.13 H new ATOM 0 HH22 ARG A 106 1.222 17.239 -9.424 1.00 21.13 H new ATOM 1657 N THR A 107 3.795 9.158 -4.727 1.00 63.23 N ATOM 1658 CA THR A 107 4.023 7.866 -4.074 1.00 41.24 C ATOM 1659 C THR A 107 3.566 7.931 -2.597 1.00 72.03 C ATOM 1660 O THR A 107 4.327 8.321 -1.693 1.00 64.13 O ATOM 1661 CB THR A 107 5.532 7.475 -4.195 1.00 72.45 C ATOM 1662 OG1 THR A 107 5.945 7.618 -5.568 1.00 32.34 O ATOM 1663 CG2 THR A 107 5.818 6.035 -3.728 1.00 3.42 C ATOM 0 H THR A 107 4.638 9.725 -4.813 1.00 63.23 H new ATOM 0 HA THR A 107 3.434 7.094 -4.569 1.00 41.24 H new ATOM 0 HB THR A 107 6.094 8.143 -3.542 1.00 72.45 H new ATOM 0 HG1 THR A 107 6.891 7.376 -5.652 1.00 32.34 H new ATOM 0 HG21 THR A 107 6.882 5.822 -3.836 1.00 3.42 H new ATOM 0 HG22 THR A 107 5.531 5.928 -2.682 1.00 3.42 H new ATOM 0 HG23 THR A 107 5.244 5.335 -4.335 1.00 3.42 H new ATOM 1671 N LEU A 108 2.282 7.618 -2.400 1.00 4.42 N ATOM 1672 CA LEU A 108 1.624 7.614 -1.093 1.00 60.35 C ATOM 1673 C LEU A 108 1.719 6.218 -0.480 1.00 53.50 C ATOM 1674 O LEU A 108 1.213 5.249 -1.052 1.00 12.12 O ATOM 1675 CB LEU A 108 0.146 8.027 -1.269 1.00 41.31 C ATOM 1676 CG LEU A 108 -0.073 9.428 -1.906 1.00 12.31 C ATOM 1677 CD1 LEU A 108 -1.544 9.612 -2.312 1.00 33.20 C ATOM 1678 CD2 LEU A 108 0.410 10.552 -0.956 1.00 65.53 C ATOM 0 H LEU A 108 1.658 7.355 -3.163 1.00 4.42 H new ATOM 0 HA LEU A 108 2.114 8.323 -0.426 1.00 60.35 H new ATOM 0 HB2 LEU A 108 -0.353 7.281 -1.888 1.00 41.31 H new ATOM 0 HB3 LEU A 108 -0.340 8.008 -0.293 1.00 41.31 H new ATOM 0 HG LEU A 108 0.529 9.495 -2.812 1.00 12.31 H new ATOM 0 HD11 LEU A 108 -1.678 10.598 -2.756 1.00 33.20 H new ATOM 0 HD12 LEU A 108 -1.820 8.847 -3.038 1.00 33.20 H new ATOM 0 HD13 LEU A 108 -2.179 9.521 -1.431 1.00 33.20 H new ATOM 0 HD21 LEU A 108 0.245 11.522 -1.426 1.00 65.53 H new ATOM 0 HD22 LEU A 108 -0.148 10.503 -0.021 1.00 65.53 H new ATOM 0 HD23 LEU A 108 1.473 10.424 -0.752 1.00 65.53 H new ATOM 1690 N PHE A 109 2.364 6.125 0.674 1.00 22.21 N ATOM 1691 CA PHE A 109 2.587 4.857 1.361 1.00 41.21 C ATOM 1692 C PHE A 109 1.559 4.733 2.494 1.00 50.42 C ATOM 1693 O PHE A 109 1.643 5.458 3.492 1.00 64.24 O ATOM 1694 CB PHE A 109 4.038 4.827 1.892 1.00 71.03 C ATOM 1695 CG PHE A 109 4.512 3.473 2.430 1.00 65.31 C ATOM 1696 CD1 PHE A 109 4.838 2.434 1.559 1.00 61.51 C ATOM 1697 CD2 PHE A 109 4.660 3.253 3.801 1.00 35.24 C ATOM 1698 CE1 PHE A 109 5.297 1.220 2.044 1.00 54.13 C ATOM 1699 CE2 PHE A 109 5.112 2.040 4.286 1.00 4.43 C ATOM 1700 CZ PHE A 109 5.433 1.024 3.408 1.00 41.31 C ATOM 0 H PHE A 109 2.751 6.931 1.165 1.00 22.21 H new ATOM 0 HA PHE A 109 2.459 4.010 0.687 1.00 41.21 H new ATOM 0 HB2 PHE A 109 4.708 5.134 1.089 1.00 71.03 H new ATOM 0 HB3 PHE A 109 4.132 5.568 2.686 1.00 71.03 H new ATOM 0 HD1 PHE A 109 4.731 2.577 0.494 1.00 61.51 H new ATOM 0 HD2 PHE A 109 4.417 4.044 4.495 1.00 35.24 H new ATOM 0 HE1 PHE A 109 5.549 0.425 1.357 1.00 54.13 H new ATOM 0 HE2 PHE A 109 5.214 1.887 5.350 1.00 4.43 H new ATOM 0 HZ PHE A 109 5.790 0.077 3.785 1.00 41.31 H new ATOM 1710 N VAL A 110 0.551 3.863 2.296 1.00 32.44 N ATOM 1711 CA VAL A 110 -0.466 3.564 3.316 1.00 3.50 C ATOM 1712 C VAL A 110 -0.235 2.143 3.887 1.00 54.34 C ATOM 1713 O VAL A 110 -0.485 1.137 3.210 1.00 2.31 O ATOM 1714 CB VAL A 110 -1.960 3.722 2.777 1.00 1.34 C ATOM 1715 CG1 VAL A 110 -2.276 5.190 2.434 1.00 13.20 C ATOM 1716 CG2 VAL A 110 -2.268 2.813 1.559 1.00 43.31 C ATOM 0 H VAL A 110 0.421 3.349 1.425 1.00 32.44 H new ATOM 0 HA VAL A 110 -0.351 4.302 4.110 1.00 3.50 H new ATOM 0 HB VAL A 110 -2.607 3.396 3.592 1.00 1.34 H new ATOM 0 HG11 VAL A 110 -3.300 5.266 2.070 1.00 13.20 H new ATOM 0 HG12 VAL A 110 -2.162 5.805 3.327 1.00 13.20 H new ATOM 0 HG13 VAL A 110 -1.590 5.539 1.663 1.00 13.20 H new ATOM 0 HG21 VAL A 110 -3.299 2.968 1.241 1.00 43.31 H new ATOM 0 HG22 VAL A 110 -1.594 3.062 0.739 1.00 43.31 H new ATOM 0 HG23 VAL A 110 -2.128 1.769 1.839 1.00 43.31 H new ATOM 1726 N PRO A 111 0.334 2.025 5.125 1.00 42.43 N ATOM 1727 CA PRO A 111 0.263 0.770 5.885 1.00 4.41 C ATOM 1728 C PRO A 111 -1.198 0.485 6.286 1.00 63.51 C ATOM 1729 O PRO A 111 -1.970 1.423 6.542 1.00 41.31 O ATOM 1730 CB PRO A 111 1.187 1.023 7.111 1.00 14.34 C ATOM 1731 CG PRO A 111 1.256 2.510 7.252 1.00 31.12 C ATOM 1732 CD PRO A 111 1.124 3.065 5.847 1.00 72.21 C ATOM 0 HA PRO A 111 0.585 -0.108 5.325 1.00 4.41 H new ATOM 0 HB2 PRO A 111 0.782 0.561 8.011 1.00 14.34 H new ATOM 0 HB3 PRO A 111 2.177 0.596 6.952 1.00 14.34 H new ATOM 0 HG2 PRO A 111 0.457 2.879 7.895 1.00 31.12 H new ATOM 0 HG3 PRO A 111 2.198 2.816 7.707 1.00 31.12 H new ATOM 0 HD2 PRO A 111 0.614 4.028 5.844 1.00 72.21 H new ATOM 0 HD3 PRO A 111 2.099 3.219 5.385 1.00 72.21 H new ATOM 1740 N PHE A 112 -1.590 -0.791 6.257 1.00 25.43 N ATOM 1741 CA PHE A 112 -2.891 -1.228 6.768 1.00 31.12 C ATOM 1742 C PHE A 112 -2.740 -2.586 7.447 1.00 62.41 C ATOM 1743 O PHE A 112 -2.099 -3.480 6.902 1.00 62.11 O ATOM 1744 CB PHE A 112 -3.979 -1.254 5.658 1.00 44.20 C ATOM 1745 CG PHE A 112 -3.831 -2.284 4.537 1.00 34.23 C ATOM 1746 CD1 PHE A 112 -2.933 -2.088 3.493 1.00 22.43 C ATOM 1747 CD2 PHE A 112 -4.630 -3.427 4.510 1.00 71.33 C ATOM 1748 CE1 PHE A 112 -2.839 -3.003 2.461 1.00 21.22 C ATOM 1749 CE2 PHE A 112 -4.528 -4.340 3.483 1.00 65.12 C ATOM 1750 CZ PHE A 112 -3.636 -4.128 2.457 1.00 21.30 C ATOM 0 H PHE A 112 -1.018 -1.547 5.881 1.00 25.43 H new ATOM 0 HA PHE A 112 -3.234 -0.502 7.505 1.00 31.12 H new ATOM 0 HB2 PHE A 112 -4.943 -1.418 6.138 1.00 44.20 H new ATOM 0 HB3 PHE A 112 -4.015 -0.265 5.201 1.00 44.20 H new ATOM 0 HD1 PHE A 112 -2.302 -1.211 3.489 1.00 22.43 H new ATOM 0 HD2 PHE A 112 -5.339 -3.599 5.306 1.00 71.33 H new ATOM 0 HE1 PHE A 112 -2.139 -2.836 1.656 1.00 21.22 H new ATOM 0 HE2 PHE A 112 -5.149 -5.223 3.483 1.00 65.12 H new ATOM 0 HZ PHE A 112 -3.560 -4.842 1.650 1.00 21.30 H new ATOM 1760 N ARG A 113 -3.289 -2.730 8.655 1.00 13.55 N ATOM 1761 CA ARG A 113 -3.191 -3.988 9.406 1.00 52.31 C ATOM 1762 C ARG A 113 -4.571 -4.651 9.398 1.00 10.11 C ATOM 1763 O ARG A 113 -5.483 -4.184 10.082 1.00 44.35 O ATOM 1764 CB ARG A 113 -2.714 -3.721 10.861 1.00 23.43 C ATOM 1765 CG ARG A 113 -2.208 -4.985 11.593 1.00 21.43 C ATOM 1766 CD ARG A 113 -2.153 -4.828 13.120 1.00 64.12 C ATOM 1767 NE ARG A 113 -3.503 -4.841 13.711 1.00 11.20 N ATOM 1768 CZ ARG A 113 -3.795 -5.210 14.969 1.00 71.34 C ATOM 1769 NH1 ARG A 113 -2.833 -5.609 15.803 1.00 53.24 N ATOM 1770 NH2 ARG A 113 -5.052 -5.168 15.389 1.00 70.14 N ATOM 0 H ARG A 113 -3.806 -1.993 9.135 1.00 13.55 H new ATOM 0 HA ARG A 113 -2.458 -4.648 8.941 1.00 52.31 H new ATOM 0 HB2 ARG A 113 -1.915 -2.980 10.841 1.00 23.43 H new ATOM 0 HB3 ARG A 113 -3.537 -3.288 11.430 1.00 23.43 H new ATOM 0 HG2 ARG A 113 -2.859 -5.824 11.345 1.00 21.43 H new ATOM 0 HG3 ARG A 113 -1.213 -5.234 11.225 1.00 21.43 H new ATOM 0 HD2 ARG A 113 -1.559 -5.635 13.549 1.00 64.12 H new ATOM 0 HD3 ARG A 113 -1.652 -3.894 13.373 1.00 64.12 H new ATOM 0 HE ARG A 113 -4.278 -4.546 13.117 1.00 11.20 H new ATOM 0 HH11 ARG A 113 -1.863 -5.636 15.487 1.00 53.24 H new ATOM 0 HH12 ARG A 113 -3.067 -5.887 16.756 1.00 53.24 H new ATOM 0 HH21 ARG A 113 -5.790 -4.857 14.758 1.00 70.14 H new ATOM 0 HH22 ARG A 113 -5.280 -5.447 16.343 1.00 70.14 H new ATOM 1784 N ASP A 114 -4.719 -5.755 8.660 1.00 42.03 N ATOM 1785 CA ASP A 114 -6.027 -6.384 8.405 1.00 15.53 C ATOM 1786 C ASP A 114 -5.992 -7.810 9.000 1.00 23.34 C ATOM 1787 O ASP A 114 -5.091 -8.107 9.794 1.00 43.34 O ATOM 1788 CB ASP A 114 -6.320 -6.363 6.879 1.00 74.11 C ATOM 1789 CG ASP A 114 -5.476 -7.370 6.086 1.00 64.51 C ATOM 1790 OD1 ASP A 114 -4.223 -7.263 6.076 1.00 15.55 O ATOM 1791 OD2 ASP A 114 -6.065 -8.289 5.488 1.00 14.25 O ATOM 0 H ASP A 114 -3.938 -6.241 8.220 1.00 42.03 H new ATOM 0 HA ASP A 114 -6.841 -5.840 8.883 1.00 15.53 H new ATOM 0 HB2 ASP A 114 -7.376 -6.576 6.716 1.00 74.11 H new ATOM 0 HB3 ASP A 114 -6.134 -5.360 6.494 1.00 74.11 H new ATOM 1796 N LYS A 115 -6.950 -8.694 8.646 1.00 52.33 N ATOM 1797 CA LYS A 115 -7.014 -10.055 9.238 