USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 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 101 GLN : amide:sc= -1! C(o=0.033!,f=-4.7!) USER MOD Set 1.2: A 168 NDP O3B : rot -126:sc= 1.04 USER MOD Set 2.1: A 143 THR OG1 : rot 180:sc= -0.334 USER MOD Set 2.2: A 154 THR OG1 : rot 180:sc= -1.22 USER MOD Set 3.1: A 153 HIS : no HE2:sc= -1.74! C(o=-0.52!,f=-13!) USER MOD Set 3.2: A 155 TYR OH : rot 135:sc= 1.21 USER MOD Set 4.1: A 137 THR OG1 : rot -90:sc= 0.0121 USER MOD Set 4.2: A 161 LYS NZ :NH3+ 173:sc= 0.0168 (180deg=0) USER MOD Set 5.1: A 85 TYR OH : rot -104:sc= 1.21 USER MOD Set 5.2: A 89 HIS : no HE2:sc= -0.523 K(o=0.69,f=-4.3!) USER MOD Set 6.1: A 63 THR OG1 : rot 48:sc= 0.16 USER MOD Set 6.2: A 65 GLN :FLIP amide:sc= -1.7 F(o=-3,f=-1.5) USER MOD Set 7.1: A 34 THR OG1 : rot -73:sc= 0.992 USER MOD Set 7.2: A 39 MET CE :methyl -170:sc= -2.9 (180deg=-3.78) USER MOD Set 7.3: A 59 ASN : amide:sc= -0.559 K(o=-2.5,f=-4.1) USER MOD Set 8.1: A 58 THR OG1 : rot 100:sc= -0.948 USER MOD Set 8.2: A 92 GLN :FLIP amide:sc= 0.227 F(o=-2.5,f=-0.72) USER MOD Single : A 1 THR N :NH3+ 149:sc= 0.262 (180deg=-0.0194) USER MOD Single : A 1 THR OG1 : rot 130:sc= -0.116 USER MOD Single : A 7 GLN : amide:sc= -3.39 K(o=-3.4,f=-6.6!) USER MOD Single : A 15 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.015) USER MOD Single : A 18 HIS : no HE2:sc= -0.743 K(o=-0.74,f=-2.8!) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0654 X(o=-0.065,f=-0.11) USER MOD Single : A 29 TYR OH : rot 180:sc= -0.894 USER MOD Single : A 33 GLN : amide:sc= -2.84 K(o=-2.8,f=-9.8!) USER MOD Single : A 37 LYS NZ :NH3+ 162:sc= 0.503 (180deg=0.377) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0376 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS :FLIP no HD1:sc= -0.511 F(o=-2.1,f=-0.51) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.0193 X(o=-0.019,f=-0.019) USER MOD Single : A 71 GLN : amide:sc= -0.0223 X(o=-0.022,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -5.07 K(o=-5.1,f=-10!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc=0.000978 USER MOD Single : A 107 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0788) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0229 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 42:sc= 0.682! USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -136:sc= -1.12 (180deg=-3.52) USER MOD Single : A 132 ASN : amide:sc= -0.255 X(o=-0.26,f=0) USER MOD Single : A 138 LYS NZ :NH3+ 151:sc= -1.53! (180deg=-3.11!) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot -70:sc= -4.09 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0113 USER MOD Single : A 148 ASN : amide:sc= -0.5 K(o=-0.5,f=-4.7!) USER MOD Single : A 152 THR OG1 : rot 93:sc= 0.909 USER MOD Single : A 159 GLN : amide:sc= -0.0208 K(o=-0.021,f=-1.1) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -89:sc= 1.29 USER MOD Single : A 168 NDP O3D : rot 93:sc= 0.0902 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.813 9.698 3.790 1.00 0.00 N ATOM 2 CA THR A 1 -5.288 9.090 2.533 1.00 0.00 C ATOM 3 C THR A 1 -3.771 8.959 2.620 1.00 0.00 C ATOM 4 O THR A 1 -3.054 9.939 2.678 1.00 0.00 O ATOM 5 CB THR A 1 -5.655 9.973 1.342 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.904 10.604 1.589 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.755 9.110 0.086 1.00 0.00 C ATOM 0 H1 THR A 1 -6.666 10.254 3.577 1.00 0.00 H new ATOM 0 H2 THR A 1 -6.051 8.945 4.467 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.089 10.320 4.204 1.00 0.00 H new ATOM 0 HA THR A 1 -5.730 8.102 2.401 1.00 0.00 H new ATOM 0 HB THR A 1 -4.888 10.734 1.199 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.823 11.566 1.421 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.017 9.737 -0.766 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.796 8.626 -0.100 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.523 8.350 0.227 1.00 0.00 H new ATOM 17 N ALA A 2 -3.276 7.753 2.626 1.00 0.00 N ATOM 18 CA ALA A 2 -1.805 7.554 2.711 1.00 0.00 C ATOM 19 C ALA A 2 -1.370 6.445 1.755 1.00 0.00 C ATOM 20 O ALA A 2 -2.161 5.624 1.337 1.00 0.00 O ATOM 21 CB ALA A 2 -1.435 7.159 4.140 1.00 0.00 C ATOM 0 H ALA A 2 -3.828 6.897 2.576 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.301 8.481 2.436 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.357 7.011 4.209 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.738 7.950 4.826 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.946 6.233 4.405 1.00 0.00 H new ATOM 27 N PHE A 3 -0.108 6.403 1.432 1.00 0.00 N ATOM 28 CA PHE A 3 0.401 5.334 0.532 1.00 0.00 C ATOM 29 C PHE A 3 1.243 4.372 1.368 1.00 0.00 C ATOM 30 O PHE A 3 2.081 4.786 2.141 1.00 0.00 O ATOM 31 CB PHE A 3 1.271 5.944 -0.577 1.00 0.00 C ATOM 32 CG PHE A 3 0.415 6.613 -1.638 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.925 6.244 -1.820 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.976 7.604 -2.450 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.697 6.863 -2.808 1.00 0.00 C ATOM 36 CE2 PHE A 3 0.203 8.224 -3.437 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.133 7.853 -3.616 1.00 0.00 C ATOM 0 H PHE A 3 0.596 7.067 1.755 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.435 4.810 0.068 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.957 6.673 -0.146 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.881 5.165 -1.035 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.362 5.479 -1.195 1.00 0.00 H new ATOM 0 HD2 PHE A 3 2.008 7.891 -2.315 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.729 6.576 -2.946 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.639 8.990 -4.061 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.729 8.332 -4.379 1.00 0.00 H new ATOM 47 N LEU A 4 1.027 3.094 1.228 1.00 0.00 N ATOM 48 CA LEU A 4 1.819 2.115 2.024 1.00 0.00 C ATOM 49 C LEU A 4 2.283 0.995 1.099 1.00 0.00 C ATOM 50 O LEU A 4 1.547 0.074 0.811 1.00 0.00 O ATOM 51 CB LEU A 4 0.943 1.538 3.145 1.00 0.00 C ATOM 52 CG LEU A 4 1.661 0.365 3.826 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.983 0.845 4.427 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.771 -0.198 4.937 1.00 0.00 C ATOM 0 H LEU A 4 0.337 2.685 0.598 1.00 0.00 H new ATOM 0 HA LEU A 4 2.684 2.606 2.469 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.720 2.313 3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.010 1.203 2.736 1.00 0.00 H new ATOM 0 HG LEU A 4 1.863 -0.411 3.088 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.489 0.008 4.909 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.618 1.246 3.637 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.786 1.624 5.164 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.279 -1.032 5.423 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.569 0.582 5.672 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.169 -0.545 4.509 1.00 0.00 H new ATOM 66 N TRP A 5 3.494 1.069 0.625 1.00 0.00 N ATOM 67 CA TRP A 5 3.995 0.008 -0.284 1.00 0.00 C ATOM 68 C TRP A 5 5.434 -0.350 0.080 1.00 0.00 C ATOM 69 O TRP A 5 6.024 0.225 0.975 1.00 0.00 O ATOM 70 CB TRP A 5 3.917 0.497 -1.739 1.00 0.00 C ATOM 71 CG TRP A 5 4.880 1.623 -1.979 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.983 1.540 -2.759 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.845 2.992 -1.471 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.623 2.765 -2.766 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.963 3.692 -1.987 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.964 3.690 -0.624 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.198 5.030 -1.675 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.200 5.038 -0.307 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.314 5.706 -0.831 1.00 0.00 C ATOM 0 H TRP A 5 4.156 1.818 0.828 1.00 0.00 H new ATOM 0 HA TRP A 5 3.377 -0.883 -0.177 1.00 0.00 H new ATOM 0 HB2 TRP A 5 4.140 -0.328 -2.416 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.902 0.827 -1.962 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.310 0.659 -3.290 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.480 2.960 -3.284 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.101 3.186 -0.215 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.058 5.541 -2.083 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.518 5.563 0.345 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.489 6.742 -0.583 1.00 0.00 H new ATOM 90 N ALA A 6 5.999 -1.296 -0.612 1.00 0.00 N ATOM 91 CA ALA A 6 7.400 -1.704 -0.328 1.00 0.00 C ATOM 92 C ALA A 6 8.138 -1.815 -1.657 1.00 0.00 C ATOM 93 O ALA A 6 7.676 -2.462 -2.575 1.00 0.00 O ATOM 94 CB ALA A 6 7.411 -3.059 0.382 1.00 0.00 C ATOM 0 H ALA A 6 5.546 -1.809 -1.369 1.00 0.00 H new ATOM 0 HA ALA A 6 7.884 -0.969 0.315 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.440 -3.354 0.588 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.861 -2.983 1.320 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.940 -3.807 -0.255 1.00 0.00 H new ATOM 100 N GLN A 7 9.263 -1.171 -1.782 1.00 0.00 N ATOM 101 CA GLN A 7 10.000 -1.235 -3.072 1.00 0.00 C ATOM 102 C GLN A 7 11.482 -1.495 -2.822 1.00 0.00 C ATOM 103 O GLN A 7 11.992 -1.266 -1.744 1.00 0.00 O ATOM 104 CB GLN A 7 9.828 0.084 -3.827 1.00 0.00 C ATOM 105 CG GLN A 7 10.160 1.257 -2.901 1.00 0.00 C ATOM 106 CD GLN A 7 10.420 2.516 -3.735 1.00 0.00 C ATOM 107 OE1 GLN A 7 11.230 3.343 -3.368 1.00 0.00 O ATOM 108 NE2 GLN A 7 9.763 2.699 -4.849 1.00 0.00 N ATOM 0 H GLN A 7 9.701 -0.608 -1.053 1.00 0.00 H new ATOM 0 HA GLN A 7 9.596 -2.052 -3.670 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.480 0.102 -4.700 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.805 0.175 -4.192 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.336 1.431 -2.209 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.037 1.020 -2.299 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.082 2.006 -5.159 1.00 0.00 H new ATOM 0 HE22 GLN A 7 9.931 3.535 -5.409 1.00 0.00 H new ATOM 117 N ASP A 8 12.172 -1.983 -3.817 1.00 0.00 N ATOM 118 CA ASP A 8 13.622 -2.272 -3.652 1.00 0.00 C ATOM 119 C ASP A 8 14.430 -0.999 -3.909 1.00 0.00 C ATOM 120 O ASP A 8 13.891 0.087 -3.985 1.00 0.00 O ATOM 121 CB ASP A 8 14.038 -3.360 -4.646 1.00 0.00 C ATOM 122 CG ASP A 8 13.674 -2.929 -6.070 1.00 0.00 C ATOM 123 OD1 ASP A 8 14.026 -1.822 -6.443 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.052 -3.716 -6.763 1.00 0.00 O ATOM 0 H ASP A 8 11.791 -2.194 -4.739 1.00 0.00 H new ATOM 0 HA ASP A 8 13.813 -2.618 -2.636 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.111 -3.540 -4.574 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.540 -4.298 -4.402 1.00 0.00 H new ATOM 129 N ARG A 9 15.722 -1.129 -4.032 1.00 0.00 N ATOM 130 CA ARG A 9 16.573 0.070 -4.273 1.00 0.00 C ATOM 131 C ARG A 9 16.113 0.795 -5.546 1.00 0.00 C ATOM 132 O ARG A 9 16.052 2.009 -5.583 1.00 0.00 O ATOM 133 CB ARG A 9 18.040 -0.351 -4.412 1.00 0.00 C ATOM 134 CG ARG A 9 18.185 -1.391 -5.526 1.00 0.00 C ATOM 135 CD ARG A 9 18.666 -0.710 -6.811 1.00 0.00 C ATOM 136 NE ARG A 9 19.985 -1.285 -7.216 1.00 0.00 N ATOM 137 CZ ARG A 9 21.109 -0.803 -6.739 1.00 0.00 C ATOM 138 NH1 ARG A 9 21.112 0.202 -5.899 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.243 -1.334 -7.106 1.00 0.00 N ATOM 0 H ARG A 9 16.226 -2.014 -3.976 1.00 0.00 H new ATOM 0 HA ARG A 9 16.476 0.749 -3.426 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.657 0.520 -4.634 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.399 -0.764 -3.469 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.893 -2.163 -5.225 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.230 -1.886 -5.701 1.00 0.00 H new ATOM 0 HD2 ARG A 9 17.935 -0.853 -7.607 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.759 0.365 -6.653 1.00 0.00 H new ATOM 0 HE ARG A 9 20.012 -2.064 -7.873 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.231 0.624 -5.605 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.995 0.563 -5.539 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.252 -2.118 -7.759 1.00 0.00 H new ATOM 0 HH22 ARG A 9 23.121 -0.965 -6.740 1.00 0.00 H new ATOM 153 N ASP A 10 15.796 0.071 -6.591 1.00 0.00 N ATOM 154 CA ASP A 10 15.352 0.734 -7.854 1.00 0.00 C ATOM 155 C ASP A 10 13.946 1.320 -7.678 1.00 0.00 C ATOM 156 O ASP A 10 13.626 2.354 -8.232 1.00 0.00 O ATOM 157 CB ASP A 10 15.337 -0.295 -8.988 1.00 0.00 C ATOM 158 CG ASP A 10 16.574 -0.103 -9.869 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.628 0.893 -10.571 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.445 -0.956 -9.826 1.00 0.00 O ATOM 0 H ASP A 10 15.826 -0.948 -6.623 1.00 0.00 H new ATOM 0 HA ASP A 10 16.044 1.541 -8.096 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.323 -1.304 -8.577 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.432 -0.181 -9.584 1.00 0.00 H new ATOM 165 N GLY A 11 13.111 0.683 -6.900 1.00 0.00 N ATOM 166 CA GLY A 11 11.737 1.227 -6.684 1.00 0.00 C ATOM 167 C GLY A 11 10.682 0.334 -7.353 1.00 0.00 C ATOM 168 O GLY A 11 9.724 0.821 -7.921 1.00 0.00 O ATOM 0 H GLY A 11 13.319 -0.186 -6.407 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.534 1.299 -5.615 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.674 2.237 -7.089 1.00 0.00 H new ATOM 172 N LEU A 12 10.834 -0.963 -7.281 1.00 0.00 N ATOM 173 CA LEU A 12 9.819 -1.869 -7.905 1.00 0.00 C ATOM 174 C LEU A 12 8.811 -2.293 -6.839 1.00 0.00 C ATOM 175 O LEU A 12 9.111 -2.304 -5.665 1.00 0.00 O ATOM 176 CB LEU A 12 10.512 -3.114 -8.472 1.00 0.00 C ATOM 177 CG LEU A 12 9.470 -4.087 -9.045 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.023 -3.609 -10.425 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.094 -5.478 -9.167 1.00 0.00 C ATOM 0 H LEU A 12 11.612 -1.434 -6.820 1.00 0.00 H new ATOM 0 HA LEU A 12 9.309 -1.344 -8.713 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.216 -2.824 -9.251 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.088 -3.607 -7.689 1.00 0.00 H new ATOM 0 HG LEU A 12 8.607 -4.127 -8.381 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.284 -4.301 -10.828 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.582 -2.616 -10.341 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.884 -3.568 -11.092 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.359 -6.172 -9.573 1.00 0.00 H new ATOM 0 HD22 LEU A 12 10.956 -5.433 -9.832 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.412 -5.822 -8.183 1.00 0.00 H new ATOM 191 N ILE A 13 7.621 -2.655 -7.237 1.00 0.00 N ATOM 192 CA ILE A 13 6.606 -3.098 -6.241 1.00 0.00 C ATOM 193 C ILE A 13 5.900 -4.353 -6.758 1.00 0.00 C ATOM 194 O ILE A 13 5.957 -5.405 -6.151 1.00 0.00 O ATOM 195 CB ILE A 13 5.568 -1.992 -5.992 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.313 -1.178 -7.271 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.082 -1.063 -4.893 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.810 -1.153 -7.563 1.00 0.00 C ATOM 0 H ILE A 13 7.309 -2.663 -8.208 1.00 0.00 H new ATOM 0 HA ILE A 13 7.113 -3.317 -5.301 1.00 0.00 H new ATOM 0 HB ILE A 13 4.630 -2.456 -5.687 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.689 -0.162 -7.150 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.851 -1.619 -8.110 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.351 -0.276 -4.711 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.237 -1.634 -3.977 1.00 0.00 H new ATOM 0 HG23 ILE A 13 7.026 -0.616 -5.206 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.625 -0.577 -8.469 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.449 -2.172 -7.701 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.284 -0.692 -6.727 1.00 0.00 H new ATOM 210 N GLY A 14 5.215 -4.242 -7.862 1.00 0.00 N ATOM 211 CA GLY A 14 4.476 -5.413 -8.412 1.00 0.00 C ATOM 212 C GLY A 14 5.424 -6.333 -9.178 1.00 0.00 C ATOM 213 O GLY A 14 6.247 -5.891 -9.956 1.00 0.00 O ATOM 0 H GLY A 14 5.135 -3.386 -8.410 1.00 0.00 H new ATOM 0 HA2 GLY A 14 4.001 -5.965 -7.600 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.680 -5.070 -9.073 1.00 0.00 H new ATOM 217 N LYS A 15 5.302 -7.614 -8.965 1.00 0.00 N ATOM 218 CA LYS A 15 6.173 -8.586 -9.678 1.00 0.00 C ATOM 219 C LYS A 15 5.333 -9.792 -10.102 1.00 0.00 C ATOM 220 O LYS A 15 5.364 -10.830 -9.469 1.00 0.00 O ATOM 221 CB LYS A 15 7.293 -9.050 -8.747 1.00 0.00 C ATOM 222 CG LYS A 15 8.533 -9.400 -9.574 1.00 0.00 C ATOM 223 CD LYS A 15 8.684 -10.921 -9.655 1.00 0.00 C ATOM 224 CE LYS A 15 9.775 -11.273 -10.669 1.00 0.00 C ATOM 225 NZ LYS A 15 11.114 -10.935 -10.104 1.00 0.00 N ATOM 0 H LYS A 15 4.630 -8.031 -8.321 1.00 0.00 H new ATOM 0 HA LYS A 15 6.609 -8.111 -10.557 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.531 -8.266 -8.029 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.968 -9.919 -8.174 1.00 0.00 H new ATOM 0 HG2 LYS A 15 8.445 -8.979 -10.576 1.00 0.00 H new ATOM 0 HG3 LYS A 15 9.421 -8.960 -9.120 1.00 0.00 H new ATOM 0 HD2 LYS A 15 8.940 -11.324 -8.675 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.738 -11.376 -9.950 1.00 0.00 H new ATOM 0 HE2 LYS A 15 9.730 -12.334 -10.913 1.00 0.00 H new ATOM 0 HE3 LYS A 15 9.613 -10.726 -11.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 11.857 -11.237 -10.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 11.179 -9.908 -9.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 11.241 -11.424 -9.195 1.00 0.00 H new ATOM 239 N ASP A 16 4.589 -9.675 -11.172 1.00 0.00 N ATOM 240 CA ASP A 16 3.756 -10.821 -11.642 1.00 0.00 C ATOM 241 C ASP A 16 2.908 -11.385 -10.493 1.00 0.00 C ATOM 242 O ASP A 16 2.984 -12.557 -10.177 1.00 0.00 O ATOM 243 CB ASP A 16 4.672 -11.919 -12.187 1.00 0.00 C ATOM 244 CG ASP A 16 5.195 -11.509 -13.565 1.00 0.00 C ATOM 245 OD1 ASP A 16 4.427 -11.569 -14.511 1.00 0.00 O ATOM 246 OD2 ASP A 16 6.355 -11.140 -13.651 1.00 0.00 O ATOM 0 H ASP A 16 4.523 -8.832 -11.742 1.00 0.00 H new ATOM 0 HA ASP A 16 3.086 -10.469 -12.426 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.505 -12.084 -11.504 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.127 -12.860 -12.258 1.00 0.00 H new ATOM 251 N GLY A 17 2.089 -10.572 -9.876 1.00 0.00 N ATOM 252 CA GLY A 17 1.231 -11.081 -8.765 1.00 0.00 C ATOM 253 C GLY A 17 2.035 -11.156 -7.466 1.00 0.00 C ATOM 254 O GLY A 17 1.995 -10.258 -6.647 1.00 0.00 O ATOM 0 H GLY A 17 1.978 -9.582 -10.093 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.371 -10.425 -8.631 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.843 -12.068 -9.018 1.00 0.00 H new ATOM 258 N HIS A 18 2.756 -12.226 -7.268 1.00 0.00 N ATOM 259 CA HIS A 18 3.560 -12.377 -6.019 1.00 0.00 C ATOM 260 C HIS A 18 4.548 -11.212 -5.889 1.00 0.00 C ATOM 261 O HIS A 18 4.446 -10.219 -6.582 1.00 0.00 O ATOM 262 CB HIS A 18 4.328 -13.702 -6.073 1.00 0.00 C ATOM 263 CG HIS A 18 5.173 -13.746 -7.317 1.00 0.00 C ATOM 264 ND1 HIS A 18 6.528 -13.452 -7.302 1.00 0.00 N ATOM 265 CD2 HIS A 18 4.871 -14.050 -8.622 1.00 0.00 C ATOM 266 CE1 HIS A 18 6.986 -13.584 -8.561 1.00 0.00 C ATOM 267 NE2 HIS A 18 6.017 -13.947 -9.405 1.00 0.00 N ATOM 0 H HIS A 18 2.824 -13.007 -7.921 1.00 0.00 H new ATOM 0 HA HIS A 18 2.894 -12.373 -5.156 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.958 -13.805 -5.190 1.00 0.00 H new ATOM 0 HB3 HIS A 18 3.630 -14.539 -6.066 1.00 0.00 H new ATOM 0 HD1 HIS A 18 7.078 -13.184 -6.486 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.892 -14.327 -8.985 1.00 0.00 H new ATOM 0 HE1 HIS A 18 8.012 -13.417 -8.853 1.00 0.00 H new ATOM 275 N LEU A 19 5.512 -11.334 -5.016 1.00 0.00 N ATOM 276 CA LEU A 19 6.515 -10.245 -4.848 1.00 0.00 C ATOM 277 C LEU A 19 7.857 -10.726 -5.401 1.00 0.00 C ATOM 278 O LEU A 19 8.073 -11.914 -5.536 1.00 0.00 O ATOM 279 CB LEU A 19 6.668 -9.909 -3.363 1.00 0.00 C ATOM 280 CG LEU A 19 5.686 -8.800 -2.985 1.00 0.00 C ATOM 281 CD1 LEU A 19 5.496 -8.782 -1.467 1.00 0.00 C ATOM 282 CD2 LEU A 19 6.241 -7.449 -3.444 1.00 0.00 C ATOM 0 H LEU A 19 5.648 -12.144 -4.411 1.00 0.00 H new ATOM 0 HA LEU A 19 6.187 -9.354 -5.383 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.481 -10.796 -2.758 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.690 -9.591 -3.155 1.00 0.00 H new ATOM 0 HG LEU A 19 4.727 -8.984 -3.470 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.796 -7.991 -1.197 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.102 -9.744 -1.138 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.455 -8.598 -0.982 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.541 -6.658 -3.175 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.200 -7.266 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.378 -7.460 -4.525 1.00 0.00 H new ATOM 294 N PRO A 20 8.724 -9.795 -5.705 1.00 0.00 N ATOM 295 CA PRO A 20 10.095 -10.045 -6.262 1.00 0.00 C ATOM 296 C PRO A 20 11.010 -10.581 -5.160 1.00 0.00 C ATOM 297 O PRO A 20 11.810 -11.469 -5.381 1.00 0.00 O ATOM 298 CB PRO A 20 10.612 -8.701 -6.778 1.00 0.00 C ATOM 299 CG PRO A 20 9.527 -7.675 -6.525 1.00 0.00 C ATOM 300 CD PRO A 20 8.539 -8.309 -5.558 1.00 0.00 C ATOM 0 HA PRO A 20 10.071 -10.783 -7.064 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.533 -8.421 -6.266 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.844 -8.761 -7.841 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.949 -6.762 -6.104 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.033 -7.398 -7.456 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.733 -7.989 -4.534 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.516 -8.016 -5.795 1.00 0.00 H new ATOM 308 N TRP A 21 10.909 -10.034 -3.979 1.00 0.00 N ATOM 309 CA TRP A 21 11.781 -10.489 -2.859 1.00 0.00 C ATOM 310 C TRP A 21 10.934 -11.115 -1.746 1.00 0.00 C ATOM 311 O TRP A 21 9.853 -10.652 -1.438 1.00 0.00 O ATOM 312 CB TRP A 21 12.511 -9.273 -2.292 1.00 0.00 C ATOM 313 CG TRP A 21 11.498 -8.227 -1.954 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.742 -8.213 -0.834 1.00 0.00 C ATOM 315 CD2 TRP A 21 11.101 -7.064 -2.732 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.908 -7.112 -0.871 1.00 0.00 N ATOM 317 CE2 TRP A 21 10.092 -6.371 -2.020 1.00 0.00 C ATOM 318 CE3 TRP A 21 11.514 -6.544 -3.972 1.00 0.00 C ATOM 319 CZ2 TRP A 21 9.513 -5.206 -2.522 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.933 -5.371 -4.479 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.934 -4.705 -3.755 1.00 0.00 C ATOM 0 H TRP A 21 10.256 -9.287 -3.741 1.00 0.00 H new ATOM 0 HA TRP A 21 12.488 -11.231 -3.230 1.00 0.00 H new ATOM 0 HB2 TRP A 21 13.078 -9.552 -1.404 1.00 0.00 H new ATOM 0 HB3 TRP A 21 13.226 -8.887 -3.019 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.783 -8.943 -0.039 1.00 0.00 H new ATOM 0 HE1 TRP A 21 9.238 -6.876 -0.139 1.00 0.00 H new ATOM 0 HE3 TRP A 21 12.283 -7.050 -4.537 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.744 -4.695 -1.961 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.257 -4.979 -5.432 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.490 -3.804 -4.151 1.00 0.00 H new ATOM 332 N HIS A 22 11.423 -12.160 -1.138 1.00 0.00 N ATOM 333 CA HIS A 22 10.658 -12.809 -0.036 1.00 0.00 C ATOM 334 C HIS A 22 11.002 -12.115 1.287 1.00 0.00 C ATOM 335 O HIS A 22 11.980 -12.443 1.930 1.00 0.00 O ATOM 336 CB HIS A 22 11.040 -14.289 0.047 1.00 0.00 C ATOM 337 CG HIS A 22 10.012 -15.028 0.859 1.00 0.00 C ATOM 338 ND1 HIS A 22 8.777 -15.383 0.341 1.00 0.00 N ATOM 339 CD2 HIS A 22 10.022 -15.486 2.154 1.00 0.00 C ATOM 340 CE1 HIS A 22 8.100 -16.025 1.311 1.00 0.00 C ATOM 341 NE2 HIS A 22 8.813 -16.115 2.437 1.00 0.00 N ATOM 0 H HIS A 22 12.320 -12.593 -1.357 1.00 0.00 H new ATOM 0 HA HIS A 22 9.589 -12.724 -0.229 1.00 0.00 H new ATOM 0 HB2 HIS A 22 11.104 -14.716 -0.954 1.00 0.00 H new ATOM 0 HB3 HIS A 22 12.024 -14.396 0.502 1.00 0.00 H new ATOM 0 HD2 HIS A 22 10.843 -15.375 2.847 1.00 0.00 H new ATOM 0 HE1 HIS A 22 7.102 -16.419 1.193 1.00 0.00 H new ATOM 0 HE2 HIS A 22 8.532 -16.551 3.315 1.00 0.00 H new ATOM 349 N LEU A 23 10.211 -11.155 1.697 1.00 0.00 N ATOM 350 CA LEU A 23 10.503 -10.441 2.976 1.00 0.00 C ATOM 351 C LEU A 23 9.340 -10.636 3.957 1.00 0.00 C ATOM 352 O LEU A 23 8.322 -9.978 3.845 1.00 0.00 O ATOM 353 CB LEU A 23 10.685 -8.943 2.705 1.00 0.00 C ATOM 354 CG LEU A 23 11.572 -8.330 3.792 1.00 0.00 C ATOM 355 CD1 LEU A 23 13.004 -8.830 3.614 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.552 -6.800 3.681 1.00 0.00 C ATOM 0 H LEU A 23 9.378 -10.836 1.202 1.00 0.00 H new ATOM 0 HA LEU A 23 11.418 -10.848 3.407 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.137 -8.793 1.725 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.715 -8.445 2.689 1.00 0.00 H new ATOM 0 HG LEU A 23 11.196 -8.624 4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.640 -8.396 4.386 1.00 0.00 H new ATOM 0 HD12 LEU A 23 13.023 -9.917 3.697 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.373 -8.535 2.632 1.00 0.00 H new ATOM 0 HD21 LEU A 23 12.185 -6.371 4.457 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.926 -6.501 2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.531 -6.440 3.805 1.00 0.00 H new ATOM 368 N PRO A 24 9.526 -11.527 4.900 1.00 0.00 N ATOM 369 CA PRO A 24 8.527 -11.867 5.970 1.00 0.00 C ATOM 370 C PRO A 24 8.383 -10.677 6.919 1.00 0.00 C ATOM 371 O PRO A 24 7.303 -10.361 7.378 1.00 0.00 O ATOM 372 CB PRO A 24 9.062 -13.083 6.721 1.00 0.00 C ATOM 373 CG PRO A 24 10.426 -13.415 6.156 1.00 0.00 C ATOM 374 CD PRO A 24 10.758 -12.371 5.096 1.00 0.00 C ATOM 0 HA PRO A 24 7.548 -12.088 5.544 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.132 -12.872 7.788 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.385 -13.930 6.607 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.178 -13.410 6.945 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.426 -14.414 5.721 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.600 -11.755 5.413 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.048 -12.851 4.161 1.00 0.00 H new ATOM 382 N ASP A 25 9.469 -10.008 7.206 1.00 0.00 N ATOM 383 CA ASP A 25 9.405 -8.830 8.117 1.00 0.00 C ATOM 384 C ASP A 25 8.611 -7.706 7.444 1.00 0.00 C ATOM 385 O ASP A 25 8.092 -6.825 8.101 1.00 0.00 O ATOM 386 CB ASP A 25 10.824 -8.342 8.418 1.00 0.00 C ATOM 387 CG ASP A 25 10.862 -7.710 9.811 1.00 0.00 C ATOM 388 OD1 ASP A 25 10.895 -8.455 10.777 1.00 0.00 O ATOM 389 OD2 ASP A 25 10.857 -6.493 9.887 1.00 0.00 O ATOM 0 H ASP A 25 10.398 -10.228 6.848 1.00 0.00 H new ATOM 0 HA ASP A 25 8.913 -9.116 9.047 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.525 -9.175 8.366 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.137 -7.615 7.669 1.00 0.00 H new ATOM 394 N ASP A 26 8.510 -7.729 6.140 1.00 0.00 N ATOM 395 CA ASP A 26 7.746 -6.663 5.431 1.00 0.00 C ATOM 396 C ASP A 26 6.249 -6.934 5.597 1.00 0.00 C ATOM 397 O ASP A 26 5.488 -6.050 5.941 1.00 0.00 O ATOM 398 CB ASP A 26 8.121 -6.666 3.945 1.00 0.00 C ATOM 399 CG ASP A 26 7.243 -5.674 3.175 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.173 -4.521 3.581 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.647 -6.090 2.198 1.00 0.00 O ATOM 0 H ASP A 26 8.924 -8.440 5.537 1.00 0.00 H new ATOM 0 HA ASP A 26 7.987 -5.687 5.852 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.172 -6.400 3.827 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.997 -7.668 3.533 1.00 0.00 H new ATOM 406 N LEU A 27 5.819 -8.149 5.357 1.00 0.00 N ATOM 407 CA LEU A 27 4.367 -8.476 5.506 1.00 0.00 C ATOM 408 C LEU A 27 3.871 -7.992 6.871 1.00 0.00 C ATOM 409 O LEU A 27 2.898 -7.270 6.968 1.00 0.00 O ATOM 410 CB LEU A 27 4.170 -9.990 5.403 1.00 0.00 C ATOM 411 CG LEU A 27 4.523 -10.459 3.990 1.00 0.00 C ATOM 412 CD1 LEU A 27 5.043 -11.900 4.044 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.274 -10.396 3.102 1.00 0.00 C ATOM 0 H LEU A 27 6.410 -8.927 5.065 1.00 0.00 H new ATOM 0 HA LEU A 27 3.802 -7.981 4.716 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.799 -10.499 6.134 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.137 -10.249 5.636 1.00 0.00 H new ATOM 0 HG LEU A 27 5.295 -9.811 3.575 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.294 -12.234 3.037 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.932 -11.943 4.673 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.273 -12.549 4.460 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.526 -10.730 2.096 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.500 -11.043 3.516 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.907 -9.370 3.063 1.00 0.00 H new ATOM 425 N HIS A 28 4.543 -8.373 7.928 1.00 0.00 N ATOM 426 CA HIS A 28 4.119 -7.925 9.287 1.00 0.00 C ATOM 427 C HIS A 28 4.064 -6.396 9.316 1.00 0.00 C ATOM 428 O HIS A 28 3.178 -5.806 9.903 1.00 0.00 O ATOM 429 CB HIS A 28 5.130 -8.417 10.325 1.00 0.00 C ATOM 430 CG HIS A 28 5.145 -9.920 10.340 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.001 -10.669 10.567 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.158 -10.829 10.159 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.350 -11.967 10.517 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.654 -12.121 10.271 1.00 0.00 N ATOM 0 H HIS A 28 5.366 -8.975 7.907 1.00 0.00 H new ATOM 0 HA HIS A 28 3.135 -8.334 9.518 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.123 -8.036 10.089 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.868 -8.036 11.312 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.190 -10.579 9.960 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.660 -12.785 10.659 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.169 -12.997 10.184 1.00 0.00 H new ATOM 442 N TYR A 29 5.001 -5.754 8.671 1.00 0.00 N ATOM 443 CA TYR A 29 5.005 -4.264 8.639 1.00 0.00 C ATOM 444 C TYR A 29 3.752 -3.777 7.911 1.00 0.00 C ATOM 445 O TYR A 29 3.178 -2.762 8.251 1.00 0.00 O ATOM 446 CB TYR A 29 6.251 -3.775 7.896 1.00 0.00 C ATOM 447 CG TYR A 29 6.393 -2.283 8.077 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.865 -1.766 9.289 1.00 0.00 C ATOM 449 CD2 TYR A 29 6.054 -1.416 7.031 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.998 -0.382 9.457 1.00 0.00 C ATOM 451 CE2 TYR A 29 6.186 -0.032 7.198 1.00 0.00 C ATOM 452 CZ TYR A 29 6.658 0.485 8.412 1.00 0.00 C ATOM 453 OH TYR A 29 6.791 1.850 8.577 1.00 0.00 O ATOM 0 H TYR A 29 5.766 -6.199 8.164 1.00 0.00 H new ATOM 0 HA TYR A 29 5.014 -3.873 9.656 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.137 -4.284 8.276 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.174 -4.018 6.836 1.00 0.00 H new ATOM 0 HD1 TYR A 29 7.127 -2.435 10.095 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.691 -1.815 6.095 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.363 0.016 10.392 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.924 0.637 6.391 1.00 0.00 H new ATOM 0 HH TYR A 29 6.513 2.307 7.756 1.00 0.00 H new ATOM 463 N PHE A 30 3.331 -4.498 6.906 1.00 0.00 N ATOM 464 CA PHE A 30 2.119 -4.091 6.139 1.00 0.00 C ATOM 465 C PHE A 30 0.872 -4.270 7.011 1.00 0.00 C ATOM 466 O PHE A 30 0.044 -3.385 7.114 1.00 0.00 O ATOM 467 CB PHE A 30 1.997 -4.959 4.884 1.00 0.00 C ATOM 468 CG PHE A 30 0.783 -4.535 4.093 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.685 -3.227 3.606 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.245 -5.451 3.851 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.443 -2.835 2.877 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.373 -5.061 3.122 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.473 -3.753 2.634 1.00 0.00 C ATOM 0 H PHE A 30 3.778 -5.356 6.582 1.00 0.00 H new ATOM 0 HA PHE A 30 2.207 -3.044 5.850 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.894 -4.861 4.273 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.914 -6.010 5.162 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.480 -2.520 3.793 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.168 -6.460 4.227 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.520 -1.825 2.502 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.167 -5.769 2.936 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.344 -3.452 2.070 1.00 0.00 H new ATOM 483 N ARG A 31 0.729 -5.406 7.639 1.00 0.00 N ATOM 484 CA ARG A 31 -0.466 -5.640 8.500 1.00 0.00 C ATOM 485 C ARG A 31 -0.471 -4.629 9.648 1.00 0.00 C ATOM 486 O ARG A 31 -1.351 -3.799 9.750 1.00 0.00 O ATOM 487 CB ARG A 31 -0.407 -7.060 9.067 1.00 0.00 C ATOM 488 CG ARG A 31 -1.781 -7.460 9.608 1.00 0.00 C ATOM 489 CD ARG A 31 -1.729 -8.910 10.095 1.00 0.00 C ATOM 490 NE ARG A 31 -0.675 -9.041 11.145 1.00 0.00 N ATOM 491 CZ ARG A 31 -0.136 -10.206 11.415 1.00 0.00 C ATOM 492 NH1 ARG A 31 -0.519 -11.287 10.784 1.00 0.00 N ATOM 493 NH2 ARG A 31 0.790 -10.290 12.332 1.00 0.00 N ATOM 0 H ARG A 31 1.389 -6.183 7.593 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.374 -5.520 7.910 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.094 -7.759 8.291 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.337 -7.113 9.862 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.069 -6.800 10.426 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.537 -7.352 8.830 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.698 -9.205 10.497 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -1.513 -9.578 9.261 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.370 -8.214 11.659 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -1.246 -11.231 10.071 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -0.090 -12.186 11.005 1.00 0.00 H new ATOM 0 HH21 ARG A 31 1.089 -9.453 12.833 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.214 -11.192 12.548 1.00 0.00 H new ATOM 507 N ALA A 32 0.504 -4.705 10.516 1.00 0.00 N ATOM 508 CA ALA A 32 0.572 -3.760 11.674 1.00 0.00 C ATOM 509 C ALA A 32 0.330 -2.319 11.203 1.00 0.00 C ATOM 510 O ALA A 32 -0.276 -1.525 11.896 1.00 0.00 O ATOM 511 CB ALA A 32 1.954 -3.854 12.322 1.00 0.00 C ATOM 0 H ALA A 32 1.262 -5.386 10.473 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.198 -4.030 12.396 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.007 -3.167 13.166 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.123 -4.872 12.672 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.718 -3.590 11.590 1.00 0.00 H new ATOM 517 N GLN A 33 0.810 -1.971 10.038 1.00 0.00 N ATOM 518 CA GLN A 33 0.620 -0.579 9.530 1.00 0.00 C ATOM 519 C GLN A 33 -0.840 -0.346 9.125 1.00 0.00 C ATOM 520 O GLN A 33 -1.273 0.779 8.968 1.00 0.00 O ATOM 521 CB GLN A 33 1.515 -0.365 8.308 1.00 0.00 C ATOM 522 CG GLN A 33 2.885 0.152 8.755 1.00 0.00 C ATOM 523 CD GLN A 33 3.045 1.606 8.313 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.660 1.880 7.302 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.512 2.556 9.032 1.00 0.00 N ATOM 0 H GLN A 33 1.327 -2.592 9.415 1.00 0.00 H new ATOM 0 HA GLN A 33 0.883 0.122 10.322 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.630 -1.301 7.761 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.051 0.348 7.626 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.979 0.077 9.838 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.676 -0.461 8.323 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.996 2.325 9.881 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.612 3.530 8.745 1.00 0.00 H new ATOM 534 N THR A 34 -1.599 -1.392 8.938 1.00 0.00 N ATOM 535 CA THR A 34 -3.023 -1.211 8.526 1.00 0.00 C ATOM 536 C THR A 34 -3.960 -1.830 9.566 1.00 0.00 C ATOM 537 O THR A 34 -5.058 -2.246 9.250 1.00 0.00 O ATOM 538 CB THR A 34 -3.253 -1.879 7.164 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.779 -3.224 7.188 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.508 -1.096 6.083 1.00 0.00 C ATOM 0 H THR A 34 -1.298 -2.360 9.052 1.00 0.00 H new ATOM 0 HA THR A 34 -3.235 -0.145 8.451 1.00 0.00 H new ATOM 0 HB THR A 34 -4.321 -1.884 6.947 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.799 -3.226 7.176 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.670 -1.569 5.114 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.880 -0.072 6.054 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.442 -1.088 6.309 1.00 0.00 H new ATOM 548 N VAL A 35 -3.545 -1.886 10.803 1.00 0.00 N ATOM 549 CA VAL A 35 -4.427 -2.471 11.855 1.00 0.00 C ATOM 550 C VAL A 35 -5.454 -1.428 12.302 1.00 0.00 C ATOM 551 O VAL A 35 -5.112 -0.409 12.871 1.00 0.00 O ATOM 552 CB VAL A 35 -3.585 -2.902 13.059 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.654 -4.044 12.648 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.753 -1.715 13.558 1.00 0.00 C ATOM 0 H VAL A 35 -2.638 -1.554 11.130 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.942 -3.340 11.445 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.244 -3.241 13.858 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.054 -4.351 13.505 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.247 -4.889 12.299 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.996 -3.707 11.847 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.155 -2.025 14.415 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.094 -1.372 12.760 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.418 -0.903 13.854 1.00 0.00 H new ATOM 564 N GLY A 36 -6.711 -1.681 12.056 1.00 0.00 N ATOM 565 CA GLY A 36 -7.770 -0.716 12.475 1.00 0.00 C ATOM 566 C GLY A 36 -7.837 0.467 11.501 1.00 0.00 C ATOM 567 O GLY A 36 -8.457 1.472 11.788 1.00 0.00 O ATOM 0 H GLY A 36 -7.052 -2.517 11.581 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.736 -1.220 12.511 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.562 -0.354 13.482 1.00 0.00 H new ATOM 571 N LYS A 37 -7.206 0.366 10.359 1.00 0.00 N ATOM 572 CA LYS A 37 -7.246 1.497 9.383 1.00 0.00 C ATOM 573 C LYS A 37 -7.866 1.015 8.068 1.00 0.00 C ATOM 574 O LYS A 37 -7.831 -0.160 7.755 1.00 0.00 O ATOM 575 CB LYS A 37 -5.824 2.000 9.126 1.00 0.00 C ATOM 576 CG LYS A 37 -5.283 2.669 10.392 1.00 0.00 C ATOM 577 CD LYS A 37 -3.755 2.598 10.395 1.00 0.00 C ATOM 578 CE LYS A 37 -3.186 3.798 9.634 1.00 0.00 C ATOM 579 NZ LYS A 37 -1.699 3.714 9.615 1.00 0.00 N ATOM 0 H LYS A 37 -6.667 -0.447 10.061 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.848 2.309 9.791 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.180 1.170 8.837 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.822 2.709 8.298 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.609 3.708 10.434 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.682 2.173 11.277 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.383 2.594 11.419 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.423 1.669 9.931 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.573 3.813 8.615 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.502 4.727 10.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.326 4.330 8.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.322 4.021 10.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -1.409 2.732 9.432 1.00 0.00 H new ATOM 593 N ILE A 38 -8.436 1.907 7.295 1.00 0.00 N ATOM 594 CA ILE A 38 -9.054 1.483 6.005 1.00 0.00 C ATOM 595 C ILE A 38 -7.948 1.149 5.003 1.00 0.00 C ATOM 596 O ILE A 38 -7.074 1.950 4.743 1.00 0.00 O ATOM 597 CB ILE A 38 -9.927 2.611 5.450 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.909 3.074 6.533 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.707 2.094 4.242 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.774 4.219 5.996 1.00 0.00 C ATOM 0 H ILE A 38 -8.499 2.904 7.502 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.675 0.603 6.173 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.298 3.449 5.149 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.542 2.242 6.842 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.362 3.403 7.416 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.331 2.894 3.842 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.009 1.760 3.474 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.338 1.259 4.547 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.470 4.543 6.770 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -11.135 5.054 5.709 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.334 3.875 5.126 1.00 0.00 H new ATOM 612 N MET A 39 -7.972 -0.035 4.451 1.00 0.00 N ATOM 613 CA MET A 39 -6.917 -0.430 3.474 1.00 0.00 C ATOM 614 C MET A 39 -7.510 -0.484 2.064 1.00 0.00 C ATOM 615 O MET A 39 -8.383 -1.281 1.781 1.00 0.00 O ATOM 616 CB MET A 39 -6.375 -1.811 3.850 1.00 0.00 C ATOM 617 CG MET A 39 -5.023 -2.035 3.168 1.00 0.00 C ATOM 618 SD MET A 39 -4.940 -3.728 2.532 1.00 0.00 S ATOM 619 CE MET A 39 -4.329 -4.509 4.044 1.00 0.00 C ATOM 0 H MET A 39 -8.679 -0.747 4.635 1.00 0.00 H new ATOM 0 HA MET A 39 -6.110 0.303 3.496 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.265 -1.888 4.932 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.080 -2.585 3.546 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.892 -1.323 2.354 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.213 -1.861 3.877 1.00 0.00 H new ATOM 0 HE1 MET A 39 -4.035 -5.536 3.829 1.00 0.00 H new ATOM 0 HE2 MET A 39 -3.468 -3.955 4.417 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.116 -4.507 4.798 1.00 0.00 H new ATOM 629 N VAL A 40 -7.044 0.356 1.177 1.00 0.00 N ATOM 630 CA VAL A 40 -7.585 0.349 -0.213 1.00 0.00 C ATOM 631 C VAL A 40 -6.734 -0.568 -1.098 1.00 0.00 C ATOM 632 O VAL A 40 -5.557 -0.335 -1.307 1.00 0.00 O ATOM 633 CB VAL A 40 -7.560 1.770 -0.779 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.259 1.791 -2.139 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.289 2.713 0.182 1.00 0.00 C ATOM 0 H VAL A 40 -6.313 1.045 1.355 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.611 -0.019 -0.196 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.527 2.096 -0.897 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.241 2.804 -2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.742 1.119 -2.824 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.293 1.466 -2.022 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.272 3.726 -0.220 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.322 2.386 0.299 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.792 2.699 1.152 1.00 0.00 H new ATOM 645 N VAL A 41 -7.333 -1.603 -1.628 1.00 0.00 N ATOM 646 CA VAL A 41 -6.582 -2.542 -2.512 1.00 0.00 C ATOM 647 C VAL A 41 -7.360 -2.729 -3.816 1.00 0.00 C ATOM 648 O VAL A 41 -8.536 -3.040 -3.809 1.00 0.00 O ATOM 649 CB VAL A 41 -6.411 -3.897 -1.817 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.296 -3.799 -0.776 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.717 -4.299 -1.124 1.00 0.00 C ATOM 0 H VAL A 41 -8.315 -1.839 -1.485 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.596 -2.129 -2.724 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.154 -4.649 -2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.174 -4.763 -0.281 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.363 -3.523 -1.267 