USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 18 HIS :FLIP no HD1:sc= -0.173 F(o=-3.4,f=-2.2) USER MOD Set 1.2: A 48 SER OG : rot 145:sc= -0.571 USER MOD Set 1.3: A 170 NDP O2D : rot 180:sc= 0.565 USER MOD Set 1.4: A 170 NDP O3D : rot 95:sc= -2.06! USER MOD Set 2.1: A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 141 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 39 MET CE :methyl -173:sc= -2.61 (180deg=-2.04!) USER MOD Set 3.2: A 46 TYR OH : rot 180:sc= 0 USER MOD Set 3.3: A 59 ASN : amide:sc= -3.32 X(o=-5.9,f=-6.3!) USER MOD Single : A 1 THR N :NH3+ -145:sc= 0.109 (180deg=-0.00644) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.0914 USER MOD Single : A 7 GLN : amide:sc= -2.15 X(o=-2.2,f=-1.8) USER MOD Single : A 15 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000858) USER MOD Single : A 22 HIS : no HE2:sc= -0.104 K(o=-0.1,f=-1.7) USER MOD Single : A 28 HIS : no HD1:sc= -0.459 X(o=-0.46,f=-0.26) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-1!) USER MOD Single : A 34 THR OG1 : rot 9:sc= 0.721 USER MOD Single : A 37 LYS NZ :NH3+ -148:sc= 0.202 (180deg=0.0108) USER MOD Single : A 45 THR OG1 : rot 125:sc= -0.719 USER MOD Single : A 51 LYS NZ :NH3+ -155:sc= -0.117 (180deg=-0.53) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0.118 USER MOD Single : A 63 THR OG1 : rot 106:sc= -0.698 USER MOD Single : A 64 HIS :FLIP no HD1:sc= -0.198 F(o=-1.2,f=-0.2) USER MOD Single : A 65 GLN : amide:sc= -0.25 X(o=-0.25,f=-0.39) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.163 X(o=-0.16,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.154 K(o=-0.15,f=-1.2!) USER MOD Single : A 77 HIS : no HD1:sc= -2.12 K(o=-2.1,f=-3.6!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN :FLIP amide:sc= -0.353 F(o=-1.3,f=-0.35) USER MOD Single : A 89 HIS : no HD1:sc= -0.526 X(o=-0.53,f=-0.039) USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 114:sc= -0.232 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 91:sc= 0.27 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -176:sc= 0 (180deg=-0.0357) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -4.66! C(o=-4.7!,f=-14!) USER MOD Single : A 152 THR OG1 : rot 134:sc= -0.987 USER MOD Single : A 153 HIS : no HD1:sc= -4.83! C(o=-4.8!,f=-5.7!) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 TYR OH : rot 180:sc= -0.139 USER MOD Single : A 159 GLN : amide:sc= -0.0168 X(o=-0.017,f=-0.15) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O3B : rot 47:sc= -0.26 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.752 -4.625 4.807 1.00 1.00 N ATOM 2 CA THR A 1 -10.675 -3.606 4.614 1.00 1.00 C ATOM 3 C THR A 1 -9.375 -4.276 4.182 1.00 1.00 C ATOM 4 O THR A 1 -9.171 -5.474 4.420 1.00 1.00 O