1.00 72.10 C ATOM 1798 C LYS A 115 -6.241 -11.103 8.405 1.00 23.04 C ATOM 1799 O LYS A 115 -6.213 -12.271 8.786 1.00 43.13 O ATOM 1800 CB LYS A 115 -8.480 -10.509 9.460 1.00 75.53 C ATOM 1801 CG LYS A 115 -9.357 -9.602 10.365 1.00 41.21 C ATOM 1802 CD LYS A 115 -8.828 -9.397 11.815 1.00 24.33 C ATOM 1803 CE LYS A 115 -8.027 -8.098 11.995 1.00 44.30 C ATOM 1804 NZ LYS A 115 -7.587 -7.898 13.405 1.00 12.43 N ATOM 0 H LYS A 115 -7.682 -8.497 7.963 1.00 52.33 H new ATOM 0 HA LYS A 115 -6.522 -9.988 10.209 1.00 72.10 H new ATOM 0 HB2 LYS A 115 -8.963 -10.589 8.486 1.00 75.53 H new ATOM 0 HB3 LYS A 115 -8.466 -11.510 9.892 1.00 75.53 H new ATOM 0 HG2 LYS A 115 -9.452 -8.626 9.889 1.00 41.21 H new ATOM 0 HG3 LYS A 115 -10.358 -10.030 10.418 1.00 41.21 H new ATOM 0 HD2 LYS A 115 -9.672 -9.393 12.505 1.00 24.33 H new ATOM 0 HD3 LYS A 115 -8.198 -10.244 12.087 1.00 24.33 H new ATOM 0 HE2 LYS A 115 -7.154 -8.119 11.343 1.00 44.30 H new ATOM 0 HE3 LYS A 115 -8.638 -7.251 11.683 1.00 44.30 H new ATOM 0 HZ1 LYS A 115 -8.092 -7.086 13.814 1.00 12.43 H new ATOM 0 HZ2 LYS A 115 -7.798 -8.752 13.959 1.00 12.43 H new ATOM 0 HZ3 LYS A 115 -6.563 -7.716 13.427 1.00 12.43 H new ATOM 1818 N THR A 116 -5.619 -10.711 7.273 1.00 53.23 N ATOM 1819 CA THR A 116 -4.600 -11.567 6.631 1.00 10.14 C ATOM 1820 C THR A 116 -3.269 -11.359 7.355 1.00 11.41 C ATOM 1821 O THR A 116 -2.414 -12.241 7.363 1.00 54.31 O ATOM 1822 CB THR A 116 -4.438 -11.338 5.085 1.00 42.12 C ATOM 1823 OG1 THR A 116 -3.845 -10.056 4.798 1.00 73.32 O ATOM 1824 CG2 THR A 116 -5.793 -11.486 4.365 1.00 4.42 C ATOM 0 H THR A 116 -5.799 -9.829 6.794 1.00 53.23 H new ATOM 0 HA THR A 116 -4.940 -12.599 6.722 1.00 10.14 H new ATOM 0 HB THR A 116 -3.762 -12.105 4.708 1.00 42.12 H new ATOM 0 HG1 THR A 116 -4.532 -9.359 4.848 1.00 73.32 H new ATOM 0 HG21 THR A 116 -5.657 -11.323 3.296 1.00 4.42 H new ATOM 0 HG22 THR A 116 -6.186 -12.489 4.532 1.00 4.42 H new ATOM 0 HG23 THR A 116 -6.496 -10.751 4.757 1.00 4.42 H new ATOM 1832 N THR A 117 -3.137 -10.179 7.983 1.00 15.43 N ATOM 1833 CA THR A 117 -2.067 -9.868 8.931 1.00 34.14 C ATOM 1834 C THR A 117 -2.468 -10.402 10.329 1.00 61.15 C ATOM 1835 O THR A 117 -3.647 -10.327 10.713 1.00 51.11 O ATOM 1836 CB THR A 117 -1.846 -8.324 8.994 1.00 41.45 C ATOM 1837 OG1 THR A 117 -1.483 -7.826 7.697 1.00 25.04 O ATOM 1838 CG2 THR A 117 -0.772 -7.923 10.013 1.00 12.52 C ATOM 0 H THR A 117 -3.785 -9.404 7.840 1.00 15.43 H new ATOM 0 HA THR A 117 -1.139 -10.340 8.609 1.00 34.14 H new ATOM 0 HB THR A 117 -2.788 -7.882 9.318 1.00 41.45 H new ATOM 0 HG1 THR A 117 -2.287 -7.737 7.144 1.00 25.04 H new ATOM 0 HG21 THR A 117 -0.659 -6.839 10.015 1.00 12.52 H new ATOM 0 HG22 THR A 117 -1.069 -8.259 11.006 1.00 12.52 H new ATOM 0 HG23 THR A 117 0.177 -8.386 9.743 1.00 12.52 H new ATOM 1846 N GLY A 118 -1.497 -10.959 11.076 1.00 62.13 N ATOM 1847 CA GLY A 118 -1.753 -11.508 12.416 1.00 43.12 C ATOM 1848 C GLY A 118 -2.343 -12.926 12.406 1.00 4.32 C ATOM 1849 O GLY A 118 -2.024 -13.733 13.287 1.00 10.43 O ATOM 0 H GLY A 118 -0.527 -11.040 10.771 1.00 62.13 H new ATOM 0 HA2 GLY A 118 -0.819 -11.518 12.978 1.00 43.12 H new ATOM 0 HA3 GLY A 118 -2.437 -10.844 12.945 1.00 43.12 H new ATOM 1853 N GLN A 119 -3.209 -13.237 11.415 1.00 34.43 N ATOM 1854 CA GLN A 119 -3.878 -14.546 11.312 1.00 64.41 C ATOM 1855 C GLN A 119 -3.203 -15.402 10.227 1.00 75.42 C ATOM 1856 O GLN A 119 -2.410 -16.296 10.548 1.00 73.33 O ATOM 1857 CB GLN A 119 -5.396 -14.366 11.015 1.00 74.14 C ATOM 1858 CG GLN A 119 -6.176 -13.595 12.103 1.00 51.10 C ATOM 1859 CD GLN A 119 -6.231 -14.327 13.453 1.00 44.04 C ATOM 1860 OE1 GLN A 119 -6.288 -15.555 13.510 1.00 75.03 O ATOM 1861 NE2 GLN A 119 -6.193 -13.582 14.546 1.00 14.15 N ATOM 0 H GLN A 119 -3.460 -12.588 10.669 1.00 34.43 H new ATOM 0 HA GLN A 119 -3.783 -15.063 12.267 1.00 64.41 H new ATOM 0 HB2 GLN A 119 -5.508 -13.842 10.066 1.00 74.14 H new ATOM 0 HB3 GLN A 119 -5.848 -15.350 10.891 1.00 74.14 H new ATOM 0 HG2 GLN A 119 -5.714 -12.618 12.247 1.00 51.10 H new ATOM 0 HG3 GLN A 119 -7.193 -13.418 11.753 1.00 51.10 H new ATOM 0 HE21 GLN A 119 -6.146 -12.566 14.469 1.00 14.15 H new ATOM 0 HE22 GLN A 119 -6.211 -14.024 15.465 1.00 14.15 H new ATOM 1870 N GLN A 120 -3.490 -15.084 8.938 1.00 63.43 N ATOM 1871 CA GLN A 120 -3.080 -15.943 7.802 1.00 11.23 C ATOM 1872 C GLN A 120 -1.547 -15.943 7.648 1.00 31.12 C ATOM 1873 O GLN A 120 -0.918 -17.005 7.653 1.00 64.10 O ATOM 1874 CB GLN A 120 -3.774 -15.474 6.493 1.00 14.12 C ATOM 1875 CG GLN A 120 -5.300 -15.237 6.606 1.00 55.41 C ATOM 1876 CD GLN A 120 -6.099 -16.424 7.162 1.00 74.54 C ATOM 1877 OE1 GLN A 120 -5.739 -17.590 6.988 1.00 41.44 O ATOM 1878 NE2 GLN A 120 -7.206 -16.124 7.816 1.00 24.32 N ATOM 0 H GLN A 120 -4.000 -14.245 8.663 1.00 63.43 H new ATOM 0 HA GLN A 120 -3.395 -16.966 8.006 1.00 11.23 H new ATOM 0 HB2 GLN A 120 -3.302 -14.549 6.161 1.00 14.12 H new ATOM 0 HB3 GLN A 120 -3.594 -16.219 5.718 1.00 14.12 H new ATOM 0 HG2 GLN A 120 -5.472 -14.371 7.245 1.00 55.41 H new ATOM 0 HG3 GLN A 120 -5.688 -14.987 5.619 1.00 55.41 H new ATOM 0 HE21 GLN A 120 -7.475 -15.148 7.942 1.00 24.32 H new ATOM 0 HE22 GLN A 120 -7.792 -16.868 8.195 1.00 24.32 H new ATOM 1887 N SER A 121 -0.950 -14.750 7.498 1.00 72.30 N ATOM 1888 CA SER A 121 0.421 -14.502 7.961 1.00 62.14 C ATOM 1889 C SER A 121 0.349 -14.074 9.431 1.00 52.53 C ATOM 1890 O SER A 121 -0.372 -13.125 9.752 1.00 51.02 O ATOM 1891 CB SER A 121 1.095 -13.401 7.100 1.00 20.42 C ATOM 1892 OG SER A 121 0.342 -12.191 7.097 1.00 34.52 O ATOM 0 H SER A 121 -1.396 -13.944 7.060 1.00 72.30 H new ATOM 0 HA SER A 121 1.023 -15.405 7.863 1.00 62.14 H new ATOM 0 HB2 SER A 121 2.097 -13.204 7.482 1.00 20.42 H new ATOM 0 HB3 SER A 121 1.209 -13.760 6.077 1.00 20.42 H new ATOM 0 HG SER A 121 -0.584 -12.381 7.357 1.00 34.52 H new ATOM 1898 N TYR A 122 1.075 -14.776 10.302 1.00 33.25 N ATOM 1899 CA TYR A 122 0.996 -14.580 11.762 1.00 43.30 C ATOM 1900 C TYR A 122 1.636 -13.244 12.195 1.00 52.42 C ATOM 1901 O TYR A 122 1.206 -12.638 13.184 1.00 32.25 O ATOM 1902 CB TYR A 122 1.647 -15.788 12.476 1.00 22.13 C ATOM 1903 CG TYR A 122 0.906 -17.108 12.194 1.00 70.13 C ATOM 1904 CD1 TYR A 122 -0.191 -17.485 12.967 1.00 45.32 C ATOM 1905 CD2 TYR A 122 1.278 -17.954 11.139 1.00 14.12 C ATOM 1906 CE1 TYR A 122 -0.887 -18.646 12.713 1.00 65.20 C ATOM 1907 CE2 TYR A 122 0.581 -19.128 10.881 1.00 60.20 C ATOM 1908 CZ TYR A 122 -0.504 -19.467 11.673 1.00 4.23 C ATOM 1909 OH TYR A 122 -1.217 -20.624 11.431 1.00 2.00 O ATOM 0 H TYR A 122 1.737 -15.499 10.021 1.00 33.25 H new ATOM 0 HA TYR A 122 -0.053 -14.523 12.054 1.00 43.30 H new ATOM 0 HB2 TYR A 122 2.684 -15.881 12.154 1.00 22.13 H new ATOM 0 HB3 TYR A 122 1.662 -15.606 13.551 1.00 22.13 H new ATOM 0 HD1 TYR A 122 -0.503 -16.852 13.784 1.00 45.32 H new ATOM 0 HD2 TYR A 122 2.120 -17.689 10.517 1.00 14.12 H new ATOM 0 HE1 TYR A 122 -1.733 -18.914 13.328 1.00 65.20 H new ATOM 0 HE2 TYR A 122 0.883 -19.772 10.068 1.00 60.20 H new ATOM 0 HH TYR A 122 -0.826 -21.095 10.666 1.00 2.00 H new ATOM 1919 N ASP A 123 2.668 -12.806 11.461 1.00 74.15 N ATOM 1920 CA ASP A 123 3.293 -11.482 11.681 1.00 3.12 C ATOM 1921 C ASP A 123 3.854 -10.885 10.383 1.00 44.03 C ATOM 1922 O ASP A 123 3.818 -11.526 9.321 1.00 12.15 O ATOM 1923 CB ASP A 123 4.399 -11.591 12.756 1.00 15.03 C ATOM 1924 CG ASP A 123 5.573 -12.491 12.327 1.00 4.33 C ATOM 1925 OD1 ASP A 123 5.397 -13.727 12.281 1.00 42.05 O ATOM 1926 OD2 ASP A 123 6.676 -11.972 12.049 1.00 33.34 O ATOM 0 H ASP A 123 3.093 -13.346 10.707 1.00 74.15 H new ATOM 0 HA ASP A 123 2.516 -10.803 12.034 1.00 3.12 H new ATOM 0 HB2 ASP A 123 4.777 -10.594 12.982 1.00 15.03 H new ATOM 0 HB3 ASP A 123 3.966 -11.983 13.676 1.00 15.03 H new ATOM 1931 N GLY A 124 4.400 -9.650 10.500 1.00 14.04 N ATOM 1932 CA GLY A 124 4.840 -8.875 9.347 1.00 5.20 C ATOM 1933 C GLY A 124 3.648 -8.260 8.645 1.00 64.14 C ATOM 1934 O GLY A 124 3.022 -8.917 7.805 1.00 12.22 O ATOM 0 H GLY A 124 4.541 -9.179 11.394 1.00 14.04 H new ATOM 0 HA2 