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.555 -3.042 -0.036 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.586 -5.263 -0.633 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.982 -3.546 -0.381 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.514 -4.374 -1.864 1.00 0.00 H new ATOM 661 N GLY A 42 -6.718 -2.527 -4.934 1.00 0.00 N ATOM 662 CA GLY A 42 -7.419 -2.672 -6.242 1.00 0.00 C ATOM 663 C GLY A 42 -7.860 -4.121 -6.458 1.00 0.00 C ATOM 664 O GLY A 42 -7.284 -5.047 -5.922 1.00 0.00 O ATOM 0 H GLY A 42 -5.734 -2.267 -4.998 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.287 -2.014 -6.270 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.758 -2.363 -7.052 1.00 0.00 H new ATOM 668 N ARG A 43 -8.891 -4.315 -7.241 1.00 0.00 N ATOM 669 CA ARG A 43 -9.403 -5.692 -7.508 1.00 0.00 C ATOM 670 C ARG A 43 -8.268 -6.618 -7.957 1.00 0.00 C ATOM 671 O ARG A 43 -8.376 -7.825 -7.857 1.00 0.00 O ATOM 672 CB ARG A 43 -10.464 -5.627 -8.611 1.00 0.00 C ATOM 673 CG ARG A 43 -11.185 -6.976 -8.717 1.00 0.00 C ATOM 674 CD ARG A 43 -10.801 -7.667 -10.028 1.00 0.00 C ATOM 675 NE ARG A 43 -11.294 -6.859 -11.184 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.308 -7.364 -12.395 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.896 -8.587 -12.615 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.737 -6.641 -13.393 1.00 0.00 N ATOM 0 H ARG A 43 -9.405 -3.570 -7.711 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.834 -6.089 -6.589 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.182 -4.837 -8.392 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.997 -5.378 -9.564 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.919 -7.609 -7.870 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.264 -6.826 -8.676 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.719 -7.782 -10.087 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -11.230 -8.668 -10.062 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.623 -5.906 -11.030 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.559 -9.159 -11.840 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.912 -8.968 -13.561 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.060 -5.687 -13.230 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.750 -7.030 -14.336 1.00 0.00 H new ATOM 692 N ARG A 44 -7.183 -6.080 -8.453 1.00 0.00 N ATOM 693 CA ARG A 44 -6.065 -6.957 -8.903 1.00 0.00 C ATOM 694 C ARG A 44 -5.308 -7.490 -7.683 1.00 0.00 C ATOM 695 O ARG A 44 -5.017 -8.668 -7.590 1.00 0.00 O ATOM 696 CB ARG A 44 -5.111 -6.149 -9.787 1.00 0.00 C ATOM 697 CG ARG A 44 -5.449 -6.389 -11.260 1.00 0.00 C ATOM 698 CD ARG A 44 -4.638 -7.575 -11.786 1.00 0.00 C ATOM 699 NE ARG A 44 -4.897 -7.744 -13.247 1.00 0.00 N ATOM 700 CZ ARG A 44 -6.037 -8.234 -13.672 1.00 0.00 C ATOM 701 NH1 ARG A 44 -6.970 -8.589 -12.826 1.00 0.00 N ATOM 702 NH2 ARG A 44 -6.243 -8.367 -14.954 1.00 0.00 N ATOM 0 H ARG A 44 -7.025 -5.079 -8.565 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.466 -7.796 -9.472 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.193 -5.088 -9.553 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.080 -6.440 -9.588 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.515 -6.587 -11.371 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.227 -5.496 -11.845 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -3.575 -7.409 -11.611 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.912 -8.483 -11.249 1.00 0.00 H new ATOM 0 HE ARG A 44 -4.180 -7.476 -13.921 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.815 -8.486 -11.823 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.852 -8.969 -13.169 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.520 -8.091 -15.618 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -7.127 -8.747 -15.292 1.00 0.00 H new ATOM 716 N THR A 45 -4.987 -6.637 -6.747 1.00 0.00 N ATOM 717 CA THR A 45 -4.249 -7.103 -5.536 1.00 0.00 C ATOM 718 C THR A 45 -5.180 -7.949 -4.665 1.00 0.00 C ATOM 719 O THR A 45 -4.824 -9.028 -4.233 1.00 0.00 O ATOM 720 CB THR A 45 -3.757 -5.895 -4.735 1.00 0.00 C ATOM 721 OG1 THR A 45 -3.242 -4.916 -5.626 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.655 -6.337 -3.767 1.00 0.00 C ATOM 0 H THR A 45 -5.203 -5.640 -6.768 1.00 0.00 H new ATOM 0 HA THR A 45 -3.393 -7.704 -5.844 1.00 0.00 H new ATOM 0 HB THR A 45 -4.587 -5.471 -4.169 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.928 -4.141 -5.115 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.305 -5.477 -3.197 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.051 -7.088 -3.084 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.824 -6.761 -4.331 1.00 0.00 H new ATOM 730 N TYR A 46 -6.370 -7.472 -4.404 1.00 0.00 N ATOM 731 CA TYR A 46 -7.324 -8.253 -3.560 1.00 0.00 C ATOM 732 C TYR A 46 -7.493 -9.658 -4.145 1.00 0.00 C ATOM 733 O TYR A 46 -7.652 -10.626 -3.427 1.00 0.00 O ATOM 734 CB TYR A 46 -8.681 -7.545 -3.537 1.00 0.00 C ATOM 735 CG TYR A 46 -9.494 -8.047 -2.367 1.00 0.00 C ATOM 736 CD1 TYR A 46 -9.337 -7.464 -1.105 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.407 -9.093 -2.545 1.00 0.00 C ATOM 738 CE1 TYR A 46 -10.090 -7.926 -0.021 1.00 0.00 C ATOM 739 CE2 TYR A 46 -11.162 -9.556 -1.461 1.00 0.00 C ATOM 740 CZ TYR A 46 -11.003 -8.972 -0.198 1.00 0.00 C ATOM 741 OH TYR A 46 -11.749 -9.428 0.872 1.00 0.00 O ATOM 0 H TYR A 46 -6.722 -6.575 -4.739 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.934 -8.327 -2.545 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.539 -6.467 -3.458 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.215 -7.729 -4.469 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.633 -6.656 -0.968 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.529 -9.543 -3.519 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.967 -7.476 0.953 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.867 -10.363 -1.598 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.334 -10.156 0.576 1.00 0.00 H new ATOM 751 N GLU A 47 -7.456 -9.775 -5.446 1.00 0.00 N ATOM 752 CA GLU A 47 -7.609 -11.114 -6.083 1.00 0.00 C ATOM 753 C GLU A 47 -6.285 -11.880 -5.995 1.00 0.00 C ATOM 754 O GLU A 47 -6.246 -13.086 -6.141 1.00 0.00 O ATOM 755 CB GLU A 47 -8.000 -10.936 -7.552 1.00 0.00 C ATOM 756 CG GLU A 47 -9.526 -10.923 -7.681 1.00 0.00 C ATOM 757 CD GLU A 47 -9.998 -12.218 -8.345 1.00 0.00 C ATOM 758 OE1 GLU A 47 -10.207 -13.185 -7.630 1.00 0.00 O ATOM 759 OE2 GLU A 47 -10.141 -12.222 -9.556 1.00 0.00 O ATOM 0 H GLU A 47 -7.326 -8.999 -6.095 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.386 -11.676 -5.564 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.585 -10.005 -7.939 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.581 -11.745 -8.151 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.983 -10.820 -6.697 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.843 -10.063 -8.271 1.00 0.00 H new ATOM 766 N SER A 48 -5.201 -11.190 -5.755 1.00 0.00 N ATOM 767 CA SER A 48 -3.882 -11.878 -5.655 1.00 0.00 C ATOM 768 C SER A 48 -3.536 -12.124 -4.181 1.00 0.00 C ATOM 769 O SER A 48 -2.706 -12.954 -3.865 1.00 0.00 O ATOM 770 CB SER A 48 -2.802 -11.003 -6.293 1.00 0.00 C ATOM 771 OG SER A 48 -1.619 -11.771 -6.471 1.00 0.00 O ATOM 0 H SER A 48 -5.173 -10.179 -5.624 1.00 0.00 H new ATOM 0 HA SER A 48 -3.934 -12.834 -6.177 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.148 -10.620 -7.253 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.597 -10.139 -5.660 1.00 0.00 H new ATOM 0 HG SER A 48 -0.925 -11.213 -6.881 1.00 0.00 H new ATOM 777 N PHE A 49 -4.156 -11.399 -3.279 1.00 0.00 N ATOM 778 CA PHE A 49 -3.861 -11.577 -1.821 1.00 0.00 C ATOM 779 C PHE A 49 -3.814 -13.073 -1.468 1.00 0.00 C ATOM 780 O PHE A 49 -4.482 -13.873 -2.093 1.00 0.00 O ATOM 781 CB PHE A 49 -4.962 -10.898 -0.999 1.00 0.00 C ATOM 782 CG PHE A 49 -4.434 -9.622 -0.384 1.00 0.00 C ATOM 783 CD1 PHE A 49 -4.485 -8.422 -1.102 1.00 0.00 C ATOM 784 CD2 PHE A 49 -3.894 -9.641 0.907 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.995 -7.242 -0.529 1.00 0.00 C ATOM 786 CE2 PHE A 49 -3.405 -8.463 1.479 1.00 0.00 C ATOM 787 CZ PHE A 49 -3.455 -7.263 0.762 1.00 0.00 C ATOM 0 H PHE A 49 -4.857 -10.689 -3.491 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.894 -11.128 -1.594 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.819 -10.677 -1.635 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.311 -11.572 -0.216 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.902 -8.406 -2.098 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -3.855 -10.567 1.462 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -4.034 -6.316 -1.083 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.988 -8.479 2.475 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.077 -6.353 1.204 1.00 0.00 H new ATOM 797 N PRO A 50 -3.025 -13.406 -0.473 1.00 0.00 N ATOM 798 CA PRO A 50 -2.818 -14.800 0.048 1.00 0.00 C ATOM 799 C PRO A 50 -3.969 -15.189 0.980 1.00 0.00 C ATOM 800 O PRO A 50 -4.708 -16.116 0.713 1.00 0.00 O ATOM 801 CB PRO A 50 -1.503 -14.783 0.819 1.00 0.00 C ATOM 802 CG PRO A 50 -1.127 -13.333 1.045 1.00 0.00 C ATOM 803 CD PRO A 50 -2.173 -12.472 0.343 1.00 0.00 C ATOM 0 HA PRO A 50 -2.790 -15.525 -0.765 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.609 -15.304 1.770 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.723 -15.299 0.259 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.097 -13.107 2.111 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.133 -13.128 0.648 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.779 -11.930 1.069 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.697 -11.727 -0.294 1.00 0.00 H new ATOM 811 N LYS A 51 -4.126 -14.488 2.073 1.00 0.00 N ATOM 812 CA LYS A 51 -5.228 -14.819 3.020 1.00 0.00 C ATOM 813 C LYS A 51 -6.001 -13.548 3.369 1.00 0.00 C ATOM 814 O LYS A 51 -5.582 -12.761 4.196 1.00 0.00 O ATOM 815 CB LYS A 51 -4.641 -15.425 4.296 1.00 0.00 C ATOM 816 CG LYS A 51 -4.099 -16.824 3.995 1.00 0.00 C ATOM 817 CD LYS A 51 -2.952 -17.150 4.958 1.00 0.00 C ATOM 818 CE LYS A 51 -1.633 -17.228 4.185 1.00 0.00 C ATOM 819 NZ LYS A 51 -0.577 -16.485 4.928 1.00 0.00 N ATOM 0 H LYS A 51 -3.538 -13.701 2.349 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.902 -15.537 2.554 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.843 -14.789 4.679 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.406 -15.479 5.071 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.894 -17.563 4.097 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -3.747 -16.875 2.964 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -2.886 -16.385 5.732 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.146 -18.097 5.462 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -1.337 -18.269 4.054 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -1.758 -16.805 3.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 0.319 -16.538 4.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -0.860 -15.490 5.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -0.452 -16.908 5.870 1.00 0.00 H new ATOM 833 N ARG A 52 -7.129 -13.343 2.746 1.00 0.00 N ATOM 834 CA ARG A 52 -7.935 -12.122 3.039 1.00 0.00 C ATOM 835 C ARG A 52 -9.364 -12.533 3.406 1.00 0.00 C ATOM 836 O ARG A 52 -9.821 -13.590 3.020 1.00 0.00 O ATOM 837 CB ARG A 52 -7.962 -11.182 1.818 1.00 0.00 C ATOM 838 CG ARG A 52 -7.892 -11.974 0.501 1.00 0.00 C ATOM 839 CD ARG A 52 -9.283 -12.059 -0.124 1.00 0.00 C ATOM 840 NE ARG A 52 -9.214 -12.859 -1.383 1.00 0.00 N ATOM 841 CZ ARG A 52 -10.307 -13.310 -1.951 1.00 0.00 C ATOM 842 NH1 ARG A 52 -11.482 -13.071 -1.427 1.00 0.00 N ATOM 843 NH2 ARG A 52 -10.222 -14.005 -3.053 1.00 0.00 N ATOM 0 H ARG A 52 -7.528 -13.968 2.046 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.478 -11.591 3.874 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.873 -10.584 1.837 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.123 -10.488 1.872 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.202 -11.490 -0.190 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.505 -12.976 0.688 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -9.980 -12.521 0.575 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -9.660 -11.059 -0.336 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.307 -13.057 -1.806 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -11.556 -12.528 -0.567 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -12.324 -13.428 -1.879 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.309 -14.194 -3.467 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -11.068 -14.359 -3.500 1.00 0.00 H new ATOM 857 N PRO A 53 -10.025 -11.682 4.154 1.00 0.00 N ATOM 858 CA PRO A 53 -9.513 -10.360 4.662 1.00 0.00 C ATOM 859 C PRO A 53 -8.582 -10.567 5.862 1.00 0.00 C ATOM 860 O PRO A 53 -8.452 -11.656 6.385 1.00 0.00 O ATOM 861 CB PRO A 53 -10.738 -9.552 5.082 1.00 0.00 C ATOM 862 CG PRO A 53 -11.929 -10.489 5.072 1.00 0.00 C ATOM 863 CD PRO A 53 -11.430 -11.867 4.649 1.00 0.00 C ATOM 0 HA PRO A 53 -8.941 -9.843 3.892 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.594 -9.126 6.075 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -10.900 -8.719 4.398 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.388 -10.535 6.060 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.693 -10.130 4.382 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.457 -12.563 5.488 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.064 -12.285 3.867 1.00 0.00 H new ATOM 871 N LEU A 54 -7.928 -9.519 6.291 1.00 0.00 N ATOM 872 CA LEU A 54 -6.992 -9.631 7.448 1.00 0.00 C ATOM 873 C LEU A 54 -7.786 -9.757 8.756 1.00 0.00 C ATOM 874 O LEU A 54 -8.941 -9.387 8.816 1.00 0.00 O ATOM 875 CB LEU A 54 -6.112 -8.381 7.510 1.00 0.00 C ATOM 876 CG LEU A 54 -5.086 -8.413 6.377 1.00 0.00 C ATOM 877 CD1 LEU A 54 -4.525 -7.006 6.163 1.00 0.00 C ATOM 878 CD2 LEU A 54 -3.944 -9.364 6.744 1.00 0.00 C ATOM 0 H LEU A 54 -8.003 -8.585 5.887 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.370 -10.517 7.320 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.729 -7.486 7.429 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.603 -8.331 8.473 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.566 -8.760 5.462 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.793 -7.025 5.356 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.336 -6.327 5.901 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.045 -6.662 7.080 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.214 -9.385 5.935 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.462 -9.018 7.659 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.342 -10.367 6.900 1.00 0.00 H new ATOM 890 N PRO A 55 -7.131 -10.277 9.766 1.00 0.00 N ATOM 891 CA PRO A 55 -7.691 -10.501 11.148 1.00 0.00 C ATOM 892 C PRO A 55 -8.053 -9.163 11.803 1.00 0.00 C ATOM 893 O PRO A 55 -7.200 -8.434 12.265 1.00 0.00 O ATOM 894 CB PRO A 55 -6.614 -11.209 11.966 1.00 0.00 C ATOM 895 CG PRO A 55 -5.407 -11.406 11.076 1.00 0.00 C ATOM 896 CD PRO A 55 -5.701 -10.748 9.733 1.00 0.00 C ATOM 0 HA PRO A 55 -8.598 -11.103 11.098 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.349 -10.617 12.842 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -6.981 -12.169 12.329 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.521 -10.964 11.532 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.200 -12.468 10.943 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.025 -9.911 9.560 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.548 -11.455 8.918 1.00 0.00 H new ATOM 904 N GLU A 56 -9.320 -8.854 11.866 1.00 0.00 N ATOM 905 CA GLU A 56 -9.759 -7.576 12.507 1.00 0.00 C ATOM 906 C GLU A 56 -9.078 -6.379 11.830 1.00 0.00 C ATOM 907 O GLU A 56 -8.456 -5.556 12.473 1.00 0.00 O ATOM 908 CB GLU A 56 -9.390 -7.603 13.992 1.00 0.00 C ATOM 909 CG GLU A 56 -10.294 -8.597 14.725 1.00 0.00 C ATOM 910 CD GLU A 56 -9.487 -9.328 15.799 1.00 0.00 C ATOM 911 OE1 GLU A 56 -8.783 -10.261 15.450 1.00 0.00 O ATOM 912 OE2 GLU A 56 -9.587 -8.942 16.952 1.00 0.00 O ATOM 0 H GLU A 56 -10.075 -9.433 11.500 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.839 -7.474 12.396 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -8.345 -7.888 14.113 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -9.501 -6.608 14.423 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -11.134 -8.073 15.181 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -10.711 -9.314 14.018 1.00 0.00 H new ATOM 919 N ARG A 57 -9.204 -6.276 10.536 1.00 0.00 N ATOM 920 CA ARG A 57 -8.582 -5.133 9.806 1.00 0.00 C ATOM 921 C ARG A 57 -9.571 -4.588 8.775 1.00 0.00 C ATOM 922 O ARG A 57 -10.275 -5.334 8.123 1.00 0.00 O ATOM 923 CB ARG A 57 -7.318 -5.607 9.089 1.00 0.00 C ATOM 924 CG ARG A 57 -6.103 -5.414 9.999 1.00 0.00 C ATOM 925 CD ARG A 57 -5.690 -6.761 10.593 1.00 0.00 C ATOM 926 NE ARG A 57 -5.306 -6.573 12.022 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.702 -7.529 12.687 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.443 -8.678 12.119 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.354 -7.331 13.929 1.00 0.00 N ATOM 0 H ARG A 57 -9.713 -6.937 9.949 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.324 -4.349 10.518 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.416 -6.658 8.816 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.183 -5.048 8.163 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.276 -4.986 9.433 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.341 -4.711 10.797 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.512 -7.473 10.516 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.854 -7.178 10.032 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.516 -5.690 12.488 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.711 -8.839 11.148 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.973 -9.413 12.647 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.552 -6.437 14.378 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.884 -8.071 14.451 1.00 0.00 H new ATOM 943 N THR A 58 -9.628 -3.293 8.622 1.00 0.00 N ATOM 944 CA THR A 58 -10.570 -2.697 7.632 1.00 0.00 C ATOM 945 C THR A 58 -9.970 -2.809 6.229 1.00 0.00 C ATOM 946 O THR A 58 -8.928 -2.251 5.944 1.00 0.00 O ATOM 947 CB THR A 58 -10.802 -1.223 7.974 1.00 0.00 C ATOM 948 OG1 THR A 58 -10.910 -1.077 9.383 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.090 -0.733 7.308 1.00 0.00 C ATOM 0 H THR A 58 -9.062 -2.621 9.140 1.00 0.00 H new ATOM 0 HA THR A 58 -11.520 -3.230 7.664 1.00 0.00 H new ATOM 0 HB THR A 58 -9.963 -0.631 7.609 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.057 -0.758 9.745 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.251 0.317 7.555 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.005 -0.843 6.227 1.00 0.00 H new ATOM 0 HG23 THR A 58 -12.933 -1.323 7.668 1.00 0.00 H new ATOM 957 N ASN A 59 -10.619 -3.527 5.351 1.00 0.00 N ATOM 958 CA ASN A 59 -10.085 -3.679 3.967 1.00 0.00 C ATOM 959 C ASN A 59 -11.136 -3.219 2.954 1.00 0.00 C ATOM 960 O ASN A 59 -12.292 -3.584 3.036 1.00 0.00 O ATOM 961 CB ASN A 59 -9.744 -5.149 3.714 1.00 0.00 C ATOM 962 CG ASN A 59 -8.321 -5.434 4.197 1.00 0.00 C ATOM 963 OD1 ASN A 59 -7.406 -5.532 3.404 1.00 0.00 O ATOM 964 ND2 ASN A 59 -8.095 -5.574 5.475 1.00 0.00 N ATOM 0 H ASN A 59 -11.496 -4.015 5.533 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.188 -3.070 3.857 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.452 -5.792 4.236 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.831 -5.376 2.651 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.150 -5.766 5.808 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -8.863 -5.492 6.141 1.00 0.00 H new ATOM 971 N VAL A 60 -10.741 -2.416 2.001 1.00 0.00 N ATOM 972 CA VAL A 60 -11.709 -1.925 0.976 1.00 0.00 C ATOM 973 C VAL A 60 -11.223 -2.349 -0.411 1.00 0.00 C ATOM 974 O VAL A 60 -10.058 -2.219 -0.730 1.00 0.00 O ATOM 975 CB VAL A 60 -11.781 -0.398 1.036 1.00 0.00 C ATOM 976 CG1 VAL A 60 -12.928 0.096 0.153 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.019 0.047 2.480 1.00 0.00 C ATOM 0 H VAL A 60 -9.785 -2.078 1.888 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.696 -2.346 1.170 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.841 0.023 0.678 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -12.978 1.184 0.197 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.756 -0.218 -0.876 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -13.868 -0.325 0.509 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.070 1.135 2.522 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.957 -0.374 2.841 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.199 -0.302 3.108 1.00 0.00 H new ATOM 987 N VAL A 61 -12.097 -2.857 -1.241 1.00 0.00 N ATOM 988 CA VAL A 61 -11.666 -3.287 -2.602 1.00 0.00 C ATOM 989 C VAL A 61 -12.123 -2.254 -3.635 1.00 0.00 C ATOM 990 O VAL A 61 -13.135 -1.601 -3.468 1.00 0.00 O ATOM 991 CB VAL A 61 -12.306 -4.639 -2.936 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.605 -5.251 -4.150 1.00 0.00 C ATOM 993 CG2 VAL A 61 -12.172 -5.585 -1.740 1.00 0.00 C ATOM 0 H VAL A 61 -13.087 -2.992 -1.035 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.580 -3.375 -2.624 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.362 -4.490 -3.161 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.061 -6.212 -4.387 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.706 -4.581 -5.004 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.548 -5.396 -3.925 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.628 -6.545 -1.982 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.117 -5.733 -1.509 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.675 -5.152 -0.875 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.390 -2.109 -4.705 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.785 -1.129 -5.756 1.00 0.00 C ATOM 1005 C LEU A 62 -11.971 -1.874 -7.078 1.00 0.00 C ATOM 1006 O LEU A 62 -11.120 -2.633 -7.499 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.695 -0.062 -5.905 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.200 1.262 -5.324 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -11.247 1.163 -3.798 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -10.259 2.400 -5.735 1.00 0.00 C ATOM 0 H LEU A 62 -10.533 -2.628 -4.897 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.718 -0.639 -5.476 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.789 -0.377 -5.388 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.435 0.064 -6.956 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.200 1.467 -5.707 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.606 2.105 -3.383 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.921 0.357 -3.506 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.247 0.956 -3.416 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.622 3.340 -5.320 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.257 2.199 -5.356 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.228 2.472 -6.822 1.00 0.00 H new ATOM 1022 N THR A 63 -13.089 -1.681 -7.724 1.00 0.00 N ATOM 1023 CA THR A 63 -13.336 -2.402 -9.006 1.00 0.00 C ATOM 1024 C THR A 63 -14.161 -1.537 -9.961 1.00 0.00 C ATOM 1025 O THR A 63 -14.845 -0.618 -9.556 1.00 0.00 O ATOM 1026 CB THR A 63 -14.102 -3.692 -8.710 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.461 -4.319 -9.931 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.365 -3.363 -7.915 1.00 0.00 C ATOM 0 H THR A 63 -13.839 -1.059 -7.422 1.00 0.00 H new ATOM 0 HA THR A 63 -12.378 -2.627 -9.476 1.00 0.00 H new ATOM 0 HB THR A 63 -13.471 -4.364 -8.128 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.680 -4.357 -10.521 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.912 -4.282 -7.704 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.089 -2.881 -6.977 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.996 -2.691 -8.496 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.101 -1.840 -11.232 1.00 0.00 N ATOM 1037 CA HIS A 64 -14.880 -1.059 -12.234 1.00 0.00 C ATOM 1038 C HIS A 64 -16.242 -1.726 -12.457 1.00 0.00 C ATOM 1039 O HIS A 64 -17.056 -1.250 -13.225 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.115 -1.030 -13.561 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.119 0.096 -13.550 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -12.162 0.465 -12.638 1.00 0.00 N flip ATOM 1043 CD2 HIS A 64 -13.025 1.010 -14.588 1.00 0.00 C flip ATOM 1044 CE1 HIS A 64 -11.484 1.589 -13.099 1.00 0.00 C flip ATOM 1045 NE2 HIS A 64 -12.043 1.876 -14.278 1.00 0.00 N flip ATOM 0 H HIS A 64 -13.542 -2.600 -11.619 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.024 -0.043 -11.867 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.603 -1.979 -13.717 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.811 -0.904 -14.390 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -13.630 1.024 -15.483 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -10.679 2.116 -12.609 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.760 2.656 -14.871 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.496 -2.828 -11.797 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.801 -3.524 -11.975 1.00 0.00 C ATOM 1055 C GLN A 65 -18.854 -2.869 -11.080 1.00 0.00 C ATOM 1056 O GLN A 65 -18.554 -1.997 -10.288 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.651 -4.997 -11.589 1.00 0.00 C ATOM 1058 CG GLN A 65 -17.000 -5.764 -12.741 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.558 -5.286 -12.925 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.635 -5.705 -12.103 1.00 0.00 O flip ATOM 1061 NE2 GLN A 65 -15.269 -4.525 -13.826 1.00 0.00 N flip ATOM 0 H GLN A 65 -15.853 -3.274 -11.142 1.00 0.00 H new ATOM 0 HA GLN A 65 -18.112 -3.451 -13.017 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -17.043 -5.088 -10.689 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.627 -5.425 -11.359 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -17.016 -6.834 -12.534 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.565 -5.609 -13.660 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -15.991 -4.198 -14.468 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -14.305 -4.213 -13.941 1.00 0.00 H new ATOM 1070 N GLU A 66 -20.086 -3.284 -11.201 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.162 -2.688 -10.360 1.00 0.00 C ATOM 1072 C GLU A 66 -21.771 -3.761 -9.450 1.00 0.00 C ATOM 1073 O GLU A 66 -22.463 -3.454 -8.498 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.253 -2.114 -11.267 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.847 -0.860 -10.624 1.00 0.00 C ATOM 1076 CD GLU A 66 -23.299 0.109 -11.718 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -22.470 0.482 -12.532 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -24.468 0.461 -11.724 1.00 0.00 O ATOM 0 H GLU A 66 -20.394 -4.011 -11.847 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.738 -1.895 -9.744 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.837 -1.871 -12.245 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.034 -2.857 -11.429 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.692 -1.129 -9.990 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.107 -0.382 -9.983 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.531 -5.015 -9.735 1.00 0.00 N ATOM 1086 CA ASP A 67 -22.110 -6.095 -8.885 1.00 0.00 C ATOM 1087 C ASP A 67 -21.001 -6.794 -8.093 1.00 0.00 C ATOM 1088 O ASP A 67 -21.100 -7.963 -7.776 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.822 -7.116 -9.777 1.00 0.00 C ATOM 1090 CG ASP A 67 -24.205 -7.426 -9.200 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -25.028 -6.526 -9.170 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.417 -8.558 -8.797 1.00 0.00 O ATOM 0 H ASP A 67 -20.961 -5.336 -10.517 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.822 -5.656 -8.186 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -22.919 -6.724 -10.790 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.232 -8.030 -9.844 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.950 -6.090 -7.759 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.848 -6.723 -6.976 1.00 0.00 C ATOM 1099 C TYR A 68 -19.411 -7.232 -5.646 1.00 0.00 C ATOM 1100 O TYR A 68 -19.898 -6.466 -4.838 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.749 -5.691 -6.709 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.449 -6.402 -6.413 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.670 -6.902 -7.463 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -16.024 -6.563 -5.089 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.466 -7.563 -7.190 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.820 -7.224 -4.815 1.00 0.00 C ATOM 1107 CZ TYR A 68 -14.041 -7.723 -5.866 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.855 -8.374 -5.596 1.00 0.00 O ATOM 0 H TYR A 68 -19.808 -5.108 -7.994 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.426 -7.555 -7.539 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.630 -5.039 -7.574 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -18.028 -5.056 -5.868 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.998 -6.778 -8.485 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.625 -6.177 -4.279 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.866 -7.949 -8.001 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.493 -7.349 -3.793 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.708 -8.398 -4.627 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.356 -8.517 -5.416 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.897 -9.071 -4.142 1.00 0.00 C ATOM 1120 C GLN A 69 -18.749 -9.397 -3.184 1.00 0.00 C ATOM 1121 O GLN A 69 -18.012 -10.342 -3.383 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.690 -10.345 -4.438 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.936 -9.991 -5.254 1.00 0.00 C ATOM 1124 CD GLN A 69 -23.010 -9.423 -4.325 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.641 -10.155 -3.587 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.248 -8.140 -4.330 1.00 0.00 N ATOM 0 H GLN A 69 -18.960 -9.206 -6.055 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.550 -8.331 -3.679 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.070 -11.053 -4.989 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.978 -10.832 -3.506 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.684 -9.262 -6.024 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.313 -10.877 -5.764 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.719 -7.526 -4.949 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -23.963 -7.752 -3.715 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.601 -8.627 -2.140 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.509 -8.894 -1.161 1.00 0.00 C ATOM 1137 C ALA A 70 -18.036 -8.658 0.256 1.00 0.00 C ATOM 1138 O ALA A 70 -17.827 -7.612 0.839 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.332 -7.956 -1.434 1.00 0.00 C ATOM 0 H ALA A 70 -19.190 -7.823 -1.923 1.00 0.00 H new ATOM 0 HA ALA A 70 -17.174 -9.926 -1.260 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.535 -8.154 -0.717 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.960 -8.124 -2.445 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.661 -6.921 -1.335 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.725 -9.621 0.811 1.00 0.00 N ATOM 1146 CA GLN A 71 -19.271 -9.453 2.188 1.00 0.00 C ATOM 1147 C GLN A 71 -18.131 -9.530 3.202 1.00 0.00 C ATOM 1148 O GLN A 71 -17.268 -10.383 3.117 1.00 0.00 O ATOM 1149 CB GLN A 71 -20.285 -10.562 2.476 1.00 0.00 C ATOM 1150 CG GLN A 71 -21.573 -10.294 1.694 1.00 0.00 C ATOM 1151 CD GLN A 71 -21.614 -11.190 0.455 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -21.541 -10.710 -0.659 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -21.727 -12.481 0.603 1.00 0.00 N ATOM 0 H GLN A 71 -18.933 -10.516 0.369 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.762 -8.483 2.266 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.871 -11.530 2.194 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.498 -10.606 3.544 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -22.441 -10.488 2.325 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -21.621 -9.246 1.399 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -21.788 -12.884 1.538 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -21.754 -13.088 -0.216 1.00 0.00 H new ATOM 1162 N GLY A 72 -18.118 -8.642 4.158 1.00 0.00 N ATOM 1163 CA GLY A 72 -17.032 -8.656 5.176 1.00 0.00 C ATOM 1164 C GLY A 72 -16.058 -7.517 4.882 1.00 0.00 C ATOM 1165 O GLY A 72 -15.535 -6.887 5.780 1.00 0.00 O ATOM 0 H GLY A 72 -18.814 -7.906 4.277 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.452 -8.543 6.176 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.510 -9.612 5.156 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.811 -7.249 3.627 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.871 -6.152 3.270 1.00 0.00 C ATOM 1171 C ALA A 73 -15.625 -5.044 2.531 1.00 0.00 C ATOM 1172 O ALA A 73 -16.544 -5.295 1.776 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.764 -6.705 2.369 1.00 0.00 C ATOM 0 H ALA A 73 -16.221 -7.744 2.835 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.432 -5.742 4.180 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.074 -5.903 2.106 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -13.223 -7.490 2.897 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.205 -7.116 1.461 1.00 0.00 H new ATOM 1179 N VAL A 74 -15.229 -3.820 2.744 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.909 -2.679 2.061 1.00 0.00 C ATOM 1181 C VAL A 74 -15.824 -2.886 0.547 1.00 0.00 C ATOM 1182 O VAL A 74 -14.985 -3.621 0.064 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.214 -1.368 2.433 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.072 -0.185 1.983 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.015 -1.307 3.949 1.00 0.00 C ATOM 0 H VAL A 74 -14.462 -3.558 3.363 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.952 -2.633 2.373 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.245 -1.320 1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.574 0.748 2.249 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.211 -0.226 0.903 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.043 -0.232 2.476 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.520 -0.373 4.214 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -15.984 -1.357 4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.399 -2.147 4.269 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.678 -2.247 -0.210 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.637 -2.413 -1.691 1.00 0.00 C ATOM 1197 C VAL A 75 -17.029 -1.086 -2.341 1.00 0.00 C ATOM 1198 O VAL A 75 -18.050 -0.509 -2.020 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.632 -3.497 -2.112 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.523 -3.737 -3.619 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -17.319 -4.796 -1.367 1.00 0.00 C ATOM 0 H VAL A 75 -17.402 -1.617 0.135 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.635 -2.704 -2.006 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.643 -3.172 -1.868 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.232 -4.509 -3.917 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.748 -2.813 -4.152 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.511 -4.060 -3.864 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.028 -5.568 -1.667 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.307 -5.119 -1.609 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.399 -4.628 -0.293 1.00 0.00 H new ATOM 1211 N VAL A 76 -16.231 -0.590 -3.248 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.569 0.705 -3.905 1.00 0.00 C ATOM 1213 C VAL A 76 -16.124 0.676 -5.368 1.00 0.00 C ATOM 1214 O VAL A 76 -15.316 -0.141 -5.768 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.852 1.848 -3.181 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.460 2.036 -1.789 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.360 1.518 -3.047 1.00 0.00 C ATOM 0 H VAL A 76 -15.363 -1.024 -3.561 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.647 0.859 -3.858 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.969 2.767 -3.755 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.948 2.850 -1.275 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.519 2.276 -1.884 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.346 1.116 -1.215 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.852 2.333 -2.531 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.241 0.597 -2.476 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.925 1.389 -4.038 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.650 1.563 -6.169 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.266 1.600 -7.609 1.00 0.00 C ATOM 1229 C HIS A 77 -16.028 3.053 -8.019 1.00 0.00 C ATOM 1230 O HIS A 77 -16.235 3.428 -9.157 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.396 1.020 -8.469 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.986 -0.193 -7.801 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.199 -1.175 -7.224 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -19.285 -0.596 -7.615 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -18.023 -2.114 -6.724 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -19.306 -1.810 -6.935 1.00 0.00 N ATOM 0 H HIS A 77 -17.332 2.267 -5.886 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.362 1.009 -7.757 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.170 1.773 -8.622 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -17.013 0.752 -9.454 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.180 -1.185 -7.185 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.158 -0.053 -7.946 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.688 -3.005 -6.214 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.594 3.876 -7.100 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.344 5.304 -7.439 1.00 0.00 C ATOM 1246 C ASP A 78 -14.554 5.971 -6.311 1.00 0.00 C ATOM 1247 O ASP A 78 -15.052 6.147 -5.217 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.679 6.028 -7.623 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.523 7.124 -8.679 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -15.878 8.117 -8.383 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.051 6.952 -9.765 1.00 0.00 O ATOM 0 H ASP A 78 -15.403 3.619 -6.132 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.770 5.359 -8.364 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.450 5.320 -7.929 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -17.003 6.463 -6.677 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.321 6.324 -6.568 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.473 6.975 -5.520 1.00 0.00 C ATOM 1258 C VAL A 79 -13.296 8.000 -4.724 1.00 0.00 C ATOM 1259 O VAL A 79 -13.084 8.196 -3.543 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.301 7.688 -6.204 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.517 8.502 -5.173 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.376 6.649 -6.844 1.00 0.00 C ATOM 0 H VAL A 79 -12.859 6.188 -7.467 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.104 6.213 -4.833 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.686 8.358 -6.973 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.685 9.007 -5.664 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.174 9.244 -4.719 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.132 7.836 -4.400 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.542 7.155 -7.331 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.994 5.979 -6.074 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.932 6.073 -7.583 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.230 8.652 -5.363 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.065 9.660 -4.647 1.00 0.00 C ATOM 1274 C ALA A 80 -15.795 8.993 -3.476 1.00 0.00 C ATOM 1275 O ALA A 80 -15.887 9.543 -2.395 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.088 10.254 -5.619 1.00 0.00 C ATOM 0 H ALA A 80 -14.451 8.530 -6.351 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.424 10.453 -4.262 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.699 10.991 -5.098 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.567 10.735 -6.447 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.727 9.460 -6.005 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.318 7.815 -3.687 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.048 7.110 -2.595 1.00 0.00 C ATOM 1284 C ALA A 81 -16.082 6.751 -1.464 1.00 0.00 C ATOM 1285 O ALA A 81 -16.370 6.962 -0.302 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.677 5.830 -3.148 1.00 0.00 C ATOM 0 H ALA A 81 -16.271 7.309 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.826 7.766 -2.206 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.211 5.313 -2.351 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.374 6.083 -3.947 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.895 5.180 -3.541 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.940 6.202 -1.789 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.962 5.822 -0.723 1.00 0.00 C ATOM 1294 C VAL A 82 -13.605 7.052 0.115 1.00 0.00 C ATOM 1295 O VAL A 82 -13.513 6.984 1.325 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.686 5.261 -1.360 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.844 4.564 -0.286 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -13.049 4.254 -2.456 1.00 0.00 C ATOM 0 H VAL A 82 -14.642 6.000 -2.743 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.414 5.063 -0.085 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.116 6.079 -1.800 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.936 4.165 -0.738 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.578 5.282 0.490 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.419 3.749 0.155 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.137 3.860 -2.904 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.624 3.436 -2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.645 4.749 -3.222 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.394 8.174 -0.520 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.036 9.408 0.238 1.00 0.00 C ATOM 1310 C PHE A 83 -14.142 9.740 1.243 1.00 0.00 C ATOM 1311 O PHE A 83 -13.884 10.253 2.315 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.868 10.574 -0.738 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.428 10.658 -1.184 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.429 10.978 -0.259 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.091 10.419 -2.521 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.095 11.059 -0.669 