ATOM 5 CB THR A 1 -10.471 -2.856 5.938 1.00 1.00 C ATOM 6 OG1 THR A 1 -10.409 -3.762 7.016 1.00 1.00 O ATOM 7 CG2 THR A 1 -11.560 -1.864 6.249 1.00 1.00 C ATOM 0 H1 THR A 1 -12.666 -4.223 4.517 1.00 1.00 H new ATOM 0 H2 THR A 1 -11.544 -5.464 4.229 1.00 1.00 H new ATOM 0 H3 THR A 1 -11.796 -4.898 5.810 1.00 1.00 H new ATOM 0 HA THR A 1 -10.968 -2.907 3.831 1.00 1.00 H new ATOM 0 HB THR A 1 -9.535 -2.312 5.812 1.00 1.00 H new ATOM 0 HG1 THR A 1 -10.277 -3.268 7.852 1.00 1.00 H new ATOM 0 HG21 THR A 1 -11.346 -1.375 7.199 1.00 1.00 H new ATOM 0 HG22 THR A 1 -11.607 -1.116 5.458 1.00 1.00 H new ATOM 0 HG23 THR A 1 -12.516 -2.383 6.316 1.00 1.00 H new ATOM 17 N ALA A 2 -8.499 -3.512 3.554 1.00 1.00 N ATOM 18 CA ALA A 2 -7.213 -4.041 3.106 1.00 1.00 C ATOM 19 C ALA A 2 -6.125 -2.961 3.110 1.00 1.00 C ATOM 20 O ALA A 2 -6.411 -1.768 2.944 1.00 1.00 O ATOM 21 CB ALA A 2 -7.340 -4.659 1.720 1.00 1.00 C ATOM 0 H ALA A 2 -8.649 -2.526 3.341 1.00 1.00 H new ATOM 0 HA ALA A 2 -6.915 -4.817 3.811 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -6.372 -5.047 1.405 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -8.065 -5.473 1.749 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -7.675 -3.900 1.013 1.00 1.00 H new ATOM 27 N PHE A 3 -4.884 -3.384 3.291 1.00 1.00 N ATOM 28 CA PHE A 3 -3.762 -2.458 3.313 1.00 1.00 C ATOM 29 C PHE A 3 -2.830 -2.750 2.157 1.00 1.00 C ATOM 30 O PHE A 3 -2.483 -3.906 1.895 1.00 1.00 O ATOM 31 CB PHE A 3 -3.004 -2.575 4.635 1.00 1.00 C ATOM 32 CG PHE A 3 -3.799 -2.159 5.848 1.00 1.00 C ATOM 33 CD1 PHE A 3 -4.943 -1.387 5.732 1.00 1.00 C ATOM 34 CD2 PHE A 3 -3.382 -2.546 7.113 1.00 1.00 C ATOM 35 CE1 PHE A 3 -5.657 -1.008 6.852 1.00 1.00 C ATOM 36 CE2 PHE A 3 -4.091 -2.170 8.236 1.00 1.00 C ATOM 37 CZ PHE A 3 -5.231 -1.400 8.106 1.00 1.00 C ATOM 0 H PHE A 3 -4.628 -4.362 3.425 1.00 1.00 H new ATOM 0 HA PHE A 3 -4.144 -1.442 3.217 1.00 1.00 H new ATOM 0 HB2 PHE A 3 -2.681 -3.608 4.764 1.00 1.00 H new ATOM 0 HB3 PHE A 3 -2.103 -1.964 4.579 1.00 1.00 H new ATOM 0 HD1 PHE A 3 -5.281 -1.078 4.754 1.00 1.00 H new ATOM 0 HD2 PHE A 3 -2.492 -3.149 7.221 1.00 1.00 H new ATOM 0 HE1 PHE A 3 -6.547 -0.406 6.747 1.00 1.00 H new ATOM 0 HE2 PHE A 3 -3.755 -2.477 9.215 1.00 1.00 H new ATOM 0 HZ PHE A 3 -5.788 -1.105 8.983 1.00 1.00 H new ATOM 47 N LEU A 4 -2.398 -1.705 1.458 1.00 1.00 N ATOM 48 CA LEU A 4 -1.486 -1.870 0.328 1.00 1.00 C ATOM 49 C LEU A 4 -0.093 -1.364 0.672 1.00 1.00 C ATOM 50 O LEU A 4 0.076 -0.222 1.108 1.00 1.00 O ATOM 51 CB LEU A 4 -2.022 -1.138 -0.911 1.00 1.00 C ATOM 52 CG LEU A 4 -3.541 -0.961 -0.953 1.00 1.00 C ATOM 53 CD1 LEU A 4 -3.967 -0.306 -2.256 1.00 1.00 C ATOM 54 CD2 LEU A 4 -4.231 -2.295 -0.789 1.00 1.00 C ATOM 0 H LEU A 4 -2.662 -0.739 