GLY A 124 5.527 -8.092 9.667 1.00 5.20 H new ATOM 0 HA3 GLY A 124 5.387 -9.516 8.656 1.00 5.20 H new ATOM 1938 N GLY A 125 3.318 -7.005 9.001 1.00 11.25 N ATOM 1939 CA GLY A 125 2.069 -6.379 8.569 1.00 0.22 C ATOM 1940 C GLY A 125 1.954 -6.080 7.079 1.00 21.22 C ATOM 1941 O GLY A 125 2.843 -6.414 6.281 1.00 22.43 O ATOM 0 H GLY A 125 3.904 -6.410 9.587 1.00 11.25 H new ATOM 0 HA2 GLY A 125 1.242 -7.029 8.854 1.00 0.22 H new ATOM 0 HA3 GLY A 125 1.944 -5.445 9.118 1.00 0.22 H new ATOM 1945 N ARG A 126 0.842 -5.421 6.707 1.00 14.10 N ATOM 1946 CA ARG A 126 0.468 -5.199 5.301 1.00 61.34 C ATOM 1947 C ARG A 126 0.625 -3.706 4.999 1.00 60.14 C ATOM 1948 O ARG A 126 0.478 -2.864 5.897 1.00 51.32 O ATOM 1949 CB ARG A 126 -1.007 -5.682 5.022 1.00 12.34 C ATOM 1950 CG ARG A 126 -1.205 -6.419 3.663 1.00 61.34 C ATOM 1951 CD ARG A 126 -1.099 -7.950 3.781 1.00 12.30 C ATOM 1952 NE ARG A 126 0.076 -8.372 4.569 1.00 42.43 N ATOM 1953 CZ ARG A 126 0.174 -9.528 5.243 1.00 51.43 C ATOM 1954 NH1 ARG A 126 -0.824 -10.412 5.234 1.00 43.20 N ATOM 1955 NH2 ARG A 126 1.258 -9.781 5.959 1.00 1.52 N ATOM 0 H ARG A 126 0.178 -5.028 7.374 1.00 14.10 H new ATOM 0 HA ARG A 126 1.118 -5.781 4.648 1.00 61.34 H new ATOM 0 HB2 ARG A 126 -1.316 -6.347 5.829 1.00 12.34 H new ATOM 0 HB3 ARG A 126 -1.670 -4.817 5.051 1.00 12.34 H new ATOM 0 HG2 ARG A 126 -2.182 -6.160 3.256 1.00 61.34 H new ATOM 0 HG3 ARG A 126 -0.459 -6.064 2.952 1.00 61.34 H new ATOM 0 HD2 ARG A 126 -2.004 -8.340 4.246 1.00 12.30 H new ATOM 0 HD3 ARG A 126 -1.040 -8.386 2.784 1.00 12.30 H new ATOM 0 HE ARG A 126 0.873 -7.737 4.604 1.00 42.43 H new ATOM 0 HH11 ARG A 126 -1.676 -10.214 4.710 1.00 43.20 H new ATOM 0 HH12 ARG A 126 -0.735 -11.287 5.751 1.00 43.20 H new ATOM 0 HH21 ARG A 126 2.015 -9.098 5.997 1.00 1.52 H new ATOM 0 HH22 ARG A 126 1.336 -10.659 6.473 1.00 1.52 H new ATOM 1969 N TYR A 127 0.976 -3.391 3.754 1.00 51.21 N ATOM 1970 CA TYR A 127 1.105 -2.009 3.278 1.00 44.04 C ATOM 1971 C TYR A 127 0.852 -1.950 1.777 1.00 30.41 C ATOM 1972 O TYR A 127 0.956 -2.961 1.068 1.00 42.20 O ATOM 1973 CB TYR A 127 2.473 -1.366 3.681 1.00 10.24 C ATOM 1974 CG TYR A 127 3.692 -2.297 3.688 1.00 43.34 C ATOM 1975 CD1 TYR A 127 3.970 -3.091 4.803 1.00 72.33 C ATOM 1976 CD2 TYR A 127 4.586 -2.359 2.617 1.00 3.13 C ATOM 1977 CE1 TYR A 127 5.072 -3.903 4.848 1.00 50.34 C ATOM 1978 CE2 TYR A 127 5.700 -3.171 2.668 1.00 23.41 C ATOM 1979 CZ TYR A 127 5.934 -3.937 3.788 1.00 41.45 C ATOM 1980 OH TYR A 127 7.033 -4.744 3.849 1.00 63.12 O ATOM 0 H TYR A 127 1.181 -4.090 3.040 1.00 51.21 H new ATOM 0 HA TYR A 127 0.344 -1.405 3.773 1.00 44.04 H new ATOM 0 HB2 TYR A 127 2.677 -0.542 2.997 1.00 10.24 H new ATOM 0 HB3 TYR A 127 2.367 -0.935 4.677 1.00 10.24 H new ATOM 0 HD1 TYR A 127 3.300 -3.064 5.650 1.00 72.33 H new ATOM 0 HD2 TYR A 127 4.403 -1.762 1.736 1.00 3.13 H new ATOM 0 HE1 TYR A 127 5.259 -4.514 5.718 1.00 50.34 H new ATOM 0 HE2 TYR A 127 6.385 -3.206 1.834 1.00 23.41 H new ATOM 0 HH TYR A 127 7.499 -4.599 4.699 1.00 63.12 H new ATOM 1990 N MET A 128 0.531 -0.746 1.313 1.00 34.43 N ATOM 1991 CA MET A 128 -0.026 -0.514 -0.017 1.00 10.02 C ATOM 1992 C MET A 128 0.463 0.862 -0.495 1.00 63.23 C ATOM 1993 O MET A 128 0.777 1.729 0.329 1.00 52.33 O ATOM 1994 CB MET A 128 -1.590 -0.602 0.061 1.00 40.31 C ATOM 1995 CG MET A 128 -2.264 -1.140 -1.216 1.00 13.10 C ATOM 1996 SD MET A 128 -2.341 0.065 -2.557 1.00 42.44 S ATOM 1997 CE MET A 128 -3.626 1.158 -1.955 1.00 23.04 C ATOM 0 H MET A 128 0.652 0.108 1.857 1.00 34.43 H new ATOM 0 HA MET A 128 0.303 -1.266 -0.734 1.00 10.02 H new ATOM 0 HB2 MET A 128 -1.864 -1.243 0.899 1.00 40.31 H new ATOM 0 HB3 MET A 128 -1.987 0.390 0.276 1.00 40.31 H new ATOM 0 HG2 MET A 128 -1.720 -2.020 -1.560 1.00 13.10 H new ATOM 0 HG3 MET A 128 -3.276 -1.465 -0.973 1.00 13.10 H new ATOM 0 HE1 MET A 128 -4.111 1.649 -2.799 1.00 23.04 H new ATOM 0 HE2 MET A 128 -4.364 0.580 -1.398 1.00 23.04 H new ATOM 0 HE3 MET A 128 -3.186 1.911 -1.301 1.00 23.04 H new ATOM 2007 N GLU A 129 0.542 1.054 -1.814 1.00 33.32 N ATOM 2008 CA GLU A 129 1.137 2.264 -2.413 1.00 40.40 C ATOM 2009 C GLU A 129 0.248 2.776 -3.566 1.00 52.14 C ATOM 2010 O GLU A 129 -0.075 2.019 -4.490 1.00 53.34 O ATOM 2011 CB GLU A 129 2.561 1.912 -2.919 1.00 14.21 C ATOM 2012 CG GLU A 129 3.350 3.071 -3.553 1.00 33.42 C ATOM 2013 CD GLU A 129 4.657 2.595 -4.210 1.00 33.42 C ATOM 2014 OE1 GLU A 129 5.679 2.462 -3.503 1.00 53.45 O ATOM 2015 OE2 GLU A 129 4.659 2.314 -5.427 1.00 51.03 O ATOM 0 H GLU A 129 0.198 0.381 -2.499 1.00 33.32 H new ATOM 0 HA GLU A 129 1.205 3.059 -1.671 1.00 40.40 H new ATOM 0 HB2 GLU A 129 3.138 1.520 -2.081 1.00 14.21 H new ATOM 0 HB3 GLU A 129 2.478 1.110 -3.652 1.00 14.21 H new ATOM 0 HG2 GLU A 129 2.729 3.565 -4.300 1.00 33.42 H new ATOM 0 HG3 GLU A 129 3.579 3.813 -2.788 1.00 33.42 H new ATOM 2022 N LEU A 130 -0.133 4.066 -3.501 1.00 41.31 N ATOM 2023 CA LEU A 130 -0.986 4.724 -4.514 1.00 3.41 C ATOM 2024 C LEU A 130 -0.156 5.780 -5.242 1.00 72.33 C ATOM 2025 O LEU A 130 0.779 6.335 -4.659 1.00 63.03 O ATOM 2026 CB LEU A 130 -2.235 5.424 -3.868 1.00 61.44 C ATOM 2027 CG LEU A 130 -2.928 4.689 -2.670 1.00 41.54 C ATOM 2028 CD1 LEU A 130 -2.207 4.966 -1.334 1.00 71.33 C ATOM 2029 CD2 LEU A 130 -4.418 5.057 -2.571 1.00 64.31 C ATOM 0 H LEU A 130 0.143 4.686 -2.740 1.00 41.31 H new ATOM 0 HA LEU A 130 -1.346 3.958 -5.200 1.00 3.41 H new ATOM 0 HB2 LEU A 130 -1.929 6.413 -3.526 1.00 61.44 H new ATOM 0 HB3 LEU A 130 -2.980 5.573 -4.649 1.00 61.44 H new ATOM 0 HG LEU A 130 -2.856 3.620 -2.869 1.00 41.54 H new ATOM 0 HD11 LEU A 130 -2.718 4.439 -0.529 1.00 71.33 H new ATOM 0 HD12 LEU A 130 -1.176 4.619 -1.398 1.00 71.33 H new ATOM 0 HD13 LEU A 130 -2.217 6.037 -1.130 1.00 71.33 H new ATOM 0 HD21 LEU A 130 -4.868 4.530 -1.730 1.00 64.31 H new ATOM 0 HD22 LEU A 130 -4.518 6.132 -2.421 1.00 64.31 H new ATOM 0 HD23 LEU A 130 -4.926 4.770 -3.492 1.00 64.31 H new ATOM 2041 N GLU A 131 -0.501 6.052 -6.509 1.00 54.21 N ATOM 2042 CA GLU A 131 0.056 7.172 -7.290 1.00 14.12 C ATOM 2043 C GLU A 131 -1.088 7.837 -8.101 1.00 11.43 C ATOM 2044 O GLU A 131 -1.351 7.441 -9.243 1.00 31.43 O ATOM 2045 CB GLU A 131 1.214 6.678 -8.212 1.00 23.44 C ATOM 2046 CG GLU A 131 2.489 6.238 -7.445 1.00 1.24 C ATOM 2047 CD GLU A 131 3.413 5.337 -8.266 1.00 53.24 C ATOM 2048 OE1 GLU A 131 4.209 5.861 -9.080 1.00 33.43 O ATOM 2049 OE2 GLU A 131 3.332 4.089 -8.118 1.00 65.03 O ATOM 0 H GLU A 131 -1.181 5.496 -7.028 1.00 54.21 H new ATOM 0 HA GLU A 131 0.484 7.916 -6.619 1.00 14.12 H new ATOM 0 HB2 GLU A 131 0.856 5.841 -8.811 1.00 23.44 H new ATOM 0 HB3 GLU A 131 1.477 7.476 -8.906 1.00 23.44 H new ATOM 0 HG2 GLU A 131 3.041 7.125 -7.134 1.00 1.24 H new ATOM 0 HG3 GLU A 131 2.194 5.712 -6.537 1.00 1.24 H new ATOM 2056 N PRO A 132 -1.838 8.818 -7.475 1.00 35.43 N ATOM 2057 CA PRO A 132 -2.944 9.566 -8.148 1.00 40.13 C ATOM 2058 C PRO A 132 -2.440 10.481 -9.283 1.00 63.10 C ATOM 2059 O PRO A 132 -1.236 10.704 -9.421 1.00 41.42 O ATOM 2060 CB PRO A 132 -3.553 10.413 -6.996 1.00 2.01 C ATOM 2061 CG PRO A 132 -2.429 10.564 -6.016 1.00 61.41 C ATOM 2062 CD PRO A 132 -1.685 9.253 -6.059 1.00 33.04 C ATOM 0 HA PRO A 132 -3.655 8.894 -8.628 1.00 40.13 H new ATOM 0 HB2 PRO A 132 -3.901 11.382 -7.355 1.00 2.01 H new ATOM 0 HB3 PRO A 132 -4.410 9.913 -6.545 1.00 2.01 H new ATOM 0 HG2 PRO A 132 -1.778 11.395 -6.289 1.00 61.41 H new ATOM 0 HG3 PRO A 132 -2.806 10.770 -5.014 1.00 61.41 H new ATOM 0 HD2 PRO A 132 -0.637 9.376 -5.787 1.00 33.04 H new ATOM 0 HD3 PRO A 132 -2.110 8.526 -5.367 1.00 33.04 H new ATOM 2070 N ASP A 133 -3.386 11.012 -10.078 1.00 51.44 N ATOM 2071 CA ASP A 133 -3.078 11.972 -11.156 1.00 54.13 C ATOM 2072 C ASP A 133 -2.551 13.283 -10.545 1.00 22.30 C ATOM 2073 O ASP A 133 -1.415 13.703 -10.797 1.00 12.34 O ATOM 2074 CB ASP A 133 -4.357 12.226 -11.998 1.00 14.32 C ATOM 2075 CG ASP A 133 -4.141 13.210 -13.161 1.00 52.54 C ATOM 2076 OD1 ASP A 133 -3.750 12.771 -14.267 1.00 42.04 O ATOM 2077 OD2 ASP A 133 -4.360 14.428 -12.972 1.00 