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.755 10.499 -2.930 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.758 10.820 -2.005 1.00 0.00 C ATOM 0 H PHE A 83 -13.454 8.289 -1.532 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.102 9.242 0.774 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.519 10.436 -1.601 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.166 11.507 -0.260 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.688 11.163 0.773 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.861 10.173 -3.237 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.324 11.306 0.046 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.494 10.312 -3.961 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.727 10.883 -2.322 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.370 9.455 0.906 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.492 9.758 1.842 1.00 0.00 C ATOM 1330 C ALA A 84 -16.331 8.941 3.128 1.00 0.00 C ATOM 1331 O ALA A 84 -16.316 9.481 4.217 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.823 9.402 1.176 1.00 0.00 C ATOM 0 H ALA A 84 -15.646 9.025 0.023 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.478 10.820 2.087 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.643 9.623 1.860 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.942 9.988 0.265 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.834 8.341 0.928 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.238 7.640 3.010 1.00 0.00 N ATOM 1339 CA TYR A 85 -16.103 6.767 4.219 1.00 0.00 C ATOM 1340 C TYR A 85 -15.051 7.324 5.186 1.00 0.00 C ATOM 1341 O TYR A 85 -15.320 7.527 6.354 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.684 5.364 3.777 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.207 4.347 4.762 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.584 4.108 4.856 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.317 3.641 5.580 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -18.070 3.164 5.769 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.803 2.696 6.492 1.00 0.00 C ATOM 1348 CZ TYR A 85 -17.180 2.458 6.587 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.659 1.527 7.486 1.00 0.00 O ATOM 0 H TYR A 85 -16.250 7.140 2.121 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.063 6.735 4.733 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.073 5.154 2.781 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.598 5.300 3.715 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.271 4.652 4.224 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.255 3.825 5.508 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -19.132 2.981 5.842 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -15.116 2.151 7.122 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.627 1.900 8.392 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.856 7.567 4.715 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.788 8.102 5.613 1.00 0.00 C ATOM 1361 C ALA A 86 -13.286 9.363 6.325 1.00 0.00 C ATOM 1362 O ALA A 86 -13.112 9.524 7.518 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.551 8.443 4.780 1.00 0.00 C ATOM 0 H ALA A 86 -13.572 7.418 3.747 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.535 7.348 6.358 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.770 8.834 5.432 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.190 7.544 4.280 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.810 9.194 4.034 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.909 10.253 5.603 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.422 11.503 6.231 1.00 0.00 C ATOM 1371 C LYS A 87 -15.500 11.161 7.265 1.00 0.00 C ATOM 1372 O LYS A 87 -15.750 11.915 8.185 1.00 0.00 O ATOM 1373 CB LYS A 87 -15.027 12.399 5.148 1.00 0.00 C ATOM 1374 CG LYS A 87 -15.206 13.816 5.695 1.00 0.00 C ATOM 1375 CD LYS A 87 -13.982 14.660 5.335 1.00 0.00 C ATOM 1376 CE LYS A 87 -14.420 16.096 5.038 1.00 0.00 C ATOM 1377 NZ LYS A 87 -13.249 16.892 4.566 1.00 0.00 N ATOM 0 H LYS A 87 -14.085 10.168 4.602 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.601 12.022 6.726 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.379 12.416 4.272 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.988 11.999 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -16.107 14.267 5.279 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.335 13.786 6.777 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.266 14.650 6.157 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.477 14.236 4.467 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.203 16.098 4.280 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.843 16.550 5.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.550 17.867 4.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.516 16.901 5.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.864 16.463 3.700 1.00 0.00 H new ATOM 1391 N GLN A 88 -16.157 10.043 7.105 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.238 9.669 8.062 1.00 0.00 C ATOM 1393 C GLN A 88 -16.670 8.888 9.253 1.00 0.00 C ATOM 1394 O GLN A 88 -17.148 9.021 10.363 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.277 8.810 7.340 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.207 9.713 6.528 1.00 0.00 C ATOM 1397 CD GLN A 88 -19.976 8.871 5.508 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -19.323 8.279 4.547 1.00 0.00 O flip ATOM 1399 NE2 GLN A 88 -21.182 8.753 5.587 1.00 0.00 N flip ATOM 0 H GLN A 88 -15.992 9.373 6.354 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.701 10.582 8.437 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.781 8.095 6.683 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.853 8.232 8.063 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -19.904 10.225 7.191 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -18.629 10.483 6.017 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.692 9.217 6.339 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -21.685 8.190 4.901 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.677 8.060 9.045 1.00 0.00 N ATOM 1409 CA HIS A 89 -15.121 7.267 10.182 1.00 0.00 C ATOM 1410 C HIS A 89 -14.001 8.050 10.885 1.00 0.00 C ATOM 1411 O HIS A 89 -12.970 8.307 10.294 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.546 5.955 9.641 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.600 4.883 9.689 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -15.559 3.849 10.610 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.727 4.670 8.935 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.632 3.068 10.390 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -17.378 3.524 9.380 1.00 0.00 N ATOM 0 H HIS A 89 -15.230 7.900 8.142 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.918 7.067 10.898 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.200 6.093 8.617 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.681 5.655 10.232 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.845 3.706 11.325 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -17.058 5.297 8.120 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.862 2.180 10.960 1.00 0.00 H new ATOM 1425 N PRO A 90 -14.229 8.394 12.133 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.280 9.146 13.024 1.00 0.00 C ATOM 1427 C PRO A 90 -12.305 8.176 13.708 1.00 0.00 C ATOM 1428 O PRO A 90 -11.543 8.560 14.574 1.00 0.00 O ATOM 1429 CB PRO A 90 -14.147 9.837 14.070 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.500 9.150 14.055 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.476 8.120 12.928 1.00 0.00 C ATOM 0 HA PRO A 90 -12.684 9.861 12.456 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.690 9.765 15.057 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.252 10.898 13.843 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.696 8.667 15.012 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.297 9.876 13.895 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.467 7.106 13.328 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.364 8.208 12.302 1.00 0.00 H new ATOM 1439 N ASP A 91 -12.321 6.924 13.325 1.00 0.00 N ATOM 1440 CA ASP A 91 -11.393 5.934 13.950 1.00 0.00 C ATOM 1441 C ASP A 91 -10.749 5.072 12.857 1.00 0.00 C ATOM 1442 O ASP A 91 -10.066 4.106 13.134 1.00 0.00 O ATOM 1443 CB ASP A 91 -12.178 5.037 14.913 1.00 0.00 C ATOM 1444 CG ASP A 91 -11.805 5.382 16.356 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -12.428 6.271 16.912 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -10.902 4.750 16.880 1.00 0.00 O ATOM 0 H ASP A 91 -12.937 6.545 12.606 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.614 6.463 14.499 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.249 5.173 14.761 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.958 3.989 14.711 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.958 5.424 11.617 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.365 4.650 10.494 1.00 0.00 C ATOM 1453 C GLN A 92 -10.042 5.631 9.370 1.00 0.00 C ATOM 1454 O GLN A 92 -10.936 6.147 8.728 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.386 3.619 9.994 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.739 2.232 9.920 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.502 1.260 10.822 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -12.672 0.820 10.444 1.00 0.00 O flip ATOM 1459 NE2 GLN A 92 -11.031 0.898 11.882 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.522 6.225 11.333 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.464 4.130 10.819 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.246 3.593 10.663 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -11.756 3.909 9.011 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.746 1.871 8.892 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.696 2.289 10.231 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -10.117 1.241 12.178 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -11.549 0.251 12.476 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.790 5.913 9.117 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.462 6.877 8.034 1.00 0.00 C ATOM 1470 C GLU A 93 -8.402 6.147 6.693 1.00 0.00 C ATOM 1471 O GLU A 93 -8.845 5.021 6.568 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.107 7.524 8.334 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.315 8.741 9.238 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.009 9.530 9.342 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -5.499 9.933 8.310 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -5.541 9.719 10.453 1.00 0.00 O ATOM 0 H GLU A 93 -7.989 5.519 9.611 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.232 7.647 7.983 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.448 6.805 8.820 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.622 7.825 7.406 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.104 9.376 8.835 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -7.638 8.420 10.228 1.00 0.00 H new ATOM 1483 N LEU A 94 -7.861 6.786 5.692 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.769 6.146 4.351 1.00 0.00 C ATOM 1485 C LEU A 94 -6.324 5.715 4.075 1.00 0.00 C ATOM 1486 O LEU A 94 -5.420 6.527 4.042 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.220 7.151 3.289 1.00 0.00 C ATOM 1488 CG LEU A 94 -8.837 6.408 2.106 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.311 6.122 2.398 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -8.726 7.275 0.851 1.00 0.00 C ATOM 0 H LEU A 94 -7.477 7.729 5.747 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.410 5.265 4.322 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.946 7.843 3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.371 7.746 2.954 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.308 5.468 1.949 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.753 5.592 1.554 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.392 5.508 3.295 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.840 7.062 2.553 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.166 6.748 0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.257 8.214 1.009 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.676 7.482 0.644 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.105 4.442 3.862 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.725 3.952 3.564 1.00 0.00 C ATOM 1504 C VAL A 95 -4.741 3.296 2.184 1.00 0.00 C ATOM 1505 O VAL A 95 -5.572 2.457 1.899 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.284 2.928 4.615 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.840 2.501 4.337 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.366 3.556 6.008 1.00 0.00 C ATOM 0 H VAL A 95 -6.824 3.719 3.882 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.024 4.787 3.583 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.939 2.058 4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.526 1.773 5.084 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.778 2.053 3.345 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.187 3.373 4.383 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.052 2.827 6.755 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.712 4.427 6.054 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.393 3.862 6.209 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.864 3.704 1.310 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.865 3.130 -0.066 1.00 0.00 C ATOM 1520 C ILE A 96 -2.831 2.016 -0.203 1.00 0.00 C ATOM 1521 O ILE A 96 -1.652 2.271 -0.334 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.522 4.226 -1.076 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -4.364 5.477 -0.803 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.797 3.722 -2.494 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.848 5.107 -0.780 1.00 0.00 C ATOM 0 H ILE A 96 -3.148 4.408 1.487 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.857 2.721 -0.256 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.467 4.480 -0.978 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.075 5.920 0.150 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.178 6.227 -1.572 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.552 4.504 -3.212 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -3.185 2.842 -2.693 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.851 3.459 -2.589 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.443 6.000 -0.586 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -6.133 4.684 -1.744 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.028 4.373 0.006 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.252 0.782 -0.163 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.276 -0.336 -0.285 1.00 0.00 C ATOM 1539 C ALA A 97 -2.030 -0.644 -1.770 1.00 0.00 C ATOM 1540 O ALA A 97 -1.312 -1.563 -2.110 1.00 0.00 O ATOM 1541 CB ALA A 97 -2.843 -1.577 0.408 1.00 0.00 C ATOM 0 H ALA A 97 -4.226 0.501 -0.052 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.334 -0.052 0.185 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.132 -2.399 0.322 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.018 -1.358 1.461 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.784 -1.860 -0.065 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.591 0.145 -2.656 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.358 -0.074 -4.115 1.00 0.00 C ATOM 1549 C GLY A 98 -3.487 -0.916 -4.721 1.00 0.00 C ATOM 1550 O GLY A 98 -4.603 -0.893 -4.245 1.00 0.00 O ATOM 0 H GLY A 98 -3.200 0.931 -2.429 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.298 0.886 -4.627 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.402 -0.576 -4.265 1.00 0.00 H new ATOM 1554 N GLY A 99 -3.222 -1.643 -5.788 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.850 -1.681 -6.387 1.00 0.00 C ATOM 1556 C GLY A 99 -1.483 -0.350 -7.062 1.00 0.00 C ATOM 1557 O GLY A 99 -1.832 0.721 -6.606 1.00 0.00 O ATOM 0 H GLY A 99 -3.911 -2.218 -6.273 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.120 -1.907 -5.609 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.796 -2.487 -7.119 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.771 -0.424 -8.158 1.00 0.00 N ATOM 1562 CA ALA A 100 -0.344 0.814 -8.877 1.00 0.00 C ATOM 1563 C ALA A 100 -1.562 1.617 -9.329 1.00 0.00 C ATOM 1564 O ALA A 100 -1.592 2.827 -9.215 1.00 0.00 O ATOM 1565 CB ALA A 100 0.489 0.424 -10.102 1.00 0.00 C ATOM 0 H ALA A 100 -0.465 -1.297 -8.589 1.00 0.00 H new ATOM 0 HA ALA A 100 0.250 1.428 -8.200 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.803 1.324 -10.630 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.369 -0.134 -9.781 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.111 -0.196 -10.768 1.00 0.00 H new ATOM 1571 N GLN A 101 -2.553 0.964 -9.863 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.755 1.701 -10.345 1.00 0.00 C ATOM 1573 C GLN A 101 -4.339 2.553 -9.213 1.00 0.00 C ATOM 1574 O GLN A 101 -4.798 3.662 -9.437 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.808 0.697 -10.825 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.922 0.758 -12.351 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.021 -0.662 -12.914 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -6.063 -1.068 -13.389 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -3.973 -1.438 -12.881 1.00 0.00 N ATOM 0 H GLN A 101 -2.584 -0.048 -9.987 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.467 2.354 -11.169 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -4.534 -0.310 -10.511 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.773 0.921 -10.369 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -5.801 1.336 -12.638 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.054 1.267 -12.771 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -3.098 -1.097 -12.482 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -4.028 -2.386 -13.254 1.00 0.00 H new ATOM 1588 N ILE A 102 -4.352 2.053 -8.003 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.942 2.847 -6.889 1.00 0.00 C ATOM 1590 C ILE A 102 -3.969 3.940 -6.441 1.00 0.00 C ATOM 1591 O ILE A 102 -4.376 4.940 -5.886 1.00 0.00 O ATOM 1592 CB ILE A 102 -5.258 1.923 -5.707 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.994 0.668 -6.204 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -6.142 2.667 -4.700 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -7.305 1.061 -6.893 1.00 0.00 C ATOM 0 H ILE A 102 -3.983 1.139 -7.742 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.861 3.316 -7.241 1.00 0.00 H new ATOM 0 HB ILE A 102 -4.326 1.625 -5.227 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.360 0.117 -6.899 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.201 0.003 -5.366 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.367 2.011 -3.859 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.617 3.552 -4.339 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -7.071 2.968 -5.184 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.817 0.163 -7.240 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.943 1.592 -6.186 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -7.089 1.708 -7.743 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.692 3.777 -6.666 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.731 4.835 -6.238 1.00 0.00 C ATOM 1609 C PHE A 103 -1.846 6.039 -7.179 1.00 0.00 C ATOM 1610 O PHE A 103 -1.510 7.153 -6.823 1.00 0.00 O ATOM 1611 CB PHE A 103 -0.300 4.292 -6.309 1.00 0.00 C ATOM 1612 CG PHE A 103 -0.044 3.322 -5.179 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.423 3.645 -3.871 1.00 0.00 C ATOM 1614 CD2 PHE A 103 0.587 2.099 -5.443 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.173 2.745 -2.829 1.00 0.00 C ATOM 1616 CE2 PHE A 103 0.838 1.200 -4.400 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.458 1.523 -3.093 1.00 0.00 C ATOM 0 H PHE A 103 -2.276 2.966 -7.123 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.963 5.135 -5.216 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -0.141 3.795 -7.266 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.411 5.117 -6.256 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.908 4.588 -3.666 1.00 0.00 H new ATOM 0 HD2 PHE A 103 0.880 1.850 -6.452 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.467 2.993 -1.820 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.325 0.258 -4.604 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.651 0.830 -2.288 1.00 0.00 H new ATOM 1627 N THR A 104 -2.306 5.822 -8.383 1.00 0.00 N ATOM 1628 CA THR A 104 -2.426 6.948 -9.352 1.00 0.00 C ATOM 1629 C THR A 104 -3.678 7.770 -9.051 1.00 0.00 C ATOM 1630 O THR A 104 -3.622 8.979 -8.936 1.00 0.00 O ATOM 1631 CB THR A 104 -2.522 6.386 -10.773 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.705 5.226 -10.885 1.00 0.00 O ATOM 1633 CG2 THR A 104 -2.053 7.444 -11.773 1.00 0.00 C ATOM 0 H THR A 104 -2.604 4.913 -8.736 1.00 0.00 H new ATOM 0 HA THR A 104 -1.548 7.588 -9.263 1.00 0.00 H new ATOM 0 HB THR A 104 -3.557 6.119 -10.988 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.769 4.867 -11.795 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.121 7.044 -12.785 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.684 8.329 -11.689 1.00 0.00 H new ATOM 0 HG23 THR A 104 -1.019 7.714 -11.559 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.811 7.131 -8.934 1.00 0.00 N ATOM 1642 CA ALA A 105 -6.066 7.891 -8.655 1.00 0.00 C ATOM 1643 C ALA A 105 -5.945 8.635 -7.322 1.00 0.00 C ATOM 1644 O ALA A 105 -6.565 9.660 -7.118 1.00 0.00 O ATOM 1645 CB ALA A 105 -7.247 6.920 -8.583 1.00 0.00 C ATOM 0 H ALA A 105 -4.923 6.121 -9.019 1.00 0.00 H new ATOM 0 HA ALA A 105 -6.228 8.612 -9.456 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -8.163 7.475 -8.379 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.345 6.395 -9.533 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.076 6.197 -7.785 1.00 0.00 H new ATOM 1651 N PHE A 106 -5.176 8.115 -6.405 1.00 0.00 N ATOM 1652 CA PHE A 106 -5.042 8.781 -5.076 1.00 0.00 C ATOM 1653 C PHE A 106 -3.766 9.634 -5.013 1.00 0.00 C ATOM 1654 O PHE A 106 -3.507 10.288 -4.021 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.978 7.711 -3.986 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.348 7.112 -3.774 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.824 6.122 -4.641 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.137 7.540 -2.704 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -8.089 5.563 -4.436 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.400 6.980 -2.497 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.877 5.991 -3.364 1.00 0.00 C ATOM 0 H PHE A 106 -4.634 7.258 -6.517 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.904 9.431 -4.926 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.271 6.932 -4.270 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.614 8.148 -3.056 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.214 5.790 -5.468 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.770 8.305 -2.036 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.457 4.800 -5.106 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.008 7.310 -1.668 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.854 5.558 -3.205 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.950 9.619 -6.036 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.688 10.418 -5.989 1.00 0.00 C ATOM 1673 C LYS A 107 -1.972 11.900 -5.674 1.00 0.00 C ATOM 1674 O LYS A 107 -1.246 12.519 -4.924 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.943 10.288 -7.327 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.723 10.971 -8.457 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.964 12.218 -8.924 1.00 0.00 C ATOM 1678 CE LYS A 107 -1.948 13.367 -9.159 1.00 0.00 C ATOM 1679 NZ LYS A 107 -2.881 13.013 -10.267 1.00 0.00 N ATOM 0 H LYS A 107 -3.101 9.092 -6.896 1.00 0.00 H new ATOM 0 HA LYS A 107 -1.063 10.025 -5.187 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.047 10.735 -7.241 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.797 9.234 -7.566 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.856 10.281 -9.290 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.719 11.247 -8.110 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.226 12.507 -8.176 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.419 12.000 -9.842 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.511 13.568 -8.248 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.404 14.279 -9.