1.652 1.00 1.00 H new ATOM 0 HA LEU A 4 -1.420 -2.935 0.106 1.00 1.00 H new ATOM 0 HB2 LEU A 4 -1.555 -0.154 -0.963 1.00 1.00 H new ATOM 0 HB3 LEU A 4 -1.711 -1.686 -1.801 1.00 1.00 H new ATOM 0 HG LEU A 4 -3.834 -0.312 -0.128 1.00 1.00 H new ATOM 0 HD11 LEU A 4 -5.051 -0.189 -2.267 1.00 1.00 H new ATOM 0 HD12 LEU A 4 -3.495 0.673 -2.343 1.00 1.00 H new ATOM 0 HD13 LEU A 4 -3.661 -0.932 -3.095 1.00 1.00 H new ATOM 0 HD21 LEU A 4 -5.311 -2.152 -0.821 1.00 1.00 H new ATOM 0 HD22 LEU A 4 -3.929 -2.962 -1.596 1.00 1.00 H new ATOM 0 HD23 LEU A 4 -3.951 -2.734 0.169 1.00 1.00 H new ATOM 66 N TRP A 5 0.914 -2.212 0.481 1.00 1.00 N ATOM 67 CA TRP A 5 2.286 -1.822 0.777 1.00 1.00 C ATOM 68 C TRP A 5 3.284 -2.508 -0.140 1.00 1.00 C ATOM 69 O TRP A 5 2.977 -3.508 -0.773 1.00 1.00 O ATOM 70 CB TRP A 5 2.627 -2.143 2.232 1.00 1.00 C ATOM 71 CG TRP A 5 3.057 -3.563 2.455 1.00 1.00 C ATOM 72 CD1 TRP A 5 4.292 -4.096 2.219 1.00 1.00 C ATOM 73 CD2 TRP A 5 2.252 -4.630 2.970 1.00 1.00 C ATOM 74 NE1 TRP A 5 4.302 -5.427 2.553 1.00 1.00 N ATOM 75 CE2 TRP A 5 3.063 -5.779 3.016 1.00 1.00 C ATOM 76 CE3 TRP A 5 0.923 -4.727 3.398 1.00 1.00 C ATOM 77 CZ2 TRP A 5 2.593 -7.006 3.470 1.00 1.00 C ATOM 78 CZ3 TRP A 5 0.457 -5.949 3.849 1.00 1.00 C ATOM 79 CH2 TRP A 5 1.291 -7.073 3.882 1.00 1.00 C ATOM 0 H TRP A 5 0.807 -3.162 0.127 1.00 1.00 H new ATOM 0 HA TRP A 5 2.357 -0.747 0.609 1.00 1.00 H new ATOM 0 HB2 TRP A 5 3.422 -1.476 2.564 1.00 1.00 H new ATOM 0 HB3 TRP A 5 1.756 -1.935 2.854 1.00 1.00 H new ATOM 0 HD1 TRP A 5 5.137 -3.550 1.827 1.00 1.00 H new ATOM 0 HE1 TRP A 5 5.103 -6.053 2.470 1.00 1.00 H new ATOM 0 HE3 TRP A 5 0.274 -3.864 3.377 1.00 1.00 H new ATOM 0 HZ2 TRP A 5 3.233 -7.875 3.496 1.00 1.00 H new ATOM 0 HZ3 TRP A 5 -0.567 -6.037 4.181 1.00 1.00 H new ATOM 0 HH2 TRP A 5 0.898 -8.013 4.240 1.00 1.00 H new ATOM 90 N ALA A 6 4.492 -1.959 -0.198 1.00 1.00 N ATOM 91 CA ALA A 6 5.544 -2.515 -1.025 1.00 1.00 C ATOM 92 C ALA A 6 6.832 -2.611 -0.212 1.00 1.00 C ATOM 93 O ALA A 6 7.102 -1.762 0.623 1.00 1.00 O ATOM 94 CB ALA A 6 5.755 -1.640 -2.258 1.00 1.00 C ATOM 0 H ALA A 6 4.763 -1.125 0.323 1.00 1.00 H new ATOM 0 HA ALA A 6 5.258 -3.514 -1.355 1.00 1.00 H new ATOM 0 HB1 ALA A 6 6.547 -2.065 -2.874 1.00 1.00 H new ATOM 0 HB2 ALA A 6 4.831 -1.595 -2.835 1.00 1.00 H new ATOM 0 HB3 ALA A 6 6.037 -0.634 -1.946 1.00 1.00 H new ATOM 100 N GLN A 7 7.612 -3.663 -0.445 1.00 1.00 N ATOM 101 CA GLN A 7 8.851 -3.841 0.299 1.00 1.00 C ATOM 102 C GLN A 7 9.982 -4.363 -0.594 1.00 1.00 C ATOM 103 O GLN A 7 9.731 -5.082 -1.558 1.00 1.00 O ATOM 104 CB GLN A 7 8.588 -4.815 1.458 1.00 1.00 C ATOM 105 CG GLN A 7 9.800 -5.092 2.339 1.00 1.00 C ATOM 106 CD GLN A 7 10.142 -6.563 2.405 1.00 1.00 C ATOM 107 OE1 