0.34 O ATOM 0 H ASP A 133 -4.378 10.791 -9.994 1.00 51.44 H new ATOM 0 HA ASP A 133 -2.307 11.564 -11.809 1.00 54.13 H new ATOM 0 HB2 ASP A 133 -4.714 11.277 -12.397 1.00 14.32 H new ATOM 0 HB3 ASP A 133 -5.141 12.612 -11.346 1.00 14.32 H new ATOM 2082 N ARG A 134 -3.398 13.881 -9.696 1.00 35.55 N ATOM 2083 CA ARG A 134 -3.084 15.105 -8.944 1.00 21.15 C ATOM 2084 C ARG A 134 -2.389 14.759 -7.621 1.00 22.12 C ATOM 2085 O ARG A 134 -2.260 13.581 -7.271 1.00 11.30 O ATOM 2086 CB ARG A 134 -4.384 15.950 -8.688 1.00 61.22 C ATOM 2087 CG ARG A 134 -5.685 15.166 -8.302 1.00 11.33 C ATOM 2088 CD ARG A 134 -5.556 14.233 -7.077 1.00 41.52 C ATOM 2089 NE ARG A 134 -6.823 13.585 -6.701 1.00 12.34 N ATOM 2090 CZ ARG A 134 -7.418 12.561 -7.340 1.00 73.23 C ATOM 2091 NH1 ARG A 134 -6.873 12.018 -8.426 1.00 50.20 N ATOM 2092 NH2 ARG A 134 -8.563 12.093 -6.884 1.00 43.21 N ATOM 0 H ARG A 134 -4.335 13.523 -9.509 1.00 35.55 H new ATOM 0 HA ARG A 134 -2.401 15.709 -9.541 1.00 21.15 H new ATOM 0 HB2 ARG A 134 -4.171 16.664 -7.892 1.00 61.22 H new ATOM 0 HB3 ARG A 134 -4.593 16.529 -9.588 1.00 61.22 H new ATOM 0 HG2 ARG A 134 -6.479 15.887 -8.107 1.00 11.33 H new ATOM 0 HG3 ARG A 134 -5.998 14.571 -9.160 1.00 11.33 H new ATOM 0 HD2 ARG A 134 -4.813 13.465 -7.291 1.00 41.52 H new ATOM 0 HD3 ARG A 134 -5.185 14.808 -6.229 1.00 41.52 H new ATOM 0 HE ARG A 134 -7.297 13.948 -5.874 1.00 12.34 H new ATOM 0 HH11 ARG A 134 -5.989 12.377 -8.787 1.00 50.20 H new ATOM 0 HH12 ARG A 134 -7.339 11.242 -8.897 1.00 50.20 H new ATOM 0 HH21 ARG A 134 -8.989 12.507 -6.055 1.00 43.21 H new ATOM 0 HH22 ARG A 134 -9.023 11.317 -7.360 1.00 43.21 H new ATOM 2106 N ASP A 135 -1.955 15.790 -6.891 1.00 24.43 N ATOM 2107 CA ASP A 135 -1.553 15.640 -5.491 1.00 73.42 C ATOM 2108 C ASP A 135 -2.793 15.864 -4.612 1.00 43.40 C ATOM 2109 O ASP A 135 -3.653 16.685 -4.961 1.00 11.32 O ATOM 2110 CB ASP A 135 -0.416 16.633 -5.119 1.00 21.15 C ATOM 2111 CG ASP A 135 0.458 16.097 -3.974 1.00 63.02 C ATOM 2112 OD1 ASP A 135 0.081 16.243 -2.786 1.00 62.40 O ATOM 2113 OD2 ASP A 135 1.506 15.471 -4.268 1.00 12.41 O ATOM 0 H ASP A 135 -1.873 16.742 -7.249 1.00 24.43 H new ATOM 0 HA ASP A 135 -1.157 14.638 -5.327 1.00 73.42 H new ATOM 0 HB2 ASP A 135 0.206 16.818 -5.995 1.00 21.15 H new ATOM 0 HB3 ASP A 135 -0.850 17.590 -4.828 1.00 21.15 H new ATOM 2118 N LEU A 136 -2.890 15.141 -3.491 1.00 5.53 N ATOM 2119 CA LEU A 136 -4.100 15.156 -2.648 1.00 5.02 C ATOM 2120 C LEU A 136 -4.127 16.395 -1.738 1.00 4.33 C ATOM 2121 O LEU A 136 -3.129 16.719 -1.084 1.00 51.21 O ATOM 2122 CB LEU A 136 -4.196 13.866 -1.800 1.00 44.43 C ATOM 2123 CG LEU A 136 -4.294 12.529 -2.596 1.00 42.34 C ATOM 2124 CD1 LEU A 136 -4.412 11.331 -1.629 1.00 21.23 C ATOM 2125 CD2 LEU A 136 -5.460 12.549 -3.617 1.00 71.11 C ATOM 0 H LEU A 136 -2.146 14.536 -3.143 1.00 5.53 H new ATOM 0 HA LEU A 136 -4.964 15.201 -3.311 1.00 5.02 H new ATOM 0 HB2 LEU A 136 -3.322 13.816 -1.151 1.00 44.43 H new ATOM 0 HB3 LEU A 136 -5.069 13.945 -1.153 1.00 44.43 H new ATOM 0 HG LEU A 136 -3.374 12.415 -3.170 1.00 42.34 H new ATOM 0 HD11 LEU A 136 -4.479 10.406 -2.202 1.00 21.23 H new ATOM 0 HD12 LEU A 136 -3.533 11.296 -0.985 1.00 21.23 H new ATOM 0 HD13 LEU A 136 -5.307 11.444 -1.017 1.00 21.23 H new ATOM 0 HD21 LEU A 136 -5.493 11.599 -4.150 1.00 71.11 H new ATOM 0 HD22 LEU A 136 -6.402 12.703 -3.091 1.00 71.11 H new ATOM 0 HD23 LEU A 136 -5.306 13.360 -4.329 1.00 71.11 H new ATOM 2137 N SER A 137 -5.281 17.070 -1.708 1.00 1.45 N ATOM 2138 CA SER A 137 -5.552 18.193 -0.804 1.00 13.22 C ATOM 2139 C SER A 137 -6.532 17.729 0.291 1.00 1.44 C ATOM 2140 O SER A 137 -7.125 16.643 0.182 1.00 74.25 O ATOM 2141 CB SER A 137 -6.143 19.378 -1.609 1.00 42.33 C ATOM 2142 OG SER A 137 -7.283 18.982 -2.358 1.00 2.04 O ATOM 0 H SER A 137 -6.065 16.848 -2.321 1.00 1.45 H new ATOM 0 HA SER A 137 -4.628 18.528 -0.332 1.00 13.22 H new ATOM 0 HB2 SER A 137 -6.417 20.182 -0.926 1.00 42.33 H new ATOM 0 HB3 SER A 137 -5.384 19.776 -2.283 1.00 42.33 H new ATOM 0 HG SER A 137 -7.633 19.752 -2.853 1.00 2.04 H new ATOM 2148 N ASP A 138 -6.687 18.532 1.353 1.00 13.30 N ATOM 2149 CA ASP A 138 -7.643 18.241 2.440 1.00 11.04 C ATOM 2150 C ASP A 138 -9.075 18.419 1.922 1.00 63.43 C ATOM 2151 O ASP A 138 -9.524 19.545 1.719 1.00 12.32 O ATOM 2152 CB ASP A 138 -7.369 19.153 3.658 1.00 43.42 C ATOM 2153 CG ASP A 138 -8.326 18.888 4.835 1.00 64.11 C ATOM 2154 OD1 ASP A 138 -8.129 17.892 5.551 1.00 63.23 O ATOM 2155 OD2 ASP A 138 -9.296 19.657 5.032 1.00 31.42 O ATOM 0 H ASP A 138 -6.160 19.395 1.486 1.00 13.30 H new ATOM 0 HA ASP A 138 -7.518 17.209 2.767 1.00 11.04 H new ATOM 0 HB2 ASP A 138 -6.342 19.005 3.992 1.00 43.42 H new ATOM 0 HB3 ASP A 138 -7.458 20.195 3.352 1.00 43.42 H new ATOM 2160 N GLY A 139 -9.758 17.299 1.670 1.00 23.02 N ATOM 2161 CA GLY A 139 -11.106 17.307 1.096 1.00 11.51 C ATOM 2162 C GLY A 139 -11.133 16.804 -0.341 1.00 32.01 C ATOM 2163 O GLY A 139 -12.178 16.849 -0.991 1.00 11.22 O ATOM 0 H GLY A 139 -9.394 16.365 1.857 1.00 23.02 H new ATOM 0 HA2 GLY A 139 -11.761 16.686 1.707 1.00 11.51 H new ATOM 0 HA3 GLY A 139 -11.505 18.321 1.130 1.00 11.51 H new ATOM 2167 N ASP A 140 -9.977 16.342 -0.847 1.00 4.02 N ATOM 2168 CA ASP A 140 -9.881 15.657 -2.156 1.00 34.51 C ATOM 2169 C ASP A 140 -10.335 14.199 -1.958 1.00 72.24 C ATOM 2170 O ASP A 140 -10.492 13.751 -0.824 1.00 34.24 O ATOM 2171 CB ASP A 140 -8.410 15.714 -2.689 1.00 71.44 C ATOM 2172 CG ASP A 140 -8.256 15.577 -4.230 1.00 21.22 C ATOM 2173 OD1 ASP A 140 -8.907 14.715 -4.851 1.00 53.23 O ATOM 2174 OD2 ASP A 140 -7.452 16.334 -4.829 1.00 4.55 O ATOM 0 H ASP A 140 -9.083 16.430 -0.365 1.00 4.02 H new ATOM 0 HA ASP A 140 -10.517 16.148 -2.893 1.00 34.51 H new ATOM 0 HB2 ASP A 140 -7.965 16.659 -2.379 1.00 71.44 H new ATOM 0 HB3 ASP A 140 -7.837 14.920 -2.211 1.00 71.44 H new ATOM 2179 N GLU A 141 -10.607 13.482 -3.038 1.00 32.11 N ATOM 2180 CA GLU A 141 -10.879 12.037 -2.989 1.00 0.22 C ATOM 2181 C GLU A 141 -9.686 11.229 -3.546 1.00 75.10 C ATOM 2182 O GLU A 141 -8.788 11.787 -4.178 1.00 73.23 O ATOM 2183 CB GLU A 141 -12.181 11.754 -3.767 1.00 0.44 C ATOM 2184 CG GLU A 141 -13.438 12.369 -3.110 1.00 75.52 C ATOM 2185 CD GLU A 141 -14.735 12.098 -3.890 1.00 42.25 C ATOM 2186 OE1 GLU A 141 -15.359 11.030 -3.681 1.00 2.03 O ATOM 2187 OE2 GLU A 141 -15.127 12.939 -4.732 1.00 32.50 O ATOM 0 H GLU A 141 -10.647 13.877 -3.977 1.00 32.11 H new ATOM 0 HA GLU A 141 -11.010 11.719 -1.954 1.00 0.22 H new ATOM 0 HB2 GLU A 141 -12.082 12.145 -4.780 1.00 0.44 H new ATOM 0 HB3 GLU A 141 -12.316 10.676 -3.853 1.00 0.44 H new ATOM 0 HG2 GLU A 141 -13.541 11.972 -2.100 1.00 75.52 H new ATOM 0 HG3 GLU A 141 -13.299 13.446 -3.016 1.00 75.52 H new ATOM 2194 N ILE A 142 -9.697 9.909 -3.288 1.00 12.31 N ATOM 2195 CA ILE A 142 -8.624 8.976 -3.712 1.00 20.14 C ATOM 2196 C ILE A 142 -9.175 7.532 -3.665 1.00 21.04 C ATOM 2197 O ILE A 142 -9.973 7.223 -2.796 1.00 41.44 O ATOM 2198 CB ILE A 142 -7.346 9.115 -2.784 1.00 11.11 C ATOM 2199 CG1 ILE A 142 -6.192 8.147 -3.219 1.00 3.43 C ATOM 2200 CG2 ILE A 142 -7.701 8.921 -1.286 1.00 55.01 C ATOM 2201 CD1 ILE A 142 -5.644 8.371 -4.625 1.00 13.01 C ATOM 0 H ILE A 142 -10.452 9.452 -2.777 1.00 12.31 H new ATOM 0 HA ILE A 142 -8.316 9.221 -4.728 1.00 20.14 H new ATOM 0 HB ILE A 142 -6.979 10.134 -2.910 1.00 11.11 H new ATOM 0 HG12 ILE A 142 -5.372 8.245 -2.508 1.00 3.43 H new ATOM 0 HG13 ILE A 142 -6.555 7.122 -3.148 1.00 3.43 H new ATOM 0 HG21 ILE A 142 -6.799 9.024 -0.682 1.00 55.01 H new ATOM 0 HG22 ILE A 142 -8.428 9.675 -0.984 1.00 55.01 H new ATOM 0 HG23 ILE A 142 -8.126 7.928 -1.138 1.00 55.01 H new ATOM 0 HD11 ILE A 142 -4.851 7.650 -4.826 1.00 13.01 H new ATOM 0 HD12 ILE A 142 -6.445 8.241 -5.353 1.00 13.01 H new ATOM 0 HD13 ILE A 142 -5.243 9.382 -4.703 1.00 13.01 H new ATOM 2213 N THR A 143 -8.767 6.656 -4.596 1.00 3.01 N ATOM 2214 CA THR A 143 -9.246 5.257 -4.622 1.00 41.34 C ATOM 2215 C THR A 143 -8.240 4.335 -3.905 1.00 72.21 C ATOM 2216 O THR A 143 -7.049 4.371 -4.204 1.00 