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -3.433 13.852 -10.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -2.335 12.679 -11.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -3.526 12.261 -9.951 1.00 0.00 H new ATOM 1693 N ASP A 108 -3.001 12.485 -6.234 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.283 13.928 -5.955 1.00 0.00 C ATOM 1695 C ASP A 108 -3.714 14.122 -4.498 1.00 0.00 C ATOM 1696 O ASP A 108 -3.380 15.108 -3.870 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.402 14.412 -6.880 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.154 15.872 -7.263 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.099 16.149 -7.810 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -5.023 16.688 -7.003 1.00 0.00 O ATOM 0 H ASP A 108 -3.656 12.029 -6.870 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.374 14.503 -6.132 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.441 13.792 -7.776 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.367 14.315 -6.382 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.462 13.200 -3.962 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.930 13.331 -2.551 1.00 0.00 C ATOM 1707 C ASP A 109 -4.067 12.450 -1.648 1.00 0.00 C ATOM 1708 O ASP A 109 -4.385 11.302 -1.405 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.391 12.888 -2.458 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.306 14.107 -2.594 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -7.250 14.753 -3.627 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -8.047 14.373 -1.662 1.00 0.00 O ATOM 0 H ASP A 109 -4.772 12.355 -4.442 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.846 14.370 -2.231 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.613 12.165 -3.243 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.571 12.390 -1.505 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.974 12.972 -1.151 1.00 0.00 N ATOM 1718 CA VAL A 110 -2.094 12.156 -0.264 1.00 0.00 C ATOM 1719 C VAL A 110 -1.921 12.862 1.084 1.00 0.00 C ATOM 1720 O VAL A 110 -1.905 14.075 1.163 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.719 11.994 -0.913 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.139 11.067 -0.052 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.870 11.399 -2.317 1.00 0.00 C ATOM 0 H VAL A 110 -2.655 13.926 -1.321 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.552 11.178 -0.114 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.240 12.970 -0.991 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.120 10.949 -0.511 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.253 11.497 0.943 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.344 10.093 0.027 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.114 11.287 -2.772 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.352 10.424 -2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.480 12.063 -2.930 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.791 12.109 2.144 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.613 12.727 3.490 1.00 0.00 C ATOM 1735 C ASP A 111 -0.406 12.086 4.189 1.00 0.00 C ATOM 1736 O ASP A 111 0.316 12.736 4.921 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.875 12.498 4.329 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.295 13.810 4.995 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -3.950 14.602 4.337 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -2.954 14.002 6.150 1.00 0.00 O ATOM 0 H ASP A 111 -1.801 11.089 2.135 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.442 13.798 3.380 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.681 12.125 3.697 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.687 11.738 5.087 1.00 0.00 H new ATOM 1745 N THR A 112 -0.186 10.813 3.971 1.00 0.00 N ATOM 1746 CA THR A 112 0.969 10.126 4.622 1.00 0.00 C ATOM 1747 C THR A 112 1.575 9.102 3.654 1.00 0.00 C ATOM 1748 O THR A 112 0.870 8.389 2.968 1.00 0.00 O ATOM 1749 CB THR A 112 0.489 9.410 5.887 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.330 10.289 6.645 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.694 8.981 6.726 1.00 0.00 C ATOM 0 H THR A 112 -0.758 10.220 3.369 1.00 0.00 H new ATOM 0 HA THR A 112 1.726 10.865 4.885 1.00 0.00 H new ATOM 0 HB THR A 112 -0.086 8.527 5.607 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.639 9.831 7.455 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.348 8.472 7.626 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.320 8.305 6.144 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.273 9.860 7.007 1.00 0.00 H new ATOM 1759 N LEU A 113 2.879 9.027 3.594 1.00 0.00 N ATOM 1760 CA LEU A 113 3.530 8.052 2.668 1.00 0.00 C ATOM 1761 C LEU A 113 4.352 7.036 3.465 1.00 0.00 C ATOM 1762 O LEU A 113 5.166 7.394 4.293 1.00 0.00 O ATOM 1763 CB LEU A 113 4.450 8.797 1.698 1.00 0.00 C ATOM 1764 CG LEU A 113 3.653 9.869 0.953 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.591 10.997 0.520 1.00 0.00 C ATOM 1766 CD2 LEU A 113 3.003 9.248 -0.285 1.00 0.00 C ATOM 0 H LEU A 113 3.521 9.597 4.145 1.00 0.00 H new ATOM 0 HA LEU A 113 2.755 7.527 2.109 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.274 9.256 2.244 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.889 8.097 0.987 1.00 0.00 H new ATOM 0 HG LEU A 113 2.882 10.270 1.611 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.022 11.760 -0.011 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.059 11.439 1.400 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.362 10.597 -0.138 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.434 10.010 -0.818 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.777 8.848 -0.940 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.334 8.443 0.020 1.00 0.00 H new ATOM 1778 N LEU A 114 4.154 5.768 3.206 1.00 0.00 N ATOM 1779 CA LEU A 114 4.926 4.716 3.929 1.00 0.00 C ATOM 1780 C LEU A 114 5.621 3.821 2.895 1.00 0.00 C ATOM 1781 O LEU A 114 4.985 3.089 2.162 1.00 0.00 O ATOM 1782 CB LEU A 114 3.973 3.881 4.788 1.00 0.00 C ATOM 1783 CG LEU A 114 3.170 4.808 5.704 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.807 4.184 6.003 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.933 5.014 7.014 1.00 0.00 C ATOM 0 H LEU A 114 3.486 5.416 2.520 1.00 0.00 H new ATOM 0 HA LEU A 114 5.672 5.176 4.578 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.299 3.308 4.151 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.537 3.163 5.383 1.00 0.00 H new ATOM 0 HG LEU A 114 3.026 5.768 5.209 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.239 4.847 6.655 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.262 4.037 5.071 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.947 3.222 6.497 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.362 5.674 7.667 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.077 4.052 7.506 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.904 5.463 6.803 1.00 0.00 H new ATOM 1797 N VAL A 115 6.921 3.907 2.814 1.00 0.00 N ATOM 1798 CA VAL A 115 7.656 3.089 1.801 1.00 0.00 C ATOM 1799 C VAL A 115 8.774 2.260 2.444 1.00 0.00 C ATOM 1800 O VAL A 115 9.486 2.716 3.317 1.00 0.00 O ATOM 1801 CB VAL A 115 8.252 4.023 0.744 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.305 4.930 1.383 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.898 3.191 -0.367 1.00 0.00 C ATOM 0 H VAL A 115 7.505 4.504 3.400 1.00 0.00 H new ATOM 0 HA VAL A 115 6.951 2.395 1.343 1.00 0.00 H new ATOM 0 HB VAL A 115 7.458 4.640 0.323 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.724 5.591 0.625 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.842 5.527 2.169 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.100 4.319 1.811 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.322 3.856 -1.119 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.688 2.570 0.056 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.144 2.554 -0.829 1.00 0.00 H new ATOM 1813 N THR A 116 8.940 1.044 1.984 1.00 0.00 N ATOM 1814 CA THR A 116 10.019 0.166 2.524 1.00 0.00 C ATOM 1815 C THR A 116 11.093 -0.007 1.444 1.00 0.00 C ATOM 1816 O THR A 116 10.876 -0.669 0.448 1.00 0.00 O ATOM 1817 CB THR A 116 9.445 -1.211 2.883 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.091 -1.080 3.295 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.267 -1.825 4.016 1.00 0.00 C ATOM 0 H THR A 116 8.369 0.621 1.252 1.00 0.00 H new ATOM 0 HA THR A 116 10.445 0.619 3.419 1.00 0.00 H new ATOM 0 HB THR A 116 9.490 -1.857 2.006 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.731 -1.963 3.521 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.860 -2.803 4.272 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.303 -1.935 3.695 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.225 -1.175 4.890 1.00 0.00 H new ATOM 1827 N ARG A 117 12.243 0.589 1.623 1.00 0.00 N ATOM 1828 CA ARG A 117 13.315 0.463 0.590 1.00 0.00 C ATOM 1829 C ARG A 117 14.288 -0.658 0.969 1.00 0.00 C ATOM 1830 O ARG A 117 14.938 -0.612 1.995 1.00 0.00 O ATOM 1831 CB ARG A 117 14.078 1.786 0.483 1.00 0.00 C ATOM 1832 CG ARG A 117 13.163 2.857 -0.122 1.00 0.00 C ATOM 1833 CD ARG A 117 13.713 3.307 -1.479 1.00 0.00 C ATOM 1834 NE ARG A 117 13.664 4.797 -1.564 1.00 0.00 N ATOM 1835 CZ ARG A 117 13.656 5.406 -2.726 1.00 0.00 C ATOM 1836 NH1 ARG A 117 13.700 4.726 -3.843 1.00 0.00 N ATOM 1837 NH2 ARG A 117 13.609 6.710 -2.767 1.00 0.00 N ATOM 0 H ARG A 117 12.486 1.155 2.436 1.00 0.00 H new ATOM 0 HA ARG A 117 12.856 0.224 -0.369 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.422 2.101 1.468 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.965 1.657 -0.138 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.155 2.461 -0.242 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.092 3.710 0.552 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.738 2.958 -1.602 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.127 2.866 -2.286 1.00 0.00 H new ATOM 0 HE ARG A 117 13.636 5.349 -0.707 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.741 3.707 -3.819 1.00 0.00 H new ATOM 0 HH12 ARG A 117 13.693 5.215 -4.738 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.579 7.247 -1.900 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.602 7.192 -3.666 1.00 0.00 H new ATOM 1851 N LEU A 118 14.398 -1.658 0.134 1.00 0.00 N ATOM 1852 CA LEU A 118 15.333 -2.784 0.423 1.00 0.00 C ATOM 1853 C LEU A 118 16.726 -2.438 -0.110 1.00 0.00 C ATOM 1854 O LEU A 118 16.878 -1.586 -0.963 1.00 0.00 O ATOM 1855 CB LEU A 118 14.832 -4.058 -0.262 1.00 0.00 C ATOM 1856 CG LEU A 118 13.490 -4.474 0.343 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.375 -3.607 -0.242 1.00 0.00 C ATOM 1858 CD2 LEU A 118 13.219 -5.945 0.014 1.00 0.00 C ATOM 0 H LEU A 118 13.878 -1.743 -0.739 1.00 0.00 H new ATOM 0 HA LEU A 118 15.381 -2.946 1.500 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.722 -3.888 -1.333 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.561 -4.859 -0.140 1.00 0.00 H new ATOM 0 HG LEU A 118 13.522 -4.342 1.424 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.419 -3.904 0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.568 -2.560 -0.010 1.00 0.00 H new ATOM 0 HD13 LEU A 118 12.341 -3.738 -1.324 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.263 -6.244 0.444 1.00 0.00 H new ATOM 0 HD22 LEU A 118 13.187 -6.076 -1.068 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.014 -6.564 0.431 1.00 0.00 H new ATOM 1870 N ALA A 119 17.742 -3.092 0.386 1.00 0.00 N ATOM 1871 CA ALA A 119 19.124 -2.799 -0.092 1.00 0.00 C ATOM 1872 C ALA A 119 19.427 -3.623 -1.348 1.00 0.00 C ATOM 1873 O ALA A 119 20.281 -3.270 -2.137 1.00 0.00 O ATOM 1874 CB ALA A 119 20.131 -3.151 1.005 1.00 0.00 C ATOM 0 H ALA A 119 17.675 -3.816 1.101 1.00 0.00 H new ATOM 0 HA ALA A 119 19.202 -1.739 -0.332 1.00 0.00 H new ATOM 0 HB1 ALA A 119 21.141 -2.936 0.655 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.922 -2.557 1.895 1.00 0.00 H new ATOM 0 HB3 ALA A 119 20.049 -4.210 1.248 1.00 0.00 H new ATOM 1880 N GLY A 120 18.739 -4.720 -1.541 1.00 0.00 N ATOM 1881 CA GLY A 120 18.996 -5.559 -2.748 1.00 0.00 C ATOM 1882 C GLY A 120 18.349 -4.909 -3.974 1.00 0.00 C ATOM 1883 O GLY A 120 17.617 -3.946 -3.861 1.00 0.00 O ATOM 0 H GLY A 120 18.013 -5.069 -0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 120 20.069 -5.668 -2.906 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.592 -6.561 -2.600 1.00 0.00 H new ATOM 1887 N SER A 121 18.614 -5.429 -5.144 1.00 0.00 N ATOM 1888 CA SER A 121 18.016 -4.841 -6.377 1.00 0.00 C ATOM 1889 C SER A 121 17.269 -5.926 -7.157 1.00 0.00 C ATOM 1890 O SER A 121 17.858 -6.871 -7.644 1.00 0.00 O ATOM 1891 CB SER A 121 19.126 -4.261 -7.253 1.00 0.00 C ATOM 1892 OG SER A 121 19.891 -5.323 -7.807 1.00 0.00 O ATOM 0 H SER A 121 19.219 -6.236 -5.298 1.00 0.00 H new ATOM 0 HA SER A 121 17.318 -4.051 -6.098 1.00 0.00 H new ATOM 0 HB2 SER A 121 18.696 -3.653 -8.049 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.766 -3.606 -6.662 1.00 0.00 H new ATOM 0 HG SER A 121 19.291 -6.042 -8.096 1.00 0.00 H new ATOM 1898 N PHE A 122 15.975 -5.797 -7.274 1.00 0.00 N ATOM 1899 CA PHE A 122 15.180 -6.818 -8.017 1.00 0.00 C ATOM 1900 C PHE A 122 14.650 -6.207 -9.317 1.00 0.00 C ATOM 1901 O PHE A 122 14.611 -5.002 -9.474 1.00 0.00 O ATOM 1902 CB PHE A 122 14.014 -7.288 -7.144 1.00 0.00 C ATOM 1903 CG PHE A 122 14.547 -7.716 -5.797 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.850 -6.753 -4.828 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.746 -9.074 -5.519 1.00 0.00 C ATOM 1906 CE1 PHE A 122 15.350 -7.145 -3.581 1.00 0.00 C ATOM 1907 CE2 PHE A 122 15.246 -9.468 -4.271 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.548 -8.502 -3.302 1.00 0.00 C ATOM 0 H PHE A 122 15.432 -5.026 -6.886 1.00 0.00 H new ATOM 0 HA PHE A 122 15.813 -7.672 -8.258 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.287 -6.485 -7.023 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.495 -8.118 -7.624 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.698 -5.706 -5.043 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.514 -9.818 -6.267 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.583 -6.400 -2.834 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.399 -10.515 -4.056 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.934 -8.805 -2.340 1.00 0.00 H new ATOM 1918 N GLU A 123 14.247 -7.028 -10.251 1.00 0.00 N ATOM 1919 CA GLU A 123 13.725 -6.493 -11.543 1.00 0.00 C ATOM 1920 C GLU A 123 12.218 -6.745 -11.648 1.00 0.00 C ATOM 1921 O GLU A 123 11.679 -7.633 -11.016 1.00 0.00 O ATOM 1922 CB GLU A 123 14.440 -7.181 -12.707 1.00 0.00 C ATOM 1923 CG GLU A 123 15.924 -6.802 -12.691 1.00 0.00 C ATOM 1924 CD GLU A 123 16.751 -7.987 -12.190 1.00 0.00 C ATOM 1925 OE1 GLU A 123 16.993 -8.889 -12.975 1.00 0.00 O ATOM 1926 OE2 GLU A 123 17.128 -7.973 -11.029 1.00 0.00 O ATOM 0 H GLU A 123 14.257 -8.045 -10.175 1.00 0.00 H new ATOM 0 HA GLU A 123 13.909 -5.419 -11.583 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.329 -8.262 -12.628 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.988 -6.883 -13.653 1.00 0.00 H new ATOM 0 HG2 GLU A 123 16.248 -6.517 -13.692 1.00 0.00 H new ATOM 0 HG3 GLU A 123 16.082 -5.937 -12.047 1.00 0.00 H new ATOM 1933 N GLY A 124 11.539 -5.966 -12.449 1.00 0.00 N ATOM 1934 CA GLY A 124 10.065 -6.142 -12.617 1.00 0.00 C ATOM 1935 C GLY A 124 9.579 -5.204 -13.725 1.00 0.00 C ATOM 1936 O GLY A 124 10.357 -4.751 -14.542 1.00 0.00 O ATOM 0 H GLY A 124 11.946 -5.209 -12.999 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.835 -7.177 -12.871 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.550 -5.921 -11.682 1.00 0.00 H new ATOM 1940 N ASP A 125 8.308 -4.897 -13.764 1.00 0.00 N ATOM 1941 CA ASP A 125 7.789 -3.975 -14.817 1.00 0.00 C ATOM 1942 C ASP A 125 6.778 -3.002 -14.187 1.00 0.00 C ATOM 1943 O ASP A 125 6.408 -2.007 -14.778 1.00 0.00 O ATOM 1944 CB ASP A 125 7.095 -4.788 -15.913 1.00 0.00 C ATOM 1945 CG ASP A 125 8.142 -5.562 -16.716 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.774 -6.433 -16.142 1.00 0.00 O ATOM 1947 OD2 ASP A 125 8.294 -5.270 -17.890 1.00 0.00 O ATOM 0 H ASP A 125 7.607 -5.246 -13.111 1.00 0.00 H new ATOM 0 HA ASP A 125 8.617 -3.415 -15.250 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.378 -5.479 -15.469 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.533 -4.125 -16.571 1.00 0.00 H new ATOM 1952 N THR A 126 6.333 -3.288 -12.988 1.00 0.00 N ATOM 1953 CA THR A 126 5.354 -2.394 -12.308 1.00 0.00 C ATOM 1954 C THR A 126 6.047 -1.702 -11.136 1.00 0.00 C ATOM 1955 O THR A 126 6.577 -2.346 -10.253 1.00 0.00 O ATOM 1956 CB THR A 126 4.179 -3.226 -11.786 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.709 -4.081 -12.818 1.00 0.00 O ATOM 1958 CG2 THR A 126 3.050 -2.297 -11.337 1.00 0.00 C ATOM 0 H THR A 126 6.610 -4.109 -12.450 1.00 0.00 H new ATOM 0 HA THR A 126 4.983 -1.649 -13.012 1.00 0.00 H new ATOM 0 HB THR A 126 4.509 -3.827 -10.939 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.958 -4.615 -12.484 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.215 -2.892 -10.966 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.411 -1.643 -10.543 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.718 -1.693 -12.182 1.00 0.00 H new ATOM 1966 N LYS A 127 6.062 -0.397 -11.125 1.00 0.00 N ATOM 1967 CA LYS A 127 6.738 0.326 -10.011 1.00 0.00 C ATOM 1968 C LYS A 127 5.797 1.383 -9.432 1.00 0.00 C ATOM 1969 O LYS A 127 4.789 1.723 -10.021 1.00 0.00 O ATOM 1970 CB LYS A 127 8.005 0.999 -10.541 1.00 0.00 C ATOM 1971 CG LYS A 127 8.912 -0.059 -11.176 1.00 0.00 C ATOM 1972 CD LYS A 127 9.882 0.611 -12.153 1.00 0.00 C ATOM 1973 CE LYS A 127 11.303 0.544 -11.590 1.00 0.00 C ATOM 1974 NZ LYS A 127 12.093 1.703 -12.094 1.00 0.00 N ATOM 0 H LYS A 127 5.637 0.198 -11.836 1.00 0.00 H new ATOM 0 HA LYS A 127 7.002 -0.383 -9.226 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.746 1.761 -11.276 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.529 1.504 -9.730 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.468 -0.587 -10.401 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.310 -0.802 -11.699 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.840 0.114 -13.122 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.592 1.649 -12.315 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.275 0.556 -10.500 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.779 -0.391 -11.