GLN A 7 10.475 -7.088 3.466 1.00 1.00 O ATOM 108 NE2 GLN A 7 10.070 -7.237 1.263 1.00 1.00 N ATOM 0 H GLN A 7 7.412 -4.392 -1.130 1.00 1.00 H new ATOM 0 HA GLN A 7 9.173 -2.874 0.684 1.00 1.00 H new ATOM 0 HB2 GLN A 7 7.788 -4.413 2.079 1.00 1.00 H new ATOM 0 HB3 GLN A 7 8.229 -5.759 1.048 1.00 1.00 H new ATOM 0 HG2 GLN A 7 10.658 -4.539 1.956 1.00 1.00 H new ATOM 0 HG3 GLN A 7 9.606 -4.722 3.346 1.00 1.00 H new ATOM 0 HE21 GLN A 7 9.789 -6.760 0.406 1.00 1.00 H new ATOM 0 HE22 GLN A 7 10.296 -8.231 1.243 1.00 1.00 H new ATOM 117 N ASP A 8 11.218 -4.017 -0.242 1.00 1.00 N ATOM 118 CA ASP A 8 12.383 -4.469 -0.992 1.00 1.00 C ATOM 119 C ASP A 8 12.672 -5.931 -0.670 1.00 1.00 C ATOM 120 O ASP A 8 12.364 -6.426 0.418 1.00 1.00 O ATOM 121 CB ASP A 8 13.604 -3.583 -0.684 1.00 1.00 C ATOM 122 CG ASP A 8 13.604 -2.277 -1.467 1.00 1.00 C ATOM 123 OD1 ASP A 8 12.548 -1.917 -2.031 1.00 1.00 O ATOM 124 OD2 ASP A 8 14.662 -1.616 -1.510 1.00 1.00 O ATOM 0 H ASP A 8 11.437 -3.424 0.559 1.00 1.00 H new ATOM 0 HA ASP A 8 12.172 -4.385 -2.058 1.00 1.00 H new ATOM 0 HB2 ASP A 8 13.625 -3.361 0.383 1.00 1.00 H new ATOM 0 HB3 ASP A 8 14.515 -4.137 -0.912 1.00 1.00 H new ATOM 129 N ARG A 9 13.270 -6.630 -1.632 1.00 1.00 N ATOM 130 CA ARG A 9 13.599 -8.044 -1.450 1.00 1.00 C ATOM 131 C ARG A 9 14.566 -8.226 -0.295 1.00 1.00 C ATOM 132 O ARG A 9 14.434 -9.146 0.501 1.00 1.00 O ATOM 133 CB ARG A 9 14.182 -8.648 -2.736 1.00 1.00 C ATOM 134 CG ARG A 9 15.405 -7.935 -3.278 1.00 1.00 C ATOM 135 CD ARG A 9 16.142 -8.783 -4.316 1.00 1.00 C ATOM 136 NE ARG A 9 15.242 -9.295 -5.348 1.00 1.00 N ATOM 137 CZ ARG A 9 15.660 -9.904 -6.457 1.00 1.00 C ATOM 138 NH1 ARG A 9 16.957 -10.064 -6.692 1.00 1.00 N ATOM 139 NH2 ARG A 9 14.776 -10.360 -7.333 1.00 1.00 N ATOM 0 H ARG A 9 13.535 -6.246 -2.539 1.00 1.00 H new ATOM 0 HA ARG A 9 12.675 -8.573 -1.216 1.00 1.00 H new ATOM 0 HB2 ARG A 9 14.441 -9.690 -2.546 1.00 1.00 H new ATOM 0 HB3 ARG A 9 13.408 -8.647 -3.504 1.00 1.00 H new ATOM 0 HG2 ARG A 9 15.105 -6.989 -3.728 1.00 1.00 H new ATOM 0 HG3 ARG A 9 16.081 -7.697 -2.457 1.00 1.00 H new ATOM 0 HD2 ARG A 9 16.925 -8.185 -4.783 1.00 1.00 H new ATOM 0 HD3 ARG A 9 16.634 -9.618 -3.818 1.00 1.00 H new ATOM 0 HE ARG A 9 14.238 -9.180 -5.211 1.00 1.00 H new ATOM 0 HH11 ARG A 9 17.643 -9.719 -6.021 1.00 1.00 H new ATOM 0 HH12 ARG A 9 17.267 -10.532 -7.544 1.00 1.00 H new ATOM 0 HH21 ARG A 9 13.778 -10.244 -7.158 1.00 1.00 H new ATOM 0 HH22 ARG A 9 15.094 -10.826 -8.183 1.00 1.00 H new ATOM 153 N ASP A 10 15.547 -7.336 -0.206 1.00 1.00 N ATOM 154 CA ASP A 10 16.530 -7.399 0.858 1.00 1.00 C ATOM 155 C ASP A 10 15.862 -7.271 2.224 1.00 1.00 C ATOM 156 O ASP A 10 16.317 -7.875 3.192 1.00 1.00 O ATOM 157 CB ASP A 10 17.576 -6.287 