12.20 O ATOM 2217 CB THR A 143 -9.478 4.771 -6.088 1.00 55.12 C ATOM 2218 OG1 THR A 143 -10.315 5.715 -6.787 1.00 24.13 O ATOM 2219 CG2 THR A 143 -10.139 3.386 -6.127 1.00 72.21 C ATOM 0 H THR A 143 -8.109 6.886 -5.340 1.00 3.01 H new ATOM 0 HA THR A 143 -10.200 5.215 -4.097 1.00 41.34 H new ATOM 0 HB THR A 143 -8.504 4.699 -6.572 1.00 55.12 H new ATOM 0 HG1 THR A 143 -10.457 5.408 -7.707 1.00 24.13 H new ATOM 0 HG21 THR A 143 -10.284 3.081 -7.163 1.00 72.21 H new ATOM 0 HG22 THR A 143 -9.498 2.663 -5.623 1.00 72.21 H new ATOM 0 HG23 THR A 143 -11.104 3.429 -5.623 1.00 72.21 H new ATOM 2227 N LEU A 144 -8.739 3.502 -2.965 1.00 54.51 N ATOM 2228 CA LEU A 144 -7.927 2.604 -2.120 1.00 65.01 C ATOM 2229 C LEU A 144 -8.097 1.145 -2.614 1.00 14.23 C ATOM 2230 O LEU A 144 -9.047 0.442 -2.228 1.00 34.13 O ATOM 2231 CB LEU A 144 -8.367 2.734 -0.615 1.00 21.02 C ATOM 2232 CG LEU A 144 -7.683 3.848 0.249 1.00 2.05 C ATOM 2233 CD1 LEU A 144 -6.181 3.542 0.480 1.00 64.04 C ATOM 2234 CD2 LEU A 144 -7.892 5.254 -0.359 1.00 0.01 C ATOM 0 H LEU A 144 -9.738 3.435 -2.770 1.00 54.51 H new ATOM 0 HA LEU A 144 -6.876 2.884 -2.193 1.00 65.01 H new ATOM 0 HB2 LEU A 144 -9.443 2.906 -0.594 1.00 21.02 H new ATOM 0 HB3 LEU A 144 -8.188 1.775 -0.129 1.00 21.02 H new ATOM 0 HG LEU A 144 -8.170 3.847 1.224 1.00 2.05 H new ATOM 0 HD11 LEU A 144 -5.737 4.334 1.083 1.00 64.04 H new ATOM 0 HD12 LEU A 144 -6.080 2.590 1.001 1.00 64.04 H new ATOM 0 HD13 LEU A 144 -5.669 3.487 -0.481 1.00 64.04 H new ATOM 0 HD21 LEU A 144 -7.403 5.998 0.269 1.00 0.01 H new ATOM 0 HD22 LEU A 144 -7.462 5.285 -1.360 1.00 0.01 H new ATOM 0 HD23 LEU A 144 -8.959 5.471 -0.415 1.00 0.01 H new ATOM 2246 N ASP A 145 -7.189 0.722 -3.506 1.00 72.24 N ATOM 2247 CA ASP A 145 -7.144 -0.655 -4.033 1.00 4.50 C ATOM 2248 C ASP A 145 -6.302 -1.562 -3.117 1.00 13.01 C ATOM 2249 O ASP A 145 -5.071 -1.615 -3.237 1.00 21.30 O ATOM 2250 CB ASP A 145 -6.566 -0.660 -5.475 1.00 34.31 C ATOM 2251 CG ASP A 145 -7.587 -0.245 -6.544 1.00 63.03 C ATOM 2252 OD1 ASP A 145 -7.722 0.962 -6.839 1.00 24.02 O ATOM 2253 OD2 ASP A 145 -8.265 -1.137 -7.095 1.00 14.11 O ATOM 0 H ASP A 145 -6.460 1.327 -3.886 1.00 72.24 H new ATOM 0 HA ASP A 145 -8.161 -1.046 -4.060 1.00 4.50 H new ATOM 0 HB2 ASP A 145 -5.712 0.015 -5.518 1.00 34.31 H new ATOM 0 HB3 ASP A 145 -6.195 -1.659 -5.706 1.00 34.31 H new ATOM 2258 N PHE A 146 -6.977 -2.269 -2.195 1.00 20.13 N ATOM 2259 CA PHE A 146 -6.329 -3.293 -1.329 1.00 12.43 C ATOM 2260 C PHE A 146 -6.201 -4.609 -2.106 1.00 42.54 C ATOM 2261 O PHE A 146 -5.424 -5.495 -1.751 1.00 22.22 O ATOM 2262 CB PHE A 146 -7.156 -3.534 -0.046 1.00 2.02 C ATOM 2263 CG PHE A 146 -7.673 -2.272 0.609 1.00 3.25 C ATOM 2264 CD1 PHE A 146 -6.825 -1.206 0.880 1.00 74.24 C ATOM 2265 CD2 PHE A 146 -9.016 -2.150 0.935 1.00 43.12 C ATOM 2266 CE1 PHE A 146 -7.312 -0.064 1.458 1.00 32.12 C ATOM 2267 CE2 PHE A 146 -9.501 -1.010 1.514 1.00 72.32 C ATOM 2268 CZ PHE A 146 -8.654 0.036 1.777 1.00 34.11 C ATOM 0 H PHE A 146 -7.976 -2.156 -2.023 1.00 20.13 H new ATOM 0 HA PHE A 146 -5.342 -2.930 -1.042 1.00 12.43 H new ATOM 0 HB2 PHE A 146 -8.003 -4.176 -0.289 1.00 2.02 H new ATOM 0 HB3 PHE A 146 -6.541 -4.076 0.672 1.00 2.02 H new ATOM 0 HD1 PHE A 146 -5.776 -1.278 0.634 1.00 74.24 H new ATOM 0 HD2 PHE A 146 -9.689 -2.969 0.728 1.00 43.12 H new ATOM 0 HE1 PHE A 146 -6.646 0.761 1.665 1.00 32.12 H new ATOM 0 HE2 PHE A 146 -10.549 -0.934 1.764 1.00 72.32 H new ATOM 0 HZ PHE A 146 -9.035 0.938 2.233 1.00 34.11 H new ATOM 2278 N ASN A 147 -7.022 -4.713 -3.150 1.00 71.21 N ATOM 2279 CA ASN A 147 -6.982 -5.804 -4.123 1.00 45.24 C ATOM 2280 C ASN A 147 -5.720 -5.734 -5.007 1.00 60.54 C ATOM 2281 O ASN A 147 -5.392 -6.700 -5.688 1.00 33.41 O ATOM 2282 CB ASN A 147 -8.270 -5.769 -4.977 1.00 21.34 C ATOM 2283 CG ASN A 147 -8.522 -4.411 -5.638 1.00 0.43 C ATOM 2284 OD1 ASN A 147 -8.074 -4.237 -6.869 1.00 74.12 O flip ATOM 2285 ND2 ASN A 147 -9.123 -3.527 -5.033 1.00 75.53 N flip ATOM 0 H ASN A 147 -7.750 -4.026 -3.347 1.00 71.21 H new ATOM 0 HA ASN A 147 -6.933 -6.752 -3.587 1.00 45.24 H new ATOM 0 HB2 ASN A 147 -8.206 -6.535 -5.750 1.00 21.34 H new ATOM 0 HB3 ASN A 147 -9.122 -6.022 -4.347 1.00 21.34 H new ATOM 0 HD21 ASN A 147 -9.456 -3.694 -4.083 1.00 75.53 H new ATOM 0 HD22 ASN A 147 -9.290 -2.626 -5.480 1.00 75.53 H new ATOM 2292 N LEU A 148 -5.033 -4.567 -5.006 1.00 74.10 N ATOM 2293 CA LEU A 148 -3.739 -4.385 -5.700 1.00 61.54 C ATOM 2294 C LEU A 148 -2.599 -4.236 -4.672 1.00 4.12 C ATOM 2295 O LEU A 148 -1.538 -3.688 -4.994 1.00 2.54 O ATOM 2296 CB LEU A 148 -3.807 -3.135 -6.635 1.00 35.01 C ATOM 2297 CG LEU A 148 -4.943 -3.124 -7.714 1.00 60.15 C ATOM 2298 CD1 LEU A 148 -4.786 -1.929 -8.692 1.00 34.31 C ATOM 2299 CD2 LEU A 148 -5.030 -4.468 -8.465 1.00 25.31 C ATOM 0 H LEU A 148 -5.360 -3.729 -4.525 1.00 74.10 H new ATOM 0 HA LEU A 148 -3.536 -5.265 -6.311 1.00 61.54 H new ATOM 0 HB2 LEU A 148 -3.922 -2.249 -6.011 1.00 35.01 H new ATOM 0 HB3 LEU A 148 -2.850 -3.041 -7.148 1.00 35.01 H new ATOM 0 HG LEU A 148 -5.888 -2.991 -7.188 1.00 60.15 H new ATOM 0 HD11 LEU A 148 -5.591 -1.952 -9.427 1.00 34.31 H new ATOM 0 HD12 LEU A 148 -4.831 -0.994 -8.134 1.00 34.31 H new ATOM 0 HD13 LEU A 148 -3.826 -2.001 -9.203 1.00 34.31 H new ATOM 0 HD21 LEU A 148 -5.829 -4.421 -9.204 1.00 25.31 H new ATOM 0 HD22 LEU A 148 -4.083 -4.666 -8.967 1.00 25.31 H new ATOM 0 HD23 LEU A 148 -5.239 -5.268 -7.755 1.00 25.31 H new ATOM 2311 N ALA A 149 -2.818 -4.745 -3.435 1.00 41.14 N ATOM 2312 CA ALA A 149 -1.809 -4.673 -2.358 1.00 32.40 C ATOM 2313 C ALA A 149 -0.609 -5.567 -2.683 1.00 5.24 C ATOM 2314 O ALA A 149 -0.772 -6.755 -2.959 1.00 52.33 O ATOM 2315 CB ALA A 149 -2.407 -5.049 -0.997 1.00 72.14 C ATOM 0 H ALA A 149 -3.684 -5.209 -3.162 1.00 41.14 H new ATOM 0 HA ALA A 149 -1.468 -3.639 -2.295 1.00 32.40 H new ATOM 0 HB1 ALA A 149 -1.635 -4.984 -0.230 1.00 72.14 H new ATOM 0 HB2 ALA A 149 -3.218 -4.363 -0.754 1.00 72.14 H new ATOM 0 HB3 ALA A 149 -2.793 -6.067 -1.038 1.00 72.14 H new ATOM 2321 N TYR A 150 0.586 -4.981 -2.592 1.00 1.22 N ATOM 2322 CA TYR A 150 1.830 -5.586 -3.087 1.00 43.04 C ATOM 2323 C TYR A 150 2.428 -6.504 -2.019 1.00 34.20 C ATOM 2324 O TYR A 150 2.157 -6.308 -0.827 1.00 42.12 O ATOM 2325 CB TYR A 150 2.820 -4.455 -3.473 1.00 60.11 C ATOM 2326 CG TYR A 150 2.155 -3.334 -4.301 1.00 30.53 C ATOM 2327 CD1 TYR A 150 1.843 -3.516 -5.649 1.00 10.11 C ATOM 2328 CD2 TYR A 150 1.807 -2.109 -3.717 1.00 74.55 C ATOM 2329 CE1 TYR A 150 1.218 -2.520 -6.382 1.00 55.41 C ATOM 2330 CE2 TYR A 150 1.185 -1.114 -4.449 1.00 75.32 C ATOM 2331 CZ TYR A 150 0.895 -1.321 -5.781 1.00 54.04 C ATOM 2332 OH TYR A 150 0.268 -0.330 -6.521 1.00 74.24 O ATOM 0 H TYR A 150 0.722 -4.063 -2.168 1.00 1.22 H new ATOM 0 HA TYR A 150 1.626 -6.193 -3.969 1.00 43.04 H new ATOM 0 HB2 TYR A 150 3.246 -4.026 -2.566 1.00 60.11 H new ATOM 0 HB3 TYR A 150 3.646 -4.880 -4.043 1.00 60.11 H new ATOM 0 HD1 TYR A 150 2.093 -4.450 -6.130 1.00 10.11 H new ATOM 0 HD2 TYR A 150 2.029 -1.938 -2.674 1.00 74.55 H new ATOM 0 HE1 TYR A 150 0.984 -2.682 -7.424 1.00 55.41 H new ATOM 0 HE2 TYR A 150 0.927 -0.177 -3.978 1.00 75.32 H new ATOM 0 HH TYR A 150 0.108 0.452 -5.952 1.00 74.24 H new ATOM 2342 N SER A 151 3.193 -7.530 -2.462 1.00 13.44 N ATOM 2343 CA SER A 151 3.939 -8.463 -1.587 1.00 63.32 C ATOM 2344 C SER A 151 4.693 -7.724 -0.450 1.00 42.03 C ATOM 2345 O SER A 151 5.665 -7.010 -0.739 1.00 65.02 O ATOM 2346 CB SER A 151 4.954 -9.261 -2.449 1.00 60.53 C ATOM 2347 OG SER A 151 4.330 -9.799 -3.599 1.00 52.42 O ATOM 0 H SER A 151 3.310 -7.735 -3.454 1.00 13.44 H new ATOM 0 HA SER A 151 3.219 -9.134 -1.119 1.00 63.32 H new ATOM 0 HB2 SER A 151 5.775 -8.609 -2.748 1.00 60.53 H new ATOM 0 HB3 SER A 151 5.387 -10.066 -1.855 1.00 60.53 H new ATOM 0 HG SER A 151 3.582 -10.371 -3.328 1.00 52.42 H new ATOM 2353 N PRO A 152 4.224 -7.832 0.845 1.00 24.12 N ATOM 2354 CA PRO A 152 4.866 -7.123 1.968 1.00 1.13 C ATOM 2355 C PRO A 152 6.277 -7.687 2.230 1.00 74.12 C ATOM 2356 O PRO A 152 6.444 -8.887 2.521 1.00 63.31 O ATOM 2357 CB PRO A 152 3.896 -7.371 3.158 1.00 71.15 C ATOM 2358 CG PRO A 152 3.148 -8.619 2.802 1.00 74.40 C ATOM 2359 CD PRO A 152 3.061 -8.645 1.290 1.00 11.45 C ATOM 0 HA PRO A 152 5.018 -6.059 1.784 1.00 1.13 H new ATOM 0 HB2 PRO A 152 4.443 -7.493 4.093 1.00 71.15 H new ATOM 0 HB3 PRO A 152 3.216 -6.530 3.294 1.00 71.15 H new ATOM 0 HG2 PRO A 152 3.665 -9.502 3.177 1.00 74.40 H new ATOM 0 HG3 PRO A 152 2.154 -8.617 3.249 1.00 74.40 H new ATOM 0 HD2 PRO A 152 3.116 -9.663 0.905 1.00 11.45 H new ATOM 0 HD3 PRO A 152 2.121 -8.221 0.938 1.00 11.45 H new ATOM 2367 N PHE A 153 7.281 -6.801 2.083 1.00 10.51 N ATOM 2368 CA PHE A 153 8.700 -7.122 2.248 1.00 11.10 C ATOM 2369 C PHE A 153 9.012 -7.807 3.602 1.00 12.54 C ATOM 2370 O PHE A 153 9.623 -8.881 3.631 1.00 42.35 O ATOM 2371 CB PHE A 153 9.549 -5.830 2.116 1.00 41.25 C ATOM 2372 CG PHE A 153 9.457 -5.070 0.778 1.00 3.43 C ATOM 2373 CD1 PHE A 153 10.263 -5.427 -0.306 1.00 52.45 C ATOM 2374 CD2 PHE A 153 8.601 -3.978 0.622 1.00 43.13 C ATOM 2375 CE1 PHE A 153 10.212 -4.724 -1.497 1.00 52.14 C ATOM 2376 CE2 PHE A 153 8.555 -3.272 -0.570 1.00 75.22 C ATOM 2377 CZ PHE A 153 9.362 -3.646 -1.629 1.00 74.31 C ATOM 0 H PHE A 153 7.118 -5.824 1.841 1.00 10.51 H new ATOM 0 HA PHE A 153 8.957 -7.831 1.461 1.00 11.10 H new ATOM 0 HB2 PHE A 153 9.256 -5.148 2.914 1.00 41.25 H new ATOM 0 HB3 PHE A 153 10.593 -6.091 2.287 1.00 41.25 H new ATOM 0 HD1 PHE A 153 10.937 -6.266 -0.213 1.00 52.45 H new ATOM 0 HD2 PHE A 153 7.965 -3.679 1.442 1.00 43.13 H new ATOM 0 HE1 PHE A 153 10.839 -5.020 -2.325 1.00 52.14 H new ATOM 0 HE2 PHE A 153 7.888 -2.429 -0.672 1.00 75.22 H new ATOM 0 HZ PHE A 153 9.327 -3.095 -2.557 1.00 74.31 H new ATOM 2387 N CYS A 154 8.561 -7.179 4.703 1.00 60.43 N ATOM 2388 CA CYS A 154 8.897 -7.593 6.080 1.00 30.12 C ATOM 2389 C CYS A 154 8.309 -8.965 6.445 1.00 15.14 C ATOM 2390 O CYS A 154 8.969 -9.756 7.134 1.00 33.21 O ATOM 2391 CB CYS A 154 8.416 -6.534 7.085 1.00 62.13 C ATOM 2392 SG CYS A 154 6.662 -6.131 6.955 1.00 41.15 S ATOM 0 H CYS A 154 7.949 -6.364 4.663 1.00 60.43 H new ATOM 0 HA CYS A 154 9.982 -7.683 6.128 1.00 30.12 H new ATOM 0 HB2 CYS A 154 8.622 -6.888 8.095 1.00 62.13 H new ATOM 0 HB3 CYS A 154 8.998 -5.623 6.942 1.00 62.13 H new ATOM 0 HG CYS A 154 6.225 -5.717 8.107 1.00 41.15 H new ATOM 2398 N ALA A 155 7.057 -9.217 6.009 1.00 73.15 N ATOM 2399 CA ALA A 155 6.374 -10.514 6.212 1.00 50.32 C ATOM 2400 C ALA A 155 7.205 -11.687 5.666 1.00 32.24 C ATOM 2401 O ALA A 155 7.452 -12.673 6.370 1.00 63.14 O ATOM 2402 CB ALA A 155 4.979 -10.489 5.566 1.00 20.00 C ATOM 0 H ALA A 155 6.492 -8.531 5.508 1.00 73.15 H new ATOM 0 HA ALA A 155 6.263 -10.667 7.285 1.00 50.32 H new ATOM 0 HB1 ALA A 155 4.488 -11.449 5.723 1.00 20.00 H new ATOM 0 HB2 ALA A 155 4.382 -9.698 6.020 1.00 20.00 H new ATOM 0 HB3 ALA A 155 5.077 -10.302 4.497 1.00 20.00 H new ATOM 2408 N TYR A 156 7.641 -11.550 4.410 1.00 74.31 N ATOM 2409 CA TYR A 156 8.409 -12.595 3.707 1.00 24.20 C ATOM 2410 C TYR A 156 9.918 -12.546 4.026 1.00 2.25 C ATOM 2411 O TYR A 156 10.620 -13.529 3.778 1.00 61.14 O ATOM 2412 CB TYR A 156 8.149 -12.501 2.179 1.00 53.33 C ATOM 2413 CG TYR A 156 6.735 -12.965 1.766 1.00 14.23 C ATOM 2414 CD1 TYR A 156 6.461 -14.325 1.564 1.00 52.05 C ATOM 2415 CD2 TYR A 156 5.674 -12.063 1.604 1.00 24.35 C ATOM 2416 CE1 TYR A 156 5.199 -14.760 1.213 1.00 5.02 C ATOM 2417 CE2 TYR A 156 4.404 -12.504 1.258 1.00 12.32 C ATOM 2418 CZ TYR A 156 4.173 -13.852 1.064 1.00 52.03 C ATOM 2419 OH TYR A 156 2.909 -14.298 0.726 1.00 50.01 O ATOM 0 H TYR A 156 7.474 -10.715 3.849 1.00 74.31 H new ATOM 0 HA TYR A 156 8.059 -13.561 4.070 1.00 24.20 H new ATOM 0 HB2 TYR A 156 8.293 -11.470 1.857 1.00 53.33 H new ATOM 0 HB3 TYR A 156 8.889 -13.105 1.654 1.00 53.33 H new ATOM 0 HD1 TYR A 156 7.254 -15.048 1.686 1.00 52.05 H new ATOM 0 HD2 TYR A 156 5.848 -11.007 1.751 1.00 24.35 H new ATOM 0 HE1 TYR A 156 5.015 -15.812 1.055 1.00 5.02 H new ATOM 0 HE2 TYR A 156 3.598 -11.795 1.141 1.00 12.32 H new ATOM 0 HH TYR A 156 2.299 -13.534 0.661 1.00 50.01 H new ATOM 2429 N SER A 157 10.414 -11.433 4.602 1.00 23.51 N ATOM 2430 CA SER A 157 11.858 -11.258 4.866 1.00 62.35 C ATOM 2431 C SER A 157 12.099 -10.387 6.113 1.00 71.23 C ATOM 2432 O SER A 157 11.701 -9.218 6.148 1.00 40.45 O ATOM 2433 CB SER A 157 12.537 -10.627 3.631 1.00 4.32 C ATOM 2434 OG SER A 157 13.942 -10.754 3.677 1.00 11.43 O ATOM 0 H SER A 157 9.838 -10.643 4.893 1.00 23.51 H new ATOM 0 HA SER A 157 12.294 -12.238 5.059 1.00 62.35 H new ATOM 0 HB2 SER A 157 12.159 -11.104 2.727 1.00 4.32 H new ATOM 0 HB3 SER A 157 12.270 -9.572 3.570 1.00 4.32 H new ATOM 0 HG SER A 157 14.342 -10.223 2.957 1.00 11.43 H new ATOM 2440 N ASP A 158 12.805 -10.950 7.114 1.00 21.12 N ATOM 2441 CA ASP A 158 13.062 -10.271 8.407 1.00 5.34 C ATOM 2442 C ASP A 158 14.106 -9.137 8.277 1.00 34.14 C ATOM 2443 O ASP A 158 14.191 -8.270 9.155 1.00 21.23 O ATOM 2444 CB ASP A 158 13.509 -11.300 9.484 1.00 20.54 C ATOM 2445 CG ASP A 158 14.854 -11.987 9.169 1.00 52.33 C ATOM 2446 OD1 ASP A 158 14.856 -13.042 8.497 1.00 2.23 O ATOM 2447 OD2 ASP A 158 15.919 -11.477 9.602 1.00 5.03 O ATOM 0 H ASP A 158 13.213 -11.883 7.053 1.00 21.12 H new ATOM 0 HA ASP A 158 12.124 -9.812 8.720 1.00 5.34 H new ATOM 0 HB2 ASP A 158 13.587 -10.794 10.446 1.00 20.54 H new ATOM 0 HB3 ASP A 158 12.737 -12.063 9.587 1.00 20.54 H new ATOM 2452 N THR A 159 14.886 -9.153 7.175 1.00 13.53 N ATOM 2453 CA THR A 159 15.957 -8.166 6.912 1.00 32.12 C ATOM 2454 C THR A 159 15.414 -6.722 6.797 1.00 42.11 C ATOM 2455 O THR A 159 16.159 -5.759 7.000 1.00 14.35 O ATOM 2456 CB THR A 159 16.762 -8.540 5.621 1.00 20.31 C ATOM 2457 OG1 THR A 159 17.902 -7.686 5.457 1.00 64.34 O ATOM 2458 CG2 THR A 159 15.897 -8.453 4.360 1.00 3.21 C ATOM 0 H THR A 159 14.791 -9.853 6.440 1.00 13.53 H new ATOM 0 HA THR A 159 16.626 -8.199 7.772 1.00 32.12 H new ATOM 0 HB THR A 159 17.090 -9.571 5.753 1.00 20.31 H new ATOM 0 HG1 THR A 159 18.388 -7.941 4.645 1.00 64.34 H new ATOM 0 HG21 THR A 159 16.495 -8.720 3.489 1.00 3.21 H new ATOM 0 HG22 THR A 159 15.056 -9.141 4.448 1.00 3.21 H new ATOM 0 HG23 THR A 159 15.523 -7.436 4.245 1.00 3.21 H new ATOM 2466 N PHE A 160 14.108 -6.590 6.509 1.00 52.44 N ATOM 2467 CA PHE A 160 13.429 -5.285 6.445 1.00 53.43 C ATOM 2468 C PHE A 160 12.912 -4.933 7.847 1.00 64.41 C ATOM 2469 O PHE A 160 12.494 -5.824 8.592 1.00 22.42 O ATOM 2470 CB PHE A 160 12.240 -5.330 5.451 1.00 4.32 C ATOM 2471 CG PHE A 160 12.632 -5.590 3.993 1.00 71.12 C ATOM 2472 CD1 PHE A 160 12.814 -6.890 3.519 1.00 55.44 C ATOM 2473 CD2 PHE A 160 12.812 -4.533 3.099 1.00 32.55 C ATOM 2474 CE1 PHE A 160 13.164 -7.124 2.199 1.00 4.22 C ATOM 2475 CE2 PHE A 160 13.158 -4.770 1.782 1.00 31.40 C ATOM 2476 CZ PHE A 160 13.334 -6.068 1.333 1.00 14.42 C ATOM 0 H PHE A 160 13.495 -7.382 6.315 1.00 52.44 H new ATOM 0 HA PHE A 160 14.135 -4.531 6.098 1.00 53.43 H new ATOM 0 HB2 PHE A 160 11.547 -6.108 5.771 1.00 4.32 H new ATOM 0 HB3 PHE A 160 11.703 -4.383 5.505 1.00 4.32 H new ATOM 0 HD1 PHE A 160 12.680 -7.725 4.190 1.00 55.44 H new ATOM 0 HD2 PHE A 160 12.679 -3.517 3.441 1.00 32.55 H new ATOM 0 HE1 PHE A 160 13.304 -8.136 1.849 1.00 4.22 H new ATOM 0 HE2 PHE A 160 13.291 -3.942 1.102 1.00 31.40 H new ATOM 0 HZ PHE A 160 13.605 -6.252 0.304 1.00 14.42 H new ATOM 2486 N SER A 161 12.954 -3.654 8.209 1.00 4.44 N ATOM 2487 CA SER A 161 12.358 -3.168 9.460 1.00 71.03 C ATOM 2488 C SER A 161 10.842 -3.027 9.247 1.00 24.33 C ATOM 2489 O SER A 161 10.431 -2.256 8.383 1.00 45.41 O ATOM 2490 CB SER A 161 13.004 -1.812 9.833 1.00 3.23 C ATOM 2491 OG SER A 161 12.518 -1.299 11.069 1.00 43.23 O ATOM 0 H SER A 161 13.398 -2.925 7.651 1.00 4.44 H new ATOM 0 HA SER A 161 12.536 -3.864 10.279 1.00 71.03 H new ATOM 0 HB2 SER A 161 14.086 -1.933 9.893 1.00 3.23 H new ATOM 0 HB3 SER A 161 12.808 -1.089 9.041 1.00 3.23 H new ATOM 0 HG SER A 161 12.955 -0.444 11.263 1.00 43.23 H new ATOM 2497 N CYS A 162 10.014 -3.766 10.015 1.00 0.12 N ATOM 