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 13.059 1.657 -11.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 12.130 1.672 -13.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 11.642 2.589 -11.790 1.00 0.00 H new ATOM 1988 N MET A 128 6.124 1.907 -8.281 1.00 0.00 N ATOM 1989 CA MET A 128 5.254 2.941 -7.654 1.00 0.00 C ATOM 1990 C MET A 128 5.178 4.168 -8.565 1.00 0.00 C ATOM 1991 O MET A 128 6.061 4.418 -9.361 1.00 0.00 O ATOM 1992 CB MET A 128 5.845 3.345 -6.301 1.00 0.00 C ATOM 1993 CG MET A 128 4.712 3.634 -5.313 1.00 0.00 C ATOM 1994 SD MET A 128 4.436 5.420 -5.212 1.00 0.00 S ATOM 1995 CE MET A 128 2.843 5.351 -4.358 1.00 0.00 C ATOM 0 H MET A 128 6.958 1.662 -7.748 1.00 0.00 H new ATOM 0 HA MET A 128 4.252 2.536 -7.510 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.481 2.547 -5.918 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.475 4.227 -6.416 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.799 3.132 -5.634 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.964 3.238 -4.329 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.153 6.059 -4.817 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.433 4.344 -4.433 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.982 5.609 -3.308 1.00 0.00 H new ATOM 2005 N ILE A 129 4.123 4.929 -8.455 1.00 0.00 N ATOM 2006 CA ILE A 129 3.976 6.139 -9.316 1.00 0.00 C ATOM 2007 C ILE A 129 4.941 7.229 -8.840 1.00 0.00 C ATOM 2008 O ILE A 129 5.485 7.141 -7.757 1.00 0.00 O ATOM 2009 CB ILE A 129 2.537 6.656 -9.219 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.146 6.812 -7.743 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.592 5.661 -9.898 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.634 8.232 -7.483 1.00 0.00 C ATOM 0 H ILE A 129 3.354 4.765 -7.805 1.00 0.00 H new ATOM 0 HA ILE A 129 4.205 5.880 -10.350 1.00 0.00 H new ATOM 0 HB ILE A 129 2.464 7.623 -9.716 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.376 6.086 -7.484 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.006 6.605 -7.107 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.568 6.027 -9.830 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.870 5.553 -10.946 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.665 4.693 -9.402 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.359 8.333 -6.433 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.417 8.951 -7.724 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.761 8.424 -8.107 1.00 0.00 H new ATOM 2024 N PRO A 130 5.127 8.226 -9.670 1.00 0.00 N ATOM 2025 CA PRO A 130 6.028 9.403 -9.418 1.00 0.00 C ATOM 2026 C PRO A 130 5.477 10.245 -8.265 1.00 0.00 C ATOM 2027 O PRO A 130 4.609 11.076 -8.451 1.00 0.00 O ATOM 2028 CB PRO A 130 6.067 10.228 -10.702 1.00 0.00 C ATOM 2029 CG PRO A 130 5.184 9.540 -11.721 1.00 0.00 C ATOM 2030 CD PRO A 130 4.480 8.385 -11.021 1.00 0.00 C ATOM 0 HA PRO A 130 7.030 9.073 -9.144 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.715 11.243 -10.515 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.089 10.308 -11.074 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.456 10.240 -12.130 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.779 9.174 -12.558 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.415 8.590 -10.916 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.573 7.468 -11.603 1.00 0.00 H new ATOM 2038 N LEU A 131 5.972 10.033 -7.075 1.00 0.00 N ATOM 2039 CA LEU A 131 5.477 10.817 -5.908 1.00 0.00 C ATOM 2040 C LEU A 131 6.300 12.099 -5.776 1.00 0.00 C ATOM 2041 O LEU A 131 7.446 12.154 -6.177 1.00 0.00 O ATOM 2042 CB LEU A 131 5.629 9.983 -4.633 1.00 0.00 C ATOM 2043 CG LEU A 131 4.329 9.228 -4.354 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.609 8.069 -3.395 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.313 10.179 -3.717 1.00 0.00 C ATOM 0 H LEU A 131 6.699 9.350 -6.861 1.00 0.00 H new ATOM 0 HA LEU A 131 4.427 11.069 -6.055 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.453 9.279 -4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.873 10.630 -3.790 1.00 0.00 H new ATOM 0 HG LEU A 131 3.927 8.839 -5.290 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.683 7.530 -3.195 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.334 7.391 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.010 8.459 -2.460 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.386 9.641 -3.518 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.715 10.567 -2.781 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.113 11.007 -4.397 1.00 0.00 H new ATOM 2057 N ASN A 132 5.724 13.130 -5.218 1.00 0.00 N ATOM 2058 CA ASN A 132 6.473 14.409 -5.063 1.00 0.00 C ATOM 2059 C ASN A 132 7.164 14.431 -3.696 1.00 0.00 C ATOM 2060 O ASN A 132 6.808 15.191 -2.821 1.00 0.00 O ATOM 2061 CB ASN A 132 5.495 15.586 -5.174 1.00 0.00 C ATOM 2062 CG ASN A 132 5.963 16.539 -6.276 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.858 16.232 -7.446 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.480 17.692 -5.948 1.00 0.00 N ATOM 0 H ASN A 132 4.768 13.141 -4.863 1.00 0.00 H new ATOM 0 HA ASN A 132 7.227 14.493 -5.846 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.493 15.220 -5.397 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.437 16.115 -4.223 1.00 0.00 H new ATOM 0 HD21 ASN A 132 6.796 18.335 -6.675 1.00 0.00 H new ATOM 0 HD22 ASN A 132 6.568 17.950 -4.965 1.00 0.00 H new ATOM 2071 N TRP A 133 8.147 13.590 -3.507 1.00 0.00 N ATOM 2072 CA TRP A 133 8.863 13.547 -2.195 1.00 0.00 C ATOM 2073 C TRP A 133 9.313 14.957 -1.796 1.00 0.00 C ATOM 2074 O TRP A 133 9.402 15.280 -0.627 1.00 0.00 O ATOM 2075 CB TRP A 133 10.088 12.638 -2.317 1.00 0.00 C ATOM 2076 CG TRP A 133 9.657 11.280 -2.768 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.692 10.839 -4.047 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.129 10.182 -1.970 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.216 9.541 -4.084 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.857 9.091 -2.829 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.861 10.028 -0.598 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.337 7.890 -2.345 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.339 8.820 -0.107 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.077 7.754 -0.979 1.00 0.00 C ATOM 0 H TRP A 133 8.486 12.929 -4.206 1.00 0.00 H new ATOM 0 HA TRP A 133 8.189 13.159 -1.432 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.798 13.060 -3.028 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.600 12.569 -1.357 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.035 11.407 -4.899 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.139 8.984 -4.935 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.058 10.844 0.082 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.137 7.072 -3.021 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.138 8.712 0.949 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.674 6.828 -0.595 1.00 0.00 H new ATOM 2095 N ASP A 134 9.600 15.795 -2.755 1.00 0.00 N ATOM 2096 CA ASP A 134 10.046 17.182 -2.432 1.00 0.00 C ATOM 2097 C ASP A 134 8.924 17.936 -1.707 1.00 0.00 C ATOM 2098 O ASP A 134 9.174 18.839 -0.932 1.00 0.00 O ATOM 2099 CB ASP A 134 10.405 17.917 -3.727 1.00 0.00 C ATOM 2100 CG ASP A 134 11.752 18.624 -3.558 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.742 17.934 -3.377 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.770 19.842 -3.612 1.00 0.00 O ATOM 0 H ASP A 134 9.545 15.579 -3.750 1.00 0.00 H new ATOM 0 HA ASP A 134 10.921 17.136 -1.784 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.455 17.211 -4.556 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.630 18.643 -3.972 1.00 0.00 H new ATOM 2107 N ASP A 135 7.692 17.577 -1.955 1.00 0.00 N ATOM 2108 CA ASP A 135 6.555 18.274 -1.283 1.00 0.00 C ATOM 2109 C ASP A 135 6.207 17.565 0.032 1.00 0.00 C ATOM 2110 O ASP A 135 5.415 18.051 0.815 1.00 0.00 O ATOM 2111 CB ASP A 135 5.335 18.254 -2.208 1.00 0.00 C ATOM 2112 CG ASP A 135 4.389 19.396 -1.835 1.00 0.00 C ATOM 2113 OD1 ASP A 135 4.730 20.535 -2.110 1.00 0.00 O ATOM 2114 OD2 ASP A 135 3.340 19.113 -1.280 1.00 0.00 O ATOM 0 H ASP A 135 7.423 16.830 -2.595 1.00 0.00 H new ATOM 0 HA ASP A 135 6.842 19.303 -1.068 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.652 18.355 -3.246 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.818 17.298 -2.124 1.00 0.00 H new ATOM 2119 N PHE A 136 6.792 16.422 0.281 1.00 0.00 N ATOM 2120 CA PHE A 136 6.494 15.690 1.545 1.00 0.00 C ATOM 2121 C PHE A 136 7.761 15.607 2.395 1.00 0.00 C ATOM 2122 O PHE A 136 8.857 15.819 1.914 1.00 0.00 O ATOM 2123 CB PHE A 136 6.019 14.272 1.223 1.00 0.00 C ATOM 2124 CG PHE A 136 4.629 14.314 0.637 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.450 14.627 -0.714 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.520 14.025 1.442 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.164 14.653 -1.263 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.233 14.052 0.893 1.00 0.00 C ATOM 2129 CZ PHE A 136 2.055 14.366 -0.460 1.00 0.00 C ATOM 0 H PHE A 136 7.463 15.965 -0.337 1.00 0.00 H new ATOM 0 HA PHE A 136 5.714 16.222 2.090 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.705 13.801 0.519 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.023 13.664 2.128 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.306 14.849 -1.334 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.658 13.782 2.485 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.027 14.895 -2.307 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.377 13.831 1.513 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.062 14.387 -0.884 1.00 0.00 H new ATOM 2139 N THR A 137 7.620 15.290 3.653 1.00 0.00 N ATOM 2140 CA THR A 137 8.817 15.180 4.533 1.00 0.00 C ATOM 2141 C THR A 137 8.701 13.917 5.388 1.00 0.00 C ATOM 2142 O THR A 137 7.672 13.651 5.979 1.00 0.00 O ATOM 2143 CB THR A 137 8.903 16.407 5.442 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.600 17.573 4.690 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.317 16.520 6.015 1.00 0.00 C ATOM 0 H THR A 137 6.727 15.102 4.109 1.00 0.00 H new ATOM 0 HA THR A 137 9.716 15.125 3.919 1.00 0.00 H new ATOM 0 HB THR A 137 8.189 16.306 6.259 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.424 17.937 4.305 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.378 17.394 6.663 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.549 15.624 6.591 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.033 16.622 5.199 1.00 0.00 H new ATOM 2153 N LYS A 138 9.744 13.133 5.455 1.00 0.00 N ATOM 2154 CA LYS A 138 9.688 11.885 6.266 1.00 0.00 C ATOM 2155 C LYS A 138 9.681 12.250 7.753 1.00 0.00 C ATOM 2156 O LYS A 138 10.593 12.880 8.252 1.00 0.00 O ATOM 2157 CB LYS A 138 10.914 11.026 5.945 1.00 0.00 C ATOM 2158 CG LYS A 138 10.879 9.738 6.773 1.00 0.00 C ATOM 2159 CD LYS A 138 12.051 9.733 7.755 1.00 0.00 C ATOM 2160 CE LYS A 138 13.339 9.368 7.012 1.00 0.00 C ATOM 2161 NZ LYS A 138 13.900 10.585 6.360 1.00 0.00 N ATOM 0 H LYS A 138 10.632 13.304 4.983 1.00 0.00 H new ATOM 0 HA LYS A 138 8.783 11.326 6.030 1.00 0.00 H new ATOM 0 HB2 LYS A 138 10.932 10.785 4.882 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.826 11.583 6.161 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.936 9.667 7.315 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.936 8.869 6.117 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.153 10.713 8.221 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.865 9.017 8.556 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.066 8.948 7.707 1.00 0.00 H new ATOM 0 HE3 LYS A 138 13.135 8.603 6.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.934 10.497 6.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 13.497 10.685 5.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.661 11.424 6.927 1.00 0.00 H new ATOM 2175 N VAL A 139 8.647 11.872 8.457 1.00 0.00 N ATOM 2176 CA VAL A 139 8.560 12.209 9.908 1.00 0.00 C ATOM 2177 C VAL A 139 9.098 11.054 10.761 1.00 0.00 C ATOM 2178 O VAL A 139 9.503 11.250 11.890 1.00 0.00 O ATOM 2179 CB VAL A 139 7.098 12.473 10.276 1.00 0.00 C ATOM 2180 CG1 VAL A 139 6.606 13.725 9.549 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.243 11.275 9.858 1.00 0.00 C ATOM 0 H VAL A 139 7.857 11.343 8.088 1.00 0.00 H new ATOM 0 HA VAL A 139 9.161 13.097 10.101 1.00 0.00 H new ATOM 0 HB VAL A 139 7.017 12.622 11.353 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.565 13.913 9.811 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.214 14.580 9.844 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.688 13.576 8.472 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.202 11.462 10.120 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.326 11.127 8.781 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.592 10.381 10.375 1.00 0.00 H new ATOM 2191 N SER A 140 9.102 9.855 10.241 1.00 0.00 N ATOM 2192 CA SER A 140 9.610 8.703 11.043 1.00 0.00 C ATOM 2193 C SER A 140 10.289 7.686 10.124 1.00 0.00 C ATOM 2194 O SER A 140 9.819 7.405 9.039 1.00 0.00 O ATOM 2195 CB SER A 140 8.440 8.032 11.764 1.00 0.00 C ATOM 2196 OG SER A 140 7.933 8.913 12.757 1.00 0.00 O ATOM 0 H SER A 140 8.778 9.624 9.302 1.00 0.00 H new ATOM 0 HA SER A 140 10.334 9.066 11.773 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.655 7.779 11.051 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.767 7.099 12.222 1.00 0.00 H new ATOM 0 HG SER A 140 7.182 8.487 13.220 1.00 0.00 H new ATOM 2202 N SER A 141 11.386 7.124 10.559 1.00 0.00 N ATOM 2203 CA SER A 141 12.090 6.116 9.718 1.00 0.00 C ATOM 2204 C SER A 141 12.853 5.130 10.605 1.00 0.00 C ATOM 2205 O SER A 141 13.500 5.512 11.560 1.00 0.00 O ATOM 2206 CB SER A 141 13.071 6.818 8.780 1.00 0.00 C ATOM 2207 OG SER A 141 12.526 6.840 7.468 1.00 0.00 O ATOM 0 H SER A 141 11.823 7.320 11.459 1.00 0.00 H new ATOM 0 HA SER A 141 11.350 5.572 9.131 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.260 7.834 9.126 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.029 6.298 8.780 1.00 0.00 H new ATOM 0 HG SER A 141 12.526 5.932 7.098 1.00 0.00 H new ATOM 2213 N ARG A 142 12.790 3.866 10.286 1.00 0.00 N ATOM 2214 CA ARG A 142 13.520 2.846 11.091 1.00 0.00 C ATOM 2215 C ARG A 142 14.247 1.904 10.130 1.00 0.00 C ATOM 2216 O ARG A 142 13.688 1.477 9.139 1.00 0.00 O ATOM 2217 CB ARG A 142 12.521 2.047 11.933 1.00 0.00 C ATOM 2218 CG ARG A 142 13.276 1.226 12.982 1.00 0.00 C ATOM 2219 CD ARG A 142 13.243 1.957 14.325 1.00 0.00 C ATOM 2220 NE ARG A 142 12.192 1.353 15.195 1.00 0.00 N ATOM 2221 CZ ARG A 142 12.373 0.177 15.745 1.00 0.00 C ATOM 2222 NH1 ARG A 142 13.479 -0.494 15.541 1.00 0.00 N ATOM 2223 NH2 ARG A 142 11.440 -0.332 16.502 1.00 0.00 N ATOM 0 H ARG A 142 12.261 3.494 9.497 1.00 0.00 H new ATOM 0 HA ARG A 142 14.235 3.332 11.755 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.819 2.723 12.421 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.935 1.387 11.293 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.823 0.240 13.082 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.308 1.072 12.665 1.00 0.00 H new ATOM 0 HD2 ARG A 142 14.216 1.890 14.812 1.00 0.00 H new ATOM 0 HD3 ARG A 142 13.037 3.016 14.170 1.00 0.00 H new ATOM 0 HE ARG A 142 11.323 1.861 15.364 1.00 0.00 H new ATOM 0 HH11 ARG A 142 14.211 -0.102 14.949 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.608 -1.408 15.975 1.00 0.00 H new ATOM 0 HH21 ARG A 142 10.575 0.185 16.663 1.00 0.00 H new ATOM 0 HH22 ARG A 142 11.575 -1.247 16.933 1.00 0.00 H new ATOM 2237 N THR A 143 15.482 1.576 10.403 1.00 0.00 N ATOM 2238 CA THR A 143 16.227 0.659 9.490 1.00 0.00 C ATOM 2239 C THR A 143 16.363 -0.709 10.159 1.00 0.00 C ATOM 2240 O THR A 143 16.763 -0.810 11.302 1.00 0.00 O ATOM 2241 CB THR A 143 17.621 1.234 9.203 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.514 2.594 8.790 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.289 0.421 8.093 1.00 0.00 C ATOM 0 H THR A 143 16.006 1.902 11.215 1.00 0.00 H new ATOM 0 HA THR A 143 15.684 0.557 8.550 1.00 0.00 H new ATOM 0 HB THR A 143 18.220 1.181 10.112 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.408 2.953 8.611 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.279 0.829 7.889 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.383 -0.618 8.409 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.682 0.472 7.189 1.00 0.00 H new ATOM 2251 N VAL A 144 16.027 -1.762 9.462 1.00 0.00 N ATOM 2252 CA VAL A 144 16.129 -3.120 10.070 1.00 0.00 C ATOM 2253 C VAL A 144 17.055 -4.004 9.231 1.00 0.00 C ATOM 2254 O VAL A 144 16.850 -4.184 8.047 1.00 0.00 O ATOM 2255 CB VAL A 144 14.740 -3.763 10.120 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.781 -5.006 11.015 1.00 0.00 C ATOM 2257 CG2 VAL A 144 13.725 -2.762 10.681 1.00 0.00 C ATOM 0 H VAL A 144 15.687 -1.740 8.500 1.00 0.00 H new ATOM 0 HA VAL A 144 16.533 -3.025 11.078 1.00 0.00 H new ATOM 0 HB VAL A 144 14.442 -4.051 9.112 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.792 -5.462 11.049 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.497 -5.722 10.611 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.084 -4.719 12.022 1.00 0.00 H new ATOM 0 HG21 VAL A 144 12.738 -3.224 10.714 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.022 -2.468 11.688 1.00 0.00 H new ATOM 0 HG23 VAL A 144 13.691 -1.881 10.041 1.00 0.00 H new ATOM 2267 N GLU A 145 18.071 -4.560 9.838 1.00 0.00 N ATOM 2268 CA GLU A 145 19.008 -5.437 9.078 1.00 0.00 C ATOM 2269 C GLU A 145 18.467 -6.868 9.091 1.00 0.00 C ATOM 2270 O GLU A 145 17.646 -7.221 9.916 1.00 0.00 O ATOM 2271 CB GLU A 145 20.391 -5.403 9.736 1.00 0.00 C ATOM 2272 CG GLU A 145 20.262 -5.739 11.224 1.00 0.00 C ATOM 2273 CD GLU A 145 21.639 -6.086 11.791 1.00 0.00 C ATOM 2274 OE1 GLU A 145 22.017 -7.243 11.709 1.00 0.00 O ATOM 2275 OE2 GLU A 145 22.292 -5.188 12.298 1.00 0.00 O ATOM 0 H GLU A 145 18.292 -4.444 10.827 1.00 0.00 H new ATOM 0 HA GLU A 145 19.094 -5.084 8.050 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.054 -6.117 9.248 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.839 -4.417 9.613 1.00 0.00 H new ATOM 0 HG2 GLU A 145 19.838 -4.892 11.763 1.00 0.00 H new ATOM 0 HG3 GLU A 145 19.579 -6.578 11.360 1.00 0.00 H new ATOM 2282 N ASP A 146 18.912 -7.695 8.181 1.00 0.00 N ATOM 2283 CA ASP A 146 18.409 -9.099 8.146 1.00 0.00 C ATOM 2284 C ASP A 146 19.546 -10.059 7.780 1.00 0.00 C ATOM 2285 O ASP A 146 20.547 -9.667 7.214 1.00 0.00 O ATOM 2286 CB ASP A 146 17.291 -9.208 7.104 1.00 0.00 C ATOM 2287 CG ASP A 146 16.090 -9.934 7.713 1.00 0.00 C ATOM 2288 OD1 ASP A 146 16.080 -11.154 7.678 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.200 -9.259 8.202 1.00 0.00 O ATOM 0 H ASP A 146 19.599 -7.460 7.464 1.00 0.00 H new ATOM 0 HA ASP A 146 18.025 -9.367 9.130 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.996 -8.214 6.768 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.649 -9.748 6.227 1.00 0.00 H new ATOM 2294 N THR A 147 19.387 -11.319 8.095 1.00 0.00 N ATOM 2295 CA THR A 147 20.442 -12.325 7.766 1.00 0.00 C ATOM 2296 C THR A 147 20.679 -12.361 6.248 1.00 0.00 C ATOM 2297 O THR A 147 21.667 -12.892 5.779 1.00 0.00 O ATOM 2298 CB THR A 147 19.985 -13.707 8.240 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.622 -13.899 7.887 1.00 0.00 O ATOM 2300 CG2 THR A 147 20.138 -13.809 9.760 1.00 0.00 C ATOM 0 H THR A 147 18.567 -11.697 8.569 1.00 0.00 H new ATOM 0 HA THR A 147 21.370 -12.049 8.266 1.00 0.00 H new ATOM 0 HB THR A 147 20.598 -14.473 7.765 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.328 -14.784 8.188 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.812 -14.794 10.093 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.183 -13.662 10.031 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.528 -13.043 10.239 1.00 0.00 H new ATOM 2308 N ASN A 148 19.786 -11.791 5.483 1.00 0.00 N ATOM 2309 CA ASN A 148 19.968 -11.784 4.003 1.00 0.00 C ATOM 2310 C ASN A 148 20.325 -10.364 3.542 1.00 0.00 C ATOM 2311 O ASN A 148 19.611 -9.425 3.833 1.00 0.00 O ATOM 2312 CB ASN A 148 18.680 -12.236 3.319 1.00 0.00 C ATOM 2313 CG ASN A 148 18.996 -12.705 1.897 1.00 0.00 C ATOM 2314 OD1 ASN A 148 19.612 -11.989 1.133 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.601 -13.886 1.509 1.00 0.00 N ATOM 0 H ASN A 148 18.940 -11.331 5.819 1.00 0.00 H new ATOM 0 HA ASN A 148 20.772 -12.469 3.735 1.00 0.00 H new ATOM 0 HB2 ASN A 148 18.219 -13.045 3.886 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.963 -11.416 3.292 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.809 -14.208 0.564 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.084 -14.487 2.151 1.00 0.00 H new ATOM 2322 N PRO A 149 21.430 -10.248 2.844 1.00 0.00 N ATOM 2323 CA PRO A 149 21.985 -8.960 2.298 1.00 0.00 C ATOM 2324 C PRO A 149 20.898 -8.172 1.558 1.00 0.00 C ATOM 2325 O PRO A 149 20.760 -6.977 1.734 1.00 0.00 O ATOM 2326 CB PRO A 149 23.104 -9.330 1.326 1.00 0.00 C ATOM 2327 CG PRO A 149 23.287 -10.831 1.380 1.00 0.00 C ATOM 2328 CD PRO A 149 22.353 -11.372 2.454 1.00 0.00 C ATOM 0 HA PRO A 149 22.356 -8.333 3.109 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.852 -9.012 0.314 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.029 -8.822 1.598 