0.670 1.00 1.00 C ATOM 158 CG ASP A 10 18.900 -6.641 1.317 1.00 1.00 C ATOM 159 OD1 ASP A 10 19.429 -7.734 1.025 1.00 1.00 O ATOM 160 OD2 ASP A 10 19.404 -5.829 2.120 1.00 1.00 O ATOM 0 H ASP A 10 15.679 -6.564 -0.860 1.00 1.00 H new ATOM 0 HA ASP A 10 17.027 -8.368 0.813 1.00 1.00 H new ATOM 0 HB2 ASP A 10 17.728 -6.108 -0.394 1.00 1.00 H new ATOM 0 HB3 ASP A 10 17.199 -5.358 1.098 1.00 1.00 H new ATOM 165 N GLY A 11 14.784 -6.501 2.294 1.00 1.00 N ATOM 166 CA GLY A 11 14.080 -6.323 3.551 1.00 1.00 C ATOM 167 C GLY A 11 13.991 -4.867 3.968 1.00 1.00 C ATOM 168 O GLY A 11 14.189 -4.540 5.134 1.00 1.00 O ATOM 0 H GLY A 11 14.384 -5.996 1.503 1.00 1.00 H new ATOM 0 HA2 GLY A 11 13.074 -6.734 3.461 1.00 1.00 H new ATOM 0 HA3 GLY A 11 14.588 -6.890 4.331 1.00 1.00 H new ATOM 172 N LEU A 12 13.684 -3.997 3.014 1.00 1.00 N ATOM 173 CA LEU A 12 13.555 -2.578 3.302 1.00 1.00 C ATOM 174 C LEU A 12 12.257 -2.013 2.750 1.00 1.00 C ATOM 175 O LEU A 12 11.854 -2.340 1.629 1.00 1.00 O ATOM 176 CB LEU A 12 14.738 -1.804 2.709 1.00 1.00 C ATOM 177 CG LEU A 12 15.275 -0.670 3.586 1.00 1.00 C ATOM 178 CD1 LEU A 12 16.398 -1.179 4.478 1.00 1.00 C ATOM 179 CD2 LEU A 12 15.758 0.479 2.733 1.00 1.00 C ATOM 0 H LEU A 12 13.521 -4.249 2.039 1.00 1.00 H new ATOM 0 HA LEU A 12 13.548 -2.464 4.386 1.00 1.00 H new ATOM 0 HB2 LEU A 12 15.549 -2.505 2.511 1.00 1.00 H new ATOM 0 HB3 LEU A 12 14.435 -1.388 1.748 1.00 1.00 H new ATOM 0 HG LEU A 12 14.464 -0.309 4.219 1.00 1.00 H new ATOM 0 HD11 LEU A 12 16.770 -0.362 5.096 1.00 1.00 H new ATOM 0 HD12 LEU A 12 16.021 -1.976 5.119 1.00 1.00 H new ATOM 0 HD13 LEU A 12 17.208 -1.564 3.859 1.00 1.00 H new ATOM 0 HD21 LEU A 12 16.136 1.275 3.375 1.00 1.00 H new ATOM 0 HD22 LEU A 12 16.556 0.134 2.075 1.00 1.00 H new ATOM 0 HD23 LEU A 12 14.932 0.859 2.132 1.00 1.00 H new ATOM 191 N ILE A 13 11.605 -1.157 3.520 1.00 1.00 N ATOM 192 CA ILE A 13 10.360 -0.552 3.081 1.00 1.00 C ATOM 193 C ILE A 13 10.572 0.917 2.720 1.00 1.00 C ATOM 194 O ILE A 13 9.910 1.457 1.836 1.00 1.00 O ATOM 195 CB ILE A 13 9.266 -0.639 4.152 1.00 1.00 C ATOM 196 CG1 ILE A 13 9.814 -0.184 5.506 1.00 1.00 C ATOM 197 CG2 ILE A 13 8.715 -2.060 4.238 1.00 1.00 C ATOM 198 CD1 ILE A 13 8.741 0.262 6.470 1.00 1.00 C ATOM 0 H ILE A 13 11.916 -0.867 4.447 1.00 1.00 H new ATOM 0 HA ILE A 13 10.036 -1.112 2.204 1.00 1.00 H new ATOM 0 HB ILE A 13 8.448 0.025 3.872 1.00 1.00 H new ATOM 0 HG12 ILE A 13 10.377 -1.002 5.955 1.00 1.00 H new ATOM 0 HG13 ILE A 13 10.514 0.636 5.349 1.00 1.00 H new ATOM 0 HG21 ILE A 13 7.940 -2.104 5.003 1.00 1.00 H new ATOM 0 HG22 ILE A 13 8.291 -2.345 3.275 1.00 1.00 H new ATOM 0 HG23 ILE A 13 9.520 -2.747 4.498 1.00 1.00 H new ATOM 0 HD11 ILE A 13 9.201 0.571 7.409 1.00 1.00 