2498 CA CYS A 162 8.552 -3.770 9.829 1.00 3.02 C ATOM 2499 C CYS A 162 7.973 -2.391 10.197 1.00 31.21 C ATOM 2500 O CYS A 162 8.265 -1.878 11.288 1.00 11.43 O ATOM 2501 CB CYS A 162 7.900 -4.883 10.690 1.00 23.32 C ATOM 2502 SG CYS A 162 6.099 -4.964 10.550 1.00 42.21 S ATOM 0 H CYS A 162 10.337 -4.369 10.772 1.00 0.12 H new ATOM 0 HA CYS A 162 8.329 -3.975 8.782 1.00 3.02 H new ATOM 0 HB2 CYS A 162 8.320 -5.846 10.399 1.00 23.32 H new ATOM 0 HB3 CYS A 162 8.166 -4.722 11.735 1.00 23.32 H new ATOM 0 HG CYS A 162 5.648 -5.924 11.302 1.00 42.21 H new ATOM 2508 N PRO A 163 7.157 -1.757 9.292 1.00 12.50 N ATOM 2509 CA PRO A 163 6.645 -0.396 9.528 1.00 14.11 C ATOM 2510 C PRO A 163 5.559 -0.405 10.616 1.00 70.10 C ATOM 2511 O PRO A 163 4.584 -1.159 10.505 1.00 75.13 O ATOM 2512 CB PRO A 163 6.086 0.011 8.138 1.00 63.30 C ATOM 2513 CG PRO A 163 5.681 -1.272 7.487 1.00 2.51 C ATOM 2514 CD PRO A 163 6.644 -2.324 8.006 1.00 13.31 C ATOM 0 HA PRO A 163 7.398 0.303 9.892 1.00 14.11 H new ATOM 0 HB2 PRO A 163 5.237 0.687 8.238 1.00 63.30 H new ATOM 0 HB3 PRO A 163 6.840 0.531 7.547 1.00 63.30 H new ATOM 0 HG2 PRO A 163 4.651 -1.528 7.736 1.00 2.51 H new ATOM 0 HG3 PRO A 163 5.736 -1.194 6.401 1.00 2.51 H new ATOM 0 HD2 PRO A 163 6.142 -3.278 8.165 1.00 13.31 H new ATOM 0 HD3 PRO A 163 7.454 -2.504 7.300 1.00 13.31 H new ATOM 2522 N LEU A 164 5.774 0.367 11.703 1.00 23.22 N ATOM 2523 CA LEU A 164 4.781 0.537 12.783 1.00 20.21 C ATOM 2524 C LEU A 164 3.520 1.239 12.228 1.00 11.41 C ATOM 2525 O LEU A 164 3.586 2.426 11.891 1.00 53.24 O ATOM 2526 CB LEU A 164 5.380 1.338 13.987 1.00 20.03 C ATOM 2527 CG LEU A 164 6.305 0.537 14.963 1.00 40.35 C ATOM 2528 CD1 LEU A 164 7.559 -0.027 14.263 1.00 70.11 C ATOM 2529 CD2 LEU A 164 6.675 1.393 16.203 1.00 34.42 C ATOM 0 H LEU A 164 6.638 0.888 11.855 1.00 23.22 H new ATOM 0 HA LEU A 164 4.503 -0.449 13.155 1.00 20.21 H new ATOM 0 HB2 LEU A 164 5.949 2.178 13.589 1.00 20.03 H new ATOM 0 HB3 LEU A 164 4.555 1.756 14.564 1.00 20.03 H new ATOM 0 HG LEU A 164 5.736 -0.326 15.307 1.00 40.35 H new ATOM 0 HD11 LEU A 164 8.165 -0.573 14.986 1.00 70.11 H new ATOM 0 HD12 LEU A 164 7.256 -0.700 13.461 1.00 70.11 H new ATOM 0 HD13 LEU A 164 8.143 0.794 13.847 1.00 70.11 H new ATOM 0 HD21 LEU A 164 7.318 0.814 16.866 1.00 34.42 H new ATOM 0 HD22 LEU A 164 7.201 2.292 15.881 1.00 34.42 H new ATOM 0 HD23 LEU A 164 5.766 1.675 16.735 1.00 34.42 H new ATOM 2541 N PRO A 165 2.362 0.516 12.085 1.00 51.32 N ATOM 2542 CA PRO A 165 1.124 1.107 11.558 1.00 20.00 C ATOM 2543 C PRO A 165 0.450 2.003 12.625 1.00 11.13 C ATOM 2544 O PRO A 165 0.350 1.587 13.791 1.00 5.30 O ATOM 2545 CB PRO A 165 0.248 -0.137 11.182 1.00 64.12 C ATOM 2546 CG PRO A 165 1.125 -1.343 11.411 1.00 54.43 C ATOM 2547 CD PRO A 165 2.141 -0.911 12.437 1.00 13.13 C ATOM 0 HA PRO A 165 1.285 1.761 10.701 1.00 20.00 H new ATOM 0 HB2 PRO A 165 -0.650 -0.184 11.799 1.00 64.12 H new ATOM 0 HB3 PRO A 165 -0.081 -0.084 10.144 1.00 64.12 H new ATOM 0 HG2 PRO A 165 0.541 -2.191 11.769 1.00 54.43 H new ATOM 0 HG3 PRO A 165 1.610 -1.657 10.487 1.00 54.43 H new ATOM 0 HD2 PRO A 165 1.766 -1.025 13.454 1.00 13.13 H new ATOM 0 HD3 PRO A 165 3.060 -1.493 12.369 1.00 13.13 H new ATOM 2555 N PRO A 166 0.004 3.251 12.256 1.00 51.13 N ATOM 2556 CA PRO A 166 -0.734 4.147 13.184 1.00 65.35 C ATOM 2557 C PRO A 166 -2.012 3.440 13.681 1.00 22.14 C ATOM 2558 O PRO A 166 -2.879 3.156 12.877 1.00 14.01 O ATOM 2559 CB PRO A 166 -1.065 5.386 12.304 1.00 33.24 C ATOM 2560 CG PRO A 166 -0.960 4.884 10.899 1.00 11.50 C ATOM 2561 CD PRO A 166 0.169 3.883 10.921 1.00 34.54 C ATOM 0 HA PRO A 166 -0.173 4.419 14.078 1.00 65.35 H new ATOM 0 HB2 PRO A 166 -2.064 5.768 12.516 1.00 33.24 H new ATOM 0 HB3 PRO A 166 -0.366 6.202 12.488 1.00 33.24 H new ATOM 0 HG2 PRO A 166 -1.892 4.420 10.576 1.00 11.50 H new ATOM 0 HG3 PRO A 166 -0.752 5.698 10.204 1.00 11.50 H new ATOM 0 HD2 PRO A 166 0.084 3.156 10.113 1.00 34.54 H new ATOM 0 HD3 PRO A 166 1.141 4.364 10.816 1.00 34.54 H new ATOM 2569 N GLU A 167 -2.107 3.187 15.003 1.00 43.23 N ATOM 2570 CA GLU A 167 -3.077 2.218 15.610 1.00 53.52 C ATOM 2571 C GLU A 167 -4.562 2.398 15.174 1.00 73.01 C ATOM 2572 O GLU A 167 -5.356 1.459 15.287 1.00 24.14 O ATOM 2573 CB GLU A 167 -2.963 2.265 17.155 1.00 45.42 C ATOM 2574 CG GLU A 167 -1.559 1.918 17.685 1.00 22.44 C ATOM 2575 CD GLU A 167 -1.464 1.923 19.220 1.00 61.14 C ATOM 2576 OE1 GLU A 167 -1.852 0.916 19.850 1.00 1.10 O ATOM 2577 OE2 GLU A 167 -1.011 2.938 19.798 1.00 41.13 O ATOM 0 H GLU A 167 -1.514 3.646 15.694 1.00 43.23 H new ATOM 0 HA GLU A 167 -2.790 1.240 15.224 1.00 53.52 H new ATOM 0 HB2 GLU A 167 -3.235 3.262 17.500 1.00 45.42 H new ATOM 0 HB3 GLU A 167 -3.685 1.571 17.585 1.00 45.42 H new ATOM 0 HG2 GLU A 167 -1.272 0.934 17.314 1.00 22.44 H new ATOM 0 HG3 GLU A 167 -0.841 2.632 17.282 1.00 22.44 H new ATOM 2584 N SER A 168 -4.909 3.586 14.664 1.00 30.54 N ATOM 2585 CA SER A 168 -6.260 3.893 14.136 1.00 54.14 C ATOM 2586 C SER A 168 -6.512 3.251 12.744 1.00 5.02 C ATOM 2587 O SER A 168 -7.628 3.322 12.227 1.00 32.21 O ATOM 2588 CB SER A 168 -6.452 5.432 14.073 1.00 23.23 C ATOM 2589 OG SER A 168 -7.788 5.784 13.737 1.00 53.54 O ATOM 0 H SER A 168 -4.262 4.372 14.602 1.00 30.54 H new ATOM 0 HA SER A 168 -6.993 3.458 14.816 1.00 54.14 H new ATOM 0 HB2 SER A 168 -6.192 5.870 15.036 1.00 23.23 H new ATOM 0 HB3 SER A 168 -5.769 5.854 13.336 1.00 23.23 H new ATOM 0 HG SER A 168 -7.822 6.089 12.806 1.00 53.54 H new ATOM 2595 N ASN A 169 -5.493 2.589 12.162 1.00 34.43 N ATOM 2596 CA ASN A 169 -5.574 1.982 10.810 1.00 13.22 C ATOM 2597 C ASN A 169 -5.730 0.450 10.907 1.00 23.21 C ATOM 2598 O ASN A 169 -5.705 -0.263 9.886 1.00 0.30 O ATOM 2599 CB ASN A 169 -4.312 2.365 9.963 1.00 0.25 C ATOM 2600 CG ASN A 169 -3.042 1.528 10.247 1.00 24.22 C ATOM 2601 OD1 ASN A 169 -2.840 0.990 11.331 1.00 75.21 O ATOM 2602 ND2 ASN A 169 -2.166 1.431 9.270 1.00 63.31 N ATOM 0 H ASN A 169 -4.588 2.457 12.613 1.00 34.43 H new ATOM 0 HA ASN A 169 -6.456 2.377 10.306 1.00 13.22 H new ATOM 0 HB2 ASN A 169 -4.562 2.268 8.906 1.00 0.25 H new ATOM 0 HB3 ASN A 169 -4.081 3.415 10.141 1.00 0.25 H new ATOM 0 HD21 ASN A 169 -1.304 0.903 9.408 1.00 63.31 H new ATOM 0 HD22 ASN A 169 -2.349 1.884 8.375 1.00 63.31 H new ATOM 2609 N TRP A 170 -5.880 -0.046 12.147 1.00 52.11 N ATOM 2610 CA TRP A 170 -6.081 -1.464 12.417 1.00 65.40 C ATOM 2611 C TRP A 170 -7.499 -1.866 11.967 1.00 22.13 C ATOM 2612 O TRP A 170 -8.469 -1.660 12.704 1.00 51.21 O ATOM 2613 CB TRP A 170 -5.859 -1.754 13.931 1.00 62.11 C ATOM 2614 CG TRP A 170 -4.425 -1.605 14.426 1.00 33.10 C ATOM 2615 CD1 TRP A 170 -3.313 -1.258 13.699 1.00 13.22 C ATOM 2616 CD2 TRP A 170 -3.958 -1.825 15.773 1.00 12.20 C ATOM 2617 NE1 TRP A 170 -2.200 -1.263 14.502 1.00 45.12 N ATOM 2618 CE2 TRP A 170 -2.568 -1.604 15.777 1.00 25.53 C ATOM 2619 CE3 TRP A 170 -4.585 -2.185 16.973 1.00 1.10 C ATOM 2620 CZ2 TRP A 170 -1.794 -1.742 16.930 1.00 74.13 C ATOM 2621 CZ3 TRP A 170 -3.814 -2.319 18.116 1.00 34.14 C ATOM 2622 CH2 TRP A 170 -2.432 -2.097 18.087 1.00 2.41 C ATOM 0 H TRP A 170 -5.864 0.533 12.986 1.00 52.11 H new ATOM 0 HA TRP A 170 -5.358 -2.058 11.858 1.00 65.40 H new ATOM 0 HB2 TRP A 170 -6.495 -1.083 14.508 1.00 62.11 H new ATOM 0 HB3 TRP A 170 -6.193 -2.770 14.141 1.00 62.11 H new ATOM 0 HD1 TRP A 170 -3.314 -1.016 12.646 1.00 13.22 H new ATOM 0 HE1 TRP A 170 -1.250 -1.047 14.198 1.00 45.12 H new ATOM 0 HE3 TRP A 170 -5.651 -2.355 17.006 1.00 1.10 H new ATOM 0 HZ2 TRP A 170 -0.727 -1.574 16.910 1.00 74.13 H new ATOM 0 HZ3 TRP A 170 -4.287 -2.600 19.045 1.00 34.14 H new ATOM 0 HH2 TRP A 170 -1.859 -2.208 18.995 1.00 2.41 H new ATOM 2633 N LEU A 171 -7.598 -2.461 10.762 1.00 54.33 N ATOM 2634 CA LEU A 171 -8.876 -2.813 10.133 1.00 31.23 C ATOM 2635 C LEU A 171 -9.291 -4.192 10.645 1.00 61.35 C ATOM 2636 O LEU A 171 -8.558 -5.173 10.439 1.00 55.21 O ATOM 2637 CB LEU A 171 -8.743 -2.862 8.576 1.00 43.34 C ATOM 2638 CG LEU A 171 -8.161 -1.599 7.872 1.00 13.02 C ATOM 2639 CD1 LEU A 171 -8.124 -1.785 6.326 1.00 50.04 C ATOM 2640 CD2 LEU A 171 -8.940 -0.329 8.285 1.00 41.43 C ATOM 0 H LEU A 171 -6.785 -2.710 10.198 1.00 54.33 H new ATOM 0 HA LEU A 171 -9.621 -2.058 10.386 1.00 31.23 H new ATOM 0 HB2 LEU A 171 -8.114 -3.714 8.317 1.00 43.34 H new ATOM 0 HB3 LEU A 171 -9.731 -3.057 8.158 1.00 43.34 H new ATOM 0 HG LEU A 171 -7.131 -1.468 8.203 1.00 13.02 H new ATOM 0 HD11 LEU A 171 -7.714 -0.888 5.861 1.00 50.04 H new ATOM 0 HD12 LEU A 171 -7.498 -2.642 6.077 1.00 50.04 H new ATOM 0 HD13 LEU A 171 -9.135 -1.955 5.956 1.00 50.04 H new ATOM 0 HD21 LEU A 171 -8.515 0.539 7.781 1.00 41.43 H new ATOM 0 HD22 LEU A 171 -9.987 -0.436 8.002 1.00 41.43 H new ATOM 0 HD23 LEU A 171 -8.868 -0.193 9.364 1.00 41.43 H new ATOM 2652 N GLU A 172 -10.444 -4.281 11.326 1.00 31.44 N ATOM 2653 CA GLU A 172 -10.968 -5.567 11.819 1.00 74.14 C ATOM 2654 C GLU A 172 -11.795 -6.237 10.697 1.00 51.22 C ATOM 2655 O GLU A 172 -13.017 -6.404 10.806 1.00 72.42 O ATOM 2656 CB GLU A 172 -11.790 -5.348 13.125 1.00 52.15 C ATOM 2657 CG GLU A 172 -11.931 -6.590 14.037 1.00 53.23 C ATOM 2658 CD GLU A 172 -10.589 -7.100 14.606 1.00 41.15 C ATOM 2659 OE1 GLU A 172 -9.711 -6.272 14.951 1.00 51.43 O ATOM 2660 OE2 GLU A 172 -10.399 -8.329 14.729 1.00 72.14 O ATOM 0 H GLU A 172 -11.032 -3.478 11.549 1.00 31.44 H new ATOM 0 HA GLU A 172 -10.149 -6.239 12.076 1.00 74.14 H new ATOM 0 HB2 GLU A 172 -11.322 -4.548 13.699 1.00 52.15 H new ATOM 0 HB3 GLU A 172 -12.788 -5.003 12.853 1.00 52.15 H new ATOM 0 HG2 GLU A 172 -12.597 -6.348 14.865 1.00 53.23 H new ATOM 0 HG3 GLU A 172 -12.404 -7.393 13.471 1.00 53.23 H new ATOM 2667 N THR A 173 -11.100 -6.531 9.585 1.00 33.15 N ATOM 2668 CA THR A 173 -11.654 -7.210 8.408 1.00 75.20 C ATOM 2669 C THR A 173 -10.500 -7.804 7.576 1.00 52.44 C ATOM 2670 O THR A 173 -9.393 -7.256 7.578 1.00 2.13 O ATOM 2671 CB THR A 173 -12.508 -6.240 7.532 1.00 2.42 C ATOM 2672 OG1 THR A 173 -13.058 -6.942 6.410 1.00 4.34 O ATOM 2673 CG2 THR A 173 -11.717 -5.016 7.033 1.00 12.31 C ATOM 0 H THR A 173 -10.113 -6.296 9.480 1.00 33.15 H new ATOM 0 HA THR A 173 -12.315 -8.007 8.749 1.00 75.20 H new ATOM 0 HB THR A 173 -13.305 -5.867 8.175 1.00 2.42 H new ATOM 0 HG1 THR A 173 -14.027 -7.031 6.523 1.00 4.34 H new ATOM 0 HG21 THR A 173 -12.368 -4.383 6.431 1.00 12.31 H new ATOM 0 HG22 THR A 173 -11.348 -4.448 7.887 1.00 12.31 H new ATOM 0 HG23 THR A 173 -10.874 -5.350 6.428 1.00 12.31 H new ATOM 2681 N ALA A 174 -10.753 -8.931 6.896 1.00 71.14 N ATOM 2682 CA ALA A 174 -9.747 -9.617 6.066 1.00 61.24 C ATOM 2683 C ALA A 174 -9.827 -9.110 4.627 1.00 72.14 C ATOM 2684 O ALA A 174 -10.912 -9.094 4.032 1.00 43.45 O ATOM 2685 CB ALA A 174 -9.964 -11.141 6.106 1.00 23.22 C ATOM 0 H ALA A 174 -11.661 -9.395 6.905 1.00 71.14 H new ATOM 0 HA ALA A 174 -8.756 -9.399 6.465 1.00 61.24 H new ATOM 0 HB1 ALA A 174 -9.212 -11.632 5.488 1.00 23.22 H new ATOM 0 HB2 ALA A 174 -9.876 -11.494 7.133 1.00 23.22 H new ATOM 0 HB3 ALA A 174 -10.958 -11.377 5.725 1.00 23.22 H new ATOM 2691 N VAL A 175 -8.678 -8.697 4.075 1.00 72.42 N ATOM 2692 CA VAL A 175 -8.566 -8.325 2.667 1.00 3.05 C ATOM 2693 C VAL A 175 -8.329 -9.607 1.861 1.00 14.22 C ATOM 2694 O VAL A 175 -7.194 -10.053 1.681 1.00 21.42 O ATOM 2695 CB VAL A 175 -7.421 -7.265 2.433 1.00 31.15 C ATOM 2696 CG1 VAL A 175 -7.248 -6.943 0.930 1.00 21.22 C ATOM 2697 CG2 VAL A 175 -7.706 -5.980 3.259 1.00 43.12 C ATOM 0 H VAL A 175 -7.804 -8.613 4.595 1.00 72.42 H new ATOM 0 HA VAL A 175 -9.486 -7.845 2.335 1.00 3.05 H new ATOM 0 HB VAL A 175 -6.480 -7.694 2.777 1.00 31.15 H new ATOM 0 HG11 VAL A 175 -6.451 -6.210 0.804 1.00 21.22 H new ATOM 0 HG12 VAL A 175 -6.991 -7.854 0.390 1.00 21.22 H new ATOM 0 HG13 VAL A 175 -8.180 -6.538 0.535 1.00 21.22 H new ATOM 0 HG21 VAL A 175 -6.910 -5.255 3.090 1.00 43.12 H new ATOM 0 HG22 VAL A 175 -8.659 -5.551 2.948 1.00 43.12 H new ATOM 0 HG23 VAL A 175 -7.750 -6.231 4.319 1.00 43.12 H new ATOM 2707 N THR A 176 -9.435 -10.237 1.458 1.00 21.24 N ATOM 2708 CA THR A 176 -9.425 -11.415 0.603 1.00 64.05 C ATOM 2709 C THR A 176 -9.855 -11.007 -0.812 1.00 1.10 C ATOM 2710 O THR A 176 -11.036 -10.749 -1.068 1.00 63.52 O ATOM 2711 CB THR A 176 -10.364 -12.517 1.198 1.00 31.02 C ATOM 2712 OG1 THR A 176 -11.653 -11.954 1.511 1.00 31.22 O ATOM 2713 CG2 THR A 176 -9.760 -13.146 2.471 1.00 53.50 C ATOM 0 H THR A 176 -10.373 -9.935 1.723 1.00 21.24 H new ATOM 0 HA THR A 176 -8.421 -11.835 0.552 1.00 64.05 H new ATOM 0 HB THR A 176 -10.474 -13.298 0.446 1.00 31.02 H new ATOM 0 HG1 THR A 176 -11.938 -11.364 0.782 1.00 31.22 H new ATOM 0 HG21 THR A 176 -10.438 -13.907 2.858 1.00 53.50 H new ATOM 0 HG22 THR A 176 -8.800 -13.603 2.231 1.00 53.50 H new ATOM 0 HG23 THR A 176 -9.615 -12.373 3.225 1.00 53.50 H new ATOM 2721 N ALA A 177 -8.866 -10.899 -1.700 1.00 14.41 N ATOM 2722 CA ALA A 177 -9.055 -10.484 -3.088 1.00 12.11 C ATOM 2723 C ALA A 177 -8.278 -11.445 -3.979 1.00 4.33 C ATOM 2724 O ALA A 177 -7.048 -11.486 -3.894 1.00 42.31 O ATOM 2725 CB ALA A 177 -8.566 -9.040 -3.254 1.00 74.44 C ATOM 0 H ALA A 177 -7.893 -11.102 -1.469 1.00 14.41 H new ATOM 0 HA ALA A 177 -10.107 -10.513 -3.370 1.00 12.11 H new ATOM 0 HB1 ALA A 177 -8.705 -8.725 -4.288 1.00 74.44 H new ATOM 0 HB2 ALA A 177 -9.136 -8.385 -2.596 1.00 74.44 H new ATOM 0 HB3 ALA A 177 -7.509 -8.982 -2.996 1.00 74.44 H new ATOM 2731 N GLY A 178 -8.994 -12.209 -4.835 1.00 34.20 N ATOM 2732 CA GLY A 178 -8.382 -13.342 -5.537 1.00 34.04 C ATOM 2733 C GLY A 178 -7.791 -14.354 -4.561 1.00 22.41 C ATOM 2734 O GLY A 178 -8.398 -14.628 -3.513 1.00 3.24 O ATOM 0 H GLY A 178 -9.980 -12.059 -5.049 1.00 34.20 H new ATOM 0 HA2 GLY A 178 -9.130 -13.831 -6.161 1.00 34.04 H new ATOM 0 HA3 GLY A 178 -7.600 -12.978 -6.203 1.00 34.04 H new ATOM 2738 N GLU A 179 -6.644 -14.956 -4.923 1.00 75.02 N ATOM 2739 CA GLU A 179 -5.827 -15.722 -3.968 1.00 61.33 C ATOM 2740 C GLU A 179 -5.369 -14.805 -2.806 1.00 23.45 C ATOM 2741 O GLU A 179 -5.177 -13.591 -2.983 1.00 53.43 O ATOM 2742 CB GLU A 179 -4.591 -16.365 -4.659 1.00 34.01 C ATOM 2743 CG GLU A 179 -3.570 -15.354 -5.232 1.00 51.25 C ATOM 2744 CD GLU A 179 -2.296 -16.003 -5.786 1.00 15.31 C ATOM 2745 OE1 GLU A 179 -2.356 -16.593 -6.889 1.00 64.54 O ATOM 2746 OE2 GLU A 179 -1.228 -15.933 -5.124 1.00 34.43 O ATOM 0 H GLU A 179 -6.263 -14.926 -5.869 1.00 75.02 H new ATOM 0 HA GLU A 179 -6.445 -16.528 -3.572 1.00 61.33 H new ATOM 0 HB2 GLU A 179 -4.082 -17.006 -3.939 1.00 34.01 H new ATOM 0 HB3 GLU A 179 -4.938 -17.008 -5.468 1.00 34.01 H new ATOM 0 HG2 GLU A 179 -4.048 -14.780 -6.026 1.00 51.25 H new ATOM 0 HG3 GLU A 179 -3.295 -14.647 -4.449 1.00 51.25 H new ATOM 2753 N ARG A 180 -5.165 -15.400 -1.631 1.00 51.40 N ATOM 2754 CA ARG A 180 -4.845 -14.652 -0.403 1.00 53.32 C ATOM 2755 C ARG A 180 -3.741 -15.362 0.383 1.00 64.32 C ATOM 2756 O ARG A 180 -3.675 -16.603 0.385 1.00 44.22 O ATOM 2757 CB ARG A 180 -6.137 -14.392 0.464 1.00 72.32 C ATOM 2758 CG ARG A 180 -7.278 -15.454 0.380 1.00 40.42 C ATOM 2759 CD ARG A 180 -6.880 -16.868 0.857 1.00 43.51 C ATOM 2760 NE ARG A 180 -6.367 -16.885 2.243 1.00 15.50 N ATOM 2761 CZ ARG A 180 -6.252 -17.980 3.021 1.00 75.52 C ATOM 2762 NH1 ARG A 180 -6.610 -19.183 2.588 1.00 34.32 N ATOM 2763 NH2 ARG A 180 -5.731 -17.872 4.232 1.00 62.30 N ATOM 0 H ARG A 180 -5.215 -16.410 -1.498 1.00 51.40 H new ATOM 0 HA ARG A 180 -4.462 -13.670 -0.682 1.00 53.32 H new ATOM 0 HB2 ARG A 180 -5.832 -14.305 1.507 1.00 72.32 H new ATOM 0 HB3 ARG A 180 -6.551 -13.427 0.172 1.00 72.32 H new ATOM 0 HG2 ARG A 180 -8.122 -15.108 0.977 1.00 40.42 H new ATOM 0 HG3 ARG A 180 -7.622 -15.517 -0.652 1.00 40.42 H new ATOM 0 HD2 ARG A 180 -7.746 -17.526 0.788 1.00 43.51 H new ATOM 0 HD3 ARG A 180 -6.119 -17.271 0.188 1.00 43.51 H new ATOM 0 HE ARG A 180 -6.076 -15.994 2.644 1.00 15.50 H new ATOM 0 HH11 ARG A 180 -6.983 -19.296 1.645 1.00 34.32 H new ATOM 0 HH12 ARG A 180 -6.512 -19.995 3.198 1.00 34.32 H new ATOM 0 HH21 ARG A 180 -5.418 -16.963 4.573 1.00 62.30 H new ATOM 0 HH22 ARG A 180 -5.642 -18.698 4.824 1.00 62.30 H new