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.059 -11.279 0.413 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.322 -11.082 1.611 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.786 -12.224 2.078 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.920 -11.722 3.317 1.00 0.00 H new ATOM 2336 N ALA A 150 20.147 -8.824 0.712 1.00 0.00 N ATOM 2337 CA ALA A 150 19.095 -8.103 -0.063 1.00 0.00 C ATOM 2338 C ALA A 150 17.845 -7.880 0.793 1.00 0.00 C ATOM 2339 O ALA A 150 17.132 -6.913 0.608 1.00 0.00 O ATOM 2340 CB ALA A 150 18.721 -8.926 -1.298 1.00 0.00 C ATOM 0 H ALA A 150 20.216 -9.824 0.524 1.00 0.00 H new ATOM 0 HA ALA A 150 19.489 -7.132 -0.364 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.953 -8.401 -1.866 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.603 -9.065 -1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.341 -9.899 -0.986 1.00 0.00 H new ATOM 2346 N LEU A 151 17.555 -8.766 1.713 1.00 0.00 N ATOM 2347 CA LEU A 151 16.330 -8.590 2.552 1.00 0.00 C ATOM 2348 C LEU A 151 16.488 -7.402 3.510 1.00 0.00 C ATOM 2349 O LEU A 151 15.575 -7.072 4.242 1.00 0.00 O ATOM 2350 CB LEU A 151 16.068 -9.865 3.359 1.00 0.00 C ATOM 2351 CG LEU A 151 15.809 -11.041 2.408 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.546 -12.306 3.226 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.587 -10.749 1.532 1.00 0.00 C ATOM 0 H LEU A 151 18.109 -9.598 1.918 1.00 0.00 H new ATOM 0 HA LEU A 151 15.487 -8.393 1.890 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.924 -10.084 3.997 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.210 -9.721 4.015 1.00 0.00 H new ATOM 0 HG LEU A 151 16.683 -11.183 1.772 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.362 -13.143 2.553 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.414 -12.525 3.847 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.674 -12.153 3.862 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.411 -11.589 0.861 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.712 -10.602 2.165 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.767 -9.848 0.946 1.00 0.00 H new ATOM 2365 N THR A 152 17.614 -6.734 3.505 1.00 0.00 N ATOM 2366 CA THR A 152 17.770 -5.556 4.406 1.00 0.00 C ATOM 2367 C THR A 152 16.794 -4.481 3.926 1.00 0.00 C ATOM 2368 O THR A 152 16.571 -4.336 2.740 1.00 0.00 O ATOM 2369 CB THR A 152 19.206 -5.029 4.328 1.00 0.00 C ATOM 2370 OG1 THR A 152 20.112 -6.122 4.378 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.472 -4.088 5.505 1.00 0.00 C ATOM 0 H THR A 152 18.423 -6.951 2.922 1.00 0.00 H new ATOM 0 HA THR A 152 17.562 -5.830 5.440 1.00 0.00 H new ATOM 0 HB THR A 152 19.344 -4.484 3.394 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.328 -6.410 3.466 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.494 -3.714 5.448 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.776 -3.250 5.465 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.335 -4.629 6.441 1.00 0.00 H new ATOM 2379 N HIS A 153 16.190 -3.739 4.817 1.00 0.00 N ATOM 2380 CA HIS A 153 15.216 -2.707 4.353 1.00 0.00 C ATOM 2381 C HIS A 153 14.994 -1.634 5.417 1.00 0.00 C ATOM 2382 O HIS A 153 15.281 -1.818 6.584 1.00 0.00 O ATOM 2383 CB HIS A 153 13.881 -3.387 4.046 1.00 0.00 C ATOM 2384 CG HIS A 153 13.440 -4.191 5.239 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.916 -5.471 5.483 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.568 -3.915 6.264 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.332 -5.913 6.613 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.501 -5.003 7.129 1.00 0.00 N ATOM 0 H HIS A 153 16.325 -3.800 5.826 1.00 0.00 H new ATOM 0 HA HIS A 153 15.620 -2.228 3.461 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.128 -2.638 3.800 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.983 -4.035 3.175 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.586 -5.984 4.911 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.018 -2.993 6.381 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.513 -6.884 7.049 1.00 0.00 H new ATOM 2396 N THR A 154 14.466 -0.512 5.004 1.00 0.00 N ATOM 2397 CA THR A 154 14.191 0.600 5.954 1.00 0.00 C ATOM 2398 C THR A 154 12.747 1.070 5.750 1.00 0.00 C ATOM 2399 O THR A 154 12.199 0.950 4.672 1.00 0.00 O ATOM 2400 CB THR A 154 15.152 1.757 5.667 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.473 1.249 5.532 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.107 2.762 6.817 1.00 0.00 C ATOM 0 H THR A 154 14.211 -0.319 4.035 1.00 0.00 H new ATOM 0 HA THR A 154 14.330 0.262 6.981 1.00 0.00 H new ATOM 0 HB THR A 154 14.855 2.254 4.744 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.090 1.987 5.346 1.00 0.00 H new ATOM 0 HG21 THR A 154 15.792 3.584 6.609 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.094 3.151 6.921 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.402 2.269 7.743 1.00 0.00 H new ATOM 2410 N TYR A 155 12.123 1.598 6.769 1.00 0.00 N ATOM 2411 CA TYR A 155 10.715 2.071 6.620 1.00 0.00 C ATOM 2412 C TYR A 155 10.695 3.599 6.657 1.00 0.00 C ATOM 2413 O TYR A 155 11.211 4.204 7.574 1.00 0.00 O ATOM 2414 CB TYR A 155 9.864 1.538 7.776 1.00 0.00 C ATOM 2415 CG TYR A 155 9.903 0.028 7.800 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.185 -0.707 6.849 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.648 -0.636 8.781 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.212 -2.106 6.881 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.677 -2.036 8.812 1.00 0.00 C ATOM 2420 CZ TYR A 155 9.958 -2.771 7.862 1.00 0.00 C ATOM 2421 OH TYR A 155 9.984 -4.151 7.893 1.00 0.00 O ATOM 0 H TYR A 155 12.527 1.722 7.697 1.00 0.00 H new ATOM 0 HA TYR A 155 10.312 1.711 5.674 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.234 1.934 8.722 1.00 0.00 H new ATOM 0 HB3 TYR A 155 8.835 1.881 7.668 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.611 -0.195 6.091 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.201 -0.068 9.515 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.657 -2.673 6.148 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.254 -2.548 9.568 1.00 0.00 H new ATOM 0 HH TYR A 155 10.906 -4.458 8.022 1.00 0.00 H new ATOM 2431 N GLU A 156 10.118 4.235 5.671 1.00 0.00 N ATOM 2432 CA GLU A 156 10.086 5.727 5.671 1.00 0.00 C ATOM 2433 C GLU A 156 8.637 6.220 5.737 1.00 0.00 C ATOM 2434 O GLU A 156 7.819 5.889 4.901 1.00 0.00 O ATOM 2435 CB GLU A 156 10.740 6.252 4.390 1.00 0.00 C ATOM 2436 CG GLU A 156 12.216 5.853 4.364 1.00 0.00 C ATOM 2437 CD GLU A 156 12.846 6.323 3.051 1.00 0.00 C ATOM 2438 OE1 GLU A 156 12.769 7.507 2.770 1.00 0.00 O ATOM 2439 OE2 GLU A 156 13.395 5.489 2.348 1.00 0.00 O ATOM 0 H GLU A 156 9.670 3.789 4.870 1.00 0.00 H new ATOM 0 HA GLU A 156 10.631 6.094 6.541 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.228 5.847 3.517 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.646 7.337 4.340 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.739 6.297 5.211 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.314 4.772 4.461 1.00 0.00 H new ATOM 2446 N VAL A 157 8.320 7.017 6.724 1.00 0.00 N ATOM 2447 CA VAL A 157 6.930 7.549 6.851 1.00 0.00 C ATOM 2448 C VAL A 157 6.950 9.053 6.568 1.00 0.00 C ATOM 2449 O VAL A 157 7.717 9.786 7.160 1.00 0.00 O ATOM 2450 CB VAL A 157 6.421 7.305 8.274 1.00 0.00 C ATOM 2451 CG1 VAL A 157 4.958 7.741 8.377 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.536 5.815 8.611 1.00 0.00 C ATOM 0 H VAL A 157 8.967 7.324 7.451 1.00 0.00 H new ATOM 0 HA VAL A 157 6.273 7.047 6.141 1.00 0.00 H new ATOM 0 HB VAL A 157 7.021 7.883 8.977 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.597 7.567 9.391 1.00 0.00 H new ATOM 0 HG12 VAL A 157 4.877 8.802 8.140 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.356 7.165 7.674 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.173 5.642 9.624 1.00 0.00 H new ATOM 0 HG22 VAL A 157 5.938 5.236 7.908 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.579 5.506 8.541 1.00 0.00 H new ATOM 2462 N TRP A 158 6.125 9.525 5.667 1.00 0.00 N ATOM 2463 CA TRP A 158 6.128 10.986 5.356 1.00 0.00 C ATOM 2464 C TRP A 158 4.780 11.622 5.702 1.00 0.00 C ATOM 2465 O TRP A 158 3.771 10.957 5.832 1.00 0.00 O ATOM 2466 CB TRP A 158 6.384 11.200 3.862 1.00 0.00 C ATOM 2467 CG TRP A 158 7.659 10.539 3.449 1.00 0.00 C ATOM 2468 CD1 TRP A 158 7.900 9.209 3.496 1.00 0.00 C ATOM 2469 CD2 TRP A 158 8.865 11.155 2.914 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.179 8.970 3.025 1.00 0.00 N ATOM 2471 CE2 TRP A 158 9.814 10.139 2.655 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.224 12.485 2.632 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.075 10.432 2.134 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.492 12.784 2.108 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.416 11.760 1.859 1.00 0.00 C ATOM 0 H TRP A 158 5.455 8.967 5.138 1.00 0.00 H new ATOM 0 HA TRP A 158 6.914 11.450 5.951 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.554 10.795 3.283 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.434 12.267 3.645 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.208 8.457 3.844 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.601 8.044 2.959 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.520 13.282 2.820 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 11.783 9.639 1.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.757 13.809 1.896 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.390 11.996 1.455 1.00 0.00 H new ATOM 2486 N GLN A 159 4.767 12.922 5.805 1.00 0.00 N ATOM 2487 CA GLN A 159 3.509 13.663 6.097 1.00 0.00 C ATOM 2488 C GLN A 159 3.482 14.891 5.185 1.00 0.00 C ATOM 2489 O GLN A 159 4.514 15.471 4.903 1.00 0.00 O ATOM 2490 CB GLN A 159 3.494 14.104 7.563 1.00 0.00 C ATOM 2491 CG GLN A 159 3.297 12.883 8.464 1.00 0.00 C ATOM 2492 CD GLN A 159 2.658 13.319 9.784 1.00 0.00 C ATOM 2493 OE1 GLN A 159 3.141 14.222 10.438 1.00 0.00 O ATOM 2494 NE2 GLN A 159 1.584 12.710 10.207 1.00 0.00 N ATOM 0 H GLN A 159 5.592 13.513 5.697 1.00 0.00 H new ATOM 0 HA GLN A 159 2.638 13.031 5.921 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.429 14.605 7.812 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.693 14.824 7.729 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.663 12.149 7.966 1.00 0.00 H new ATOM 0 HG3 GLN A 159 4.255 12.400 8.654 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.178 11.952 9.658 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.151 12.992 11.086 1.00 0.00 H new ATOM 2503 N LYS A 160 2.335 15.294 4.701 1.00 0.00 N ATOM 2504 CA LYS A 160 2.293 16.478 3.795 1.00 0.00 C ATOM 2505 C LYS A 160 2.379 17.771 4.609 1.00 0.00 C ATOM 2506 O LYS A 160 1.660 17.961 5.571 1.00 0.00 O ATOM 2507 CB LYS A 160 0.980 16.462 3.007 1.00 0.00 C ATOM 2508 CG LYS A 160 0.984 17.593 1.973 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.164 18.562 2.266 1.00 0.00 C ATOM 2510 CE LYS A 160 -0.542 19.308 0.985 1.00 0.00 C ATOM 2511 NZ LYS A 160 -2.012 19.556 0.969 1.00 0.00 N ATOM 0 H LYS A 160 1.433 14.858 4.893 1.00 0.00 H new ATOM 0 HA LYS A 160 3.140 16.433 3.110 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.856 15.501 2.508 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.136 16.580 3.686 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.936 18.122 2.002 1.00 0.00 H new ATOM 0 HG3 LYS A 160 0.879 17.182 0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -1.026 18.016 2.649 1.00 0.00 H new ATOM 0 HD3 LYS A 160 0.133 19.271 3.038 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.002 20.253 0.929 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.252 18.723 0.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -2.269 20.063 0.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -2.518 18.648 1.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.276 20.130 1.795 1.00 0.00 H new ATOM 2525 N LYS A 161 3.255 18.661 4.225 1.00 0.00 N ATOM 2526 CA LYS A 161 3.395 19.947 4.966 1.00 0.00 C ATOM 2527 C LYS A 161 2.326 20.932 4.487 1.00 0.00 C ATOM 2528 O LYS A 161 1.761 20.779 3.421 1.00 0.00 O ATOM 2529 CB LYS A 161 4.781 20.539 4.703 1.00 0.00 C ATOM 2530 CG LYS A 161 5.858 19.544 5.142 1.00 0.00 C ATOM 2531 CD LYS A 161 7.199 20.271 5.284 1.00 0.00 C ATOM 2532 CE LYS A 161 7.848 19.896 6.619 1.00 0.00 C ATOM 2533 NZ LYS A 161 9.332 20.002 6.503 1.00 0.00 N ATOM 0 H LYS A 161 3.881 18.552 3.427 1.00 0.00 H new ATOM 0 HA LYS A 161 3.272 19.764 6.033 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.894 20.768 3.643 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.896 21.477 5.246 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.579 19.085 6.090 1.00 0.00 H new ATOM 0 HG3 LYS A 161 5.944 18.739 4.412 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.859 20.002 4.459 1.00 0.00 H new ATOM 0 HD3 LYS A 161 7.047 21.349 5.232 1.00 0.00 H new ATOM 0 HE2 LYS A 161 7.487 20.556 7.408 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.567 18.881 6.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 9.764 19.863 7.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 9.682 19.274 5.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 9.586 20.943 6.141 1.00 0.00 H new ATOM 2547 N ALA A 162 2.048 21.942 5.266 1.00 0.00 N ATOM 2548 CA ALA A 162 1.018 22.941 4.860 1.00 0.00 C ATOM 2549 C ALA A 162 1.689 24.293 4.609 1.00 0.00 C ATOM 2550 O ALA A 162 1.367 24.915 3.610 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.021 23.085 5.973 1.00 0.00 C ATOM 2552 OXT ALA A 162 2.513 24.683 5.420 1.00 0.00 O ATOM 0 H ALA A 162 2.491 22.119 6.168 1.00 0.00 H new ATOM 0 HA ALA A 162 0.527 22.605 3.947 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.774 23.815 5.676 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.500 22.122 6.151 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.469 23.420 6.887 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.798 -2.991 -9.291 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.804 -4.108 -8.324 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.232 -1.705 -8.840 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.229 -2.792 -9.962 1.00 0.00 O HETATM 2563 C5B NDP A 168 -6.202 -1.909 -9.373 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.588 -2.246 -9.869 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.564 -1.457 -9.140 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.861 -1.930 -11.331 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.431 -3.001 -12.177 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.377 -1.776 -11.351 1.00 0.00 C HETATM 2569 O2B NDP A 168 -10.071 -3.003 -11.437 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.635 -1.105 -9.999 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.698 0.353 -10.078 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.675 1.226 -10.357 1.00 0.00 C HETATM 2573 N7A NDP A 168 -9.039 2.486 -10.357 1.00 0.00 N HETATM 2574 C5A NDP A 168 -10.394 2.440 -10.057 1.00 0.00 C HETATM 2575 C6A NDP A 168 -11.367 3.447 -9.907 1.00 0.00 C HETATM 2576 N6A NDP A 168 -11.112 4.750 -10.044 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.629 3.063 -9.606 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.886 1.755 -9.468 1.00 0.00 C HETATM 2579 N3A NDP A 168 -12.058 0.717 -9.584 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.813 1.133 -9.883 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.978 -3.474 -10.638 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.440 -3.286 -11.204 1.00 0.00 P HETATM 2583 O1N NDP A 168 -1.216 -4.276 -12.276 1.00 0.00 O HETATM 2584 O2N NDP A 168 -1.238 -1.862 -11.537 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.666 -3.688 -9.870 1.00 0.00 O HETATM 2586 C5D NDP A 168 -1.197 -4.688 -8.983 1.00 0.00 C HETATM 2587 C4D NDP A 168 -0.083 -5.562 -8.451 1.00 0.00 C HETATM 2588 O4D NDP A 168 0.899 -4.745 -7.761 1.00 0.00 O HETATM 2589 C3D NDP A 168 -0.486 -6.605 -7.421 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.987 -7.785 -8.057 1.00 0.00 O HETATM 2591 C2D NDP A 168 0.833 -6.879 -6.708 1.00 0.00 C HETATM 2592 O2D NDP A 168 1.671 -7.808 -7.400 1.00 0.00 O HETATM 2593 C1D NDP A 168 1.472 -5.488 -6.696 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.270 -4.745 -5.450 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.140 -4.054 -4.721 1.00 0.00 C HETATM 2596 C3N NDP A 168 1.895 -3.385 -3.639 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.110 -2.831 -3.115 1.00 0.00 C HETATM 2598 O7N NDP A 168 2.722 -2.160 -2.053 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.391 -2.924 -3.550 1.00 0.00 N HETATM 2600 C4N NDP A 168 0.480 -3.364 -3.135 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.520 -4.094 -3.867 1.00 0.00 C HETATM 2602 C6N NDP A 168 -0.213 -4.816 -5.028 1.00 0.00 C HETATM 2603 P2B NDP A 168 -11.098 -3.518 -12.650 1.00 0.00 P HETATM 2604 O1X NDP A 168 -10.096 -4.501 -13.370 1.00 0.00 O HETATM 2605 O2X NDP A 168 -12.105 -4.328 -11.836 1.00 0.00 O HETATM 2606 O3X NDP A 168 -11.225 -2.232 -13.466 1.00 0.00 O HETATM 0 HO3N NDP A 168 -0.254 -8.423 -8.187 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -6.821 -2.653 -12.861 1.00 0.00 H new HETATM 0 HO2N NDP A 168 1.458 -8.720 -7.110 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.138 -2.454 -3.039 1.00 0.00 H new HETATM 0 H71N NDP A 168 4.607 -3.464 -4.388 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.861 5.432 -9.923 1.00 0.00 H new HETATM 0 H61A NDP A 168 -10.168 5.064 -10.270 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.720 -4.209 -8.155 1.00 0.00 H new HETATM 0 H52A NDP A 168 -6.167 -1.992 -8.287 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.929 -5.300 -9.510 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.961 -0.875 -9.621 1.00 0.00 H new HETATM 0 H42N NDP A 168 0.486 -3.744 -2.113 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.161 -2.323 -3.086 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.654 0.901 -10.560 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.959 -5.381 -5.587 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.549 -4.085 -3.507 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.280 -6.069 -9.345 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.661 -3.324 -9.724 1.00 0.00 H new HETATM 0 H3D NDP A 168 -1.283 -6.280 -6.753 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.332 -1.051 -11.698 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.172 -4.050 -5.072 1.00 0.00 H new HETATM 0 H2D NDP A 168 0.690 -7.334 -5.728 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.726 -1.222 -12.222 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.919 1.504 -9.227 1.00 0.00 H new HETATM 0 H1D NDP A 168 2.548 -5.625 -6.800 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.604 -1.447 -9.635 1.00 0.00 H new HETATM 2633 N1 TRR A 170 3.987 -4.924 1.459 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.894 -3.579 1.728 1.00 0.00 C HETATM 2635 N2 TRR A 170 4.864 -2.963 2.488 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.830 -2.849 1.237 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.859 -3.467 0.475 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.799 -2.736 -0.015 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.951 -4.825 0.202 1.00 0.00 C HETATM 2640 C6 TRR A 170 3.025 -5.551 0.702 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.893 -5.502 -0.629 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.847 -6.993 -0.437 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.305 -7.835 -1.446 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.264 -9.225 -1.274 1.00 0.00 C HETATM 2645 C14 TRR A 170 0.764 -9.762 -0.089 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.305 -8.922 0.924 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.347 -7.530 0.748 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.719 -10.082 -2.274 1.00 0.00 O HETATM 2649 O14 TRR A 170 0.724 -11.130 0.083 1.00 0.00 O HETATM 2650 O15 TRR A 170 -0.189 -9.481 2.103 1.00 0.00 O HETATM 2651 C17 TRR A 170 2.224 -9.536 -3.467 1.00 0.00 C HETATM 2652 C18 TRR A 170 1.905 -11.777 0.475 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.643 -8.635 3.128 1.00 0.00 C HETATM 0 H193 TRR A 170 0.173 -7.991 3.456 1.00 0.00 H new HETATM 0 H192 TRR A 170 -1.463 -8.021 2.756 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.991 -9.236 3.968 1.00 0.00 H new HETATM 0 H183 TRR A 170 2.678 -11.608 -0.274 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.236 -11.380 1.435 1.00 0.00 H new HETATM 0 H181 TRR A 170 1.720 -12.847 0.570 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.450 -8.941 -3.951 1.00 0.00 H new HETATM 0 H172 TRR A 170 3.082 -8.902 -3.242 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.533 -10.341 -4.134 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.080 -5.081 -0.378 1.00 0.00 H new HETATM 0 H71 TRR A 170 1.073 -5.284 -1.682 1.00 0.00 H new HETATM 0 H6 TRR A 170 3.105 -6.618 0.494 1.00 0.00 H new HETATM 0 H42 TRR A 170 0.082 -3.193 -0.578 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.732 -1.738 0.185 1.00 0.00 H new HETATM 0 H22 TRR A 170 4.797 -1.965 2.689 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.649 -3.505 2.850 1.00 0.00 H new HETATM 0 H16 TRR A 170 -0.011 -6.869 1.538 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.696 -7.413 -2.372 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.774 -5.460 1.823 1.00 0.00 H new