H new ATOM 0 HD12 ILE A 13 8.193 1.101 6.041 1.00 1.00 H new ATOM 0 HD13 ILE A 13 8.054 -0.563 6.657 1.00 1.00 H new ATOM 210 N GLY A 14 11.514 1.564 3.419 1.00 1.00 N ATOM 211 CA GLY A 14 11.793 2.961 3.163 1.00 1.00 C ATOM 212 C GLY A 14 13.201 3.362 3.576 1.00 1.00 C ATOM 213 O GLY A 14 13.797 2.738 4.453 1.00 1.00 O ATOM 0 H GLY A 14 12.082 1.140 4.153 1.00 1.00 H new ATOM 0 HA2 GLY A 14 11.658 3.166 2.101 1.00 1.00 H new ATOM 0 HA3 GLY A 14 11.072 3.576 3.701 1.00 1.00 H new ATOM 217 N LYS A 15 13.736 4.407 2.935 1.00 1.00 N ATOM 218 CA LYS A 15 15.074 4.890 3.245 1.00 1.00 C ATOM 219 C LYS A 15 15.036 5.972 4.318 1.00 1.00 C ATOM 220 O LYS A 15 15.174 7.155 4.022 1.00 1.00 O ATOM 221 CB LYS A 15 15.742 5.424 1.985 1.00 1.00 C ATOM 222 CG LYS A 15 17.223 5.115 1.904 1.00 1.00 C ATOM 223 CD LYS A 15 18.034 6.067 2.771 1.00 1.00 C ATOM 224 CE LYS A 15 19.405 5.494 3.072 1.00 1.00 C ATOM 225 NZ LYS A 15 20.244 5.414 1.848 1.00 1.00 N ATOM 0 H LYS A 15 13.259 4.930 2.200 1.00 1.00 H new ATOM 0 HA LYS A 15 15.655 4.052 3.632 1.00 1.00 H new ATOM 0 HB2 LYS A 15 15.243 5.001 1.113 1.00 1.00 H new ATOM 0 HB3 LYS A 15 15.602 6.504 1.940 1.00 1.00 H new ATOM 0 HG2 LYS A 15 17.401 4.088 2.223 1.00 1.00 H new ATOM 0 HG3 LYS A 15 17.556 5.189 0.869 1.00 1.00 H new ATOM 0 HD2 LYS A 15 18.140 7.026 2.263 1.00 1.00 H new ATOM 0 HD3 LYS A 15 17.503 6.257 3.704 1.00 1.00 H new ATOM 0 HE2 LYS A 15 19.904 6.114 3.816 1.00 1.00 H new ATOM 0 HE3 LYS A 15 19.297 4.500 3.506 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 21.180 5.034 2.093 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 19.787 4.788 1.154 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 20.353 6.364 1.439 1.00 1.00 H new ATOM 239 N ASP A 16 14.844 5.550 5.560 1.00 1.00 N ATOM 240 CA ASP A 16 14.788 6.490 6.677 1.00 1.00 C ATOM 241 C ASP A 16 13.514 7.335 6.615 1.00 1.00 C ATOM 242 O ASP A 16 13.484 8.464 7.095 1.00 1.00 O ATOM 243 CB ASP A 16 16.018 7.395 6.682 1.00 1.00 C ATOM 244 CG ASP A 16 16.332 7.928 8.059 1.00 1.00 C ATOM 245 OD1 ASP A 16 15.584 7.612 9.009 1.00 1.00 O ATOM 246 OD2 ASP A 16 17.327 8.672 8.191 1.00 1.00 O ATOM 0 H ASP A 16 14.725 4.571 5.821 1.00 1.00 H new ATOM 0 HA ASP A 16 14.775 5.912 7.601 1.00 1.00 H new ATOM 0 HB2 ASP A 16 16.877 6.839 6.306 1.00 1.00 H new ATOM 0 HB3 ASP A 16 15.855 8.230 6.000 1.00 1.00 H new ATOM 251 N GLY A 17 12.461 6.778 6.024 1.00 1.00 N ATOM 252 CA GLY A 17 11.213 7.484 5.912 1.00 1.00 C ATOM 253 C GLY A 17 10.949 8.004 4.504 1.00 1.00 C ATOM 254 O GLY A 17 10.232 8.982 4.326 1.00 1.00 O ATOM 0 H GLY A 17 12.458 5.842 5.620 1.00 1.00 H new ATOM 0 HA2 GLY A 17 10.399 6.822 6.208 1.00 1.00 H new ATOM 0 HA3 GLY A 17 11.212 8.322 6.609 1.00 1.00 H new ATOM 258 N HIS A 18 11.535 7.347 3.505 1.00 1.00 N ATOM 259 CA HIS A 18 11.343 7.779 2.119 1.00 1.00 C ATOM 260 C HIS A 18 11.320 6.598 1.146 1.00 1.00 C ATOM 261 O HIS A 18 11.392 5.435 1.551 1.00 1.00 O ATOM 262 CB HIS A 18 12.441 8.775 1.693 1.00 1.00 C ATOM 263 CG HIS A 18 11.927 9.934 0.902 1.00 1.00 C ATOM 264 ND1 HIS A 18 10.719 10.157 0.346 1.00 1.00 N flip ATOM 265 CD2 HIS A 18 12.694 11.041 0.610 1.00 1.00 C flip ATOM 266 CE1 HIS A 18 10.770 11.385 -0.266 1.00 1.00 C flip ATOM 267 NE2 HIS A 18 11.974 11.899 -0.092 1.00 1.00 N flip ATOM 0 H HIS A 18 12.135 6.530 3.623 1.00 1.00 H new ATOM 0 HA HIS A 18 10.372 8.273 2.079 1.00 1.00 H new ATOM 0 HB2 HIS A 18 12.945 9.150 2.584 1.00 1.00 H new ATOM 0 HB3 HIS A 18 13.189 8.246 1.102 1.00 1.00 H new ATOM 0 HD2 HIS A 18 13.722 11.185 0.908 1.00 1.00 H new ATOM 0 HE1 HIS A 18 9.958 11.854 -0.802 1.00 1.00 H new ATOM 0 HE2 HIS A 18 12.294 12.803 -0.440 1.00 1.00 H new ATOM 276 N LEU A 19 11.199 6.917 -0.137 1.00 1.00 N ATOM 277 CA LEU A 19 11.156 5.917 -1.202 1.00 1.00 C ATOM 278 C LEU A 19 12.557 5.662 -1.778 1.00 1.00 C ATOM 279 O LEU A 19 13.098 6.498 -2.505 1.00 1.00 O ATOM 280 CB LEU A 19 10.219 6.402 -2.316 1.00 1.00 C ATOM 281 CG LEU A 19 8.769 5.920 -2.179 1.00 1.00 C ATOM 282 CD1 LEU A 19 7.835 6.738 -3.061 1.00 1.00 C ATOM 283 CD2 LEU A 19 8.679 4.441 -2.523 1.00 1.00 C ATOM 0 H LEU A 19 11.128 7.878 -0.471 1.00 1.00 H new ATOM 0 HA LEU A 19 10.785 4.981 -0.784 1.00 1.00 H new ATOM 0 HB2 LEU A 19 10.227 7.492 -2.332 1.00 1.00 H new ATOM 0 HB3 LEU A 19 10.611 6.066 -3.276 1.00 1.00 H new ATOM 0 HG LEU A 19 8.454 6.060 -1.145 1.00 1.00 H new ATOM 0 HD11 LEU A 19 6.814 6.375 -2.944 1.00 1.00 H new ATOM 0 HD12 LEU A 19 7.883 7.787 -2.768 1.00 1.00 H new ATOM 0 HD13 LEU A 19 8.139 6.638 -4.103 1.00 1.00 H new ATOM 0 HD21 LEU A 19 7.646 4.106 -2.423 1.00 1.00 H new ATOM 0 HD22 LEU A 19 9.014 4.285 -3.549 1.00 1.00 H new ATOM 0 HD23 LEU A 19 9.312 3.870 -1.844 1.00 1.00 H new ATOM 295 N PRO A 20 13.182 4.506 -1.464 1.00 1.00 N ATOM 296 CA PRO A 20 14.524 4.190 -1.960 1.00 1.00 C ATOM 297 C PRO A 20 14.510 3.777 -3.424 1.00 1.00 C ATOM 298 O PRO A 20 15.433 4.076 -4.180 1.00 1.00 O ATOM 299 CB PRO A 20 14.942 3.015 -1.069 1.00 1.00 C ATOM 300 CG PRO A 20 13.669 2.346 -0.724 1.00 1.00 C ATOM 301 CD PRO A 20 12.642 3.435 -0.606 1.00 1.00 C ATOM 0 HA PRO A 20 15.201 5.043 -1.916 1.00 1.00 H new ATOM 0 HB2 PRO A 20 15.617 2.339 -1.593 1.00 1.00 H new ATOM 0 HB3 PRO A 20 15.465 3.359 -0.177 1.00 1.00 H new ATOM 0 HG2 PRO A 20 13.387 1.626 -1.492 1.00 1.00 H new ATOM 0 HG3 PRO A 20 13.760 1.794 0.211 1.00 1.00 H new ATOM 0 HD2 PRO A 20 11.662 3.102 -0.947 1.00 1.00 H new ATOM 0 HD3 PRO A 20 12.525 3.767 0.426 1.00 1.00 H new ATOM 309 N TRP A 21 13.450 3.086 -3.819 1.00 1.00 N ATOM 310 CA TRP A 21 13.300 2.624 -5.195 1.00 1.00 C ATOM 311 C TRP A 21 12.278 3.470 -5.957 1.00 1.00 C ATOM 312 O TRP A 21 11.522 4.231 -5.368 1.00 1.00 O ATOM 313 CB TRP A 21 12.879 1.157 -5.222 1.00 1.00 C ATOM 314 CG TRP A 21 11.394 0.968 -5.128 1.00 1.00 C ATOM 315 CD1 TRP A 21 10.491 1.053 -6.150 1.00 1.00 C ATOM 316 CD2 TRP A 21 10.645 0.640 -3.957 1.00 1.00 C ATOM 317 NE1 TRP A 21 9.224 0.803 -5.681 1.00 1.00 N ATOM 318 CE2 TRP A 21 9.293 0.546 -4.337 1.00 1.00 C ATOM 319 CE3 TRP A 21 10.987 0.417 -2.623 1.00 1.00 C ATOM 320 CZ2 TRP A 21 8.285 0.239 -3.427 1.00 1.00 C ATOM 321 CZ3 TRP A 21 9.987 0.114 -1.721 1.00 1.00 C ATOM 322 CH2 TRP A 21 8.650 0.028 -2.127 1.00 1.00 C ATOM 0 H TRP A 21 12.677 2.831 -3.204 1.00 1.00 H new ATOM 0 HA TRP A 21 14.267 2.729 -5.686 1.00 1.00 H new ATOM 0 HB2 TRP A 21 13.240 0.699 -6.143 1.00 1.00 H new ATOM 0 HB3 TRP A 21 13.359 0.632 -4.396 1.00 1.00 H new ATOM 0 HD1 TRP A 21 10.737 1.283 -7.176 1.00 1.00 H new ATOM 0 HE1 TRP A 21 8.372 0.808 -6.241 1.00 1.00 H new ATOM 0 HE3 TRP A 21 12.016 0.480 -2.302 1.00 1.00 H new ATOM 0 HZ2 TRP A 21 7.253 0.170 -3.737 1.00 1.00 H new ATOM 0 HZ3 TRP A 21 10.240 -0.059 -0.686 1.00 1.00 H new ATOM 0 HH2 TRP A 21 7.891 -0.210 -1.397 1.00 1.00 H new ATOM 333 N HIS A 22 12.275 3.311 -7.280 1.00 1.00 N ATOM 334 CA HIS A 22 11.350 4.046 -8.142 1.00 1.00 C ATOM 335 C HIS A 22 10.618 3.081 -9.072 1.00 1.00 C ATOM 336 O HIS A 22 11.244 2.302 -9.780 1.00 1.00 O ATOM 337 CB HIS A 22 12.106 5.091 -8.959 1.00 1.00 C ATOM 338 CG HIS A 22 12.792 6.111 -8.098 1.00 1.00 C ATOM 339 ND1 HIS A 22 12.298 6.493 -6.868 1.00 1.00 N ATOM 340 CD2 HIS A 22 13.937 6.811 -8.276 1.00 1.00 C ATOM 341 CE1 HIS A 22 13.110 7.385 -6.328 1.00 1.00 C ATOM 342 NE2 HIS A 22 14.112 7.594 -7.162 1.00 1.00 N ATOM 0 H HIS A 22 12.903 2.680 -7.778 1.00 1.00 H new ATOM 0 HA HIS A 22 10.617 4.555 -7.515 1.00 1.00 H new ATOM 0 HB2 HIS A 22 12.846 4.592 -9.584 1.00 1.00 H new ATOM 0 HB3 HIS A 22 11.410 5.596 -9.629 1.00 1.00 H new ATOM 0 HD1 HIS A 22 11.440 6.142 -6.442 1.00 1.00 H new ATOM 0 HD2 HIS A 22 14.591 6.763 -9.134 1.00 1.00 H new ATOM 0 HE1 HIS A 22 12.977 7.862 -5.368 1.00 1.00 H new ATOM 351 N LEU A 23 9.287 3.128 -9.046 1.00 1.00 N ATOM 352 CA LEU A 23 8.476 2.244 -9.871 1.00 1.00 C ATOM 353 C LEU A 23 7.188 2.933 -10.306 1.00 1.00 C ATOM 354 O LEU A 23 6.106 2.633 -9.808 1.00 1.00 O ATOM 355 CB LEU A 23 8.158 0.959 -9.094 1.00 1.00 C ATOM 356 CG LEU A 23 8.366 -0.339 -9.875 1.00 1.00 C ATOM 357 CD1 LEU A 23 7.946 -0.170 -11.329 1.00 1.00 C ATOM 358 CD2 LEU A 23 9.827 -0.768 -9.773 1.00 1.00 C ATOM 0 H LEU A 23 8.751 3.770 -8.462 1.00 1.00 H new ATOM 0 HA LEU A 23 9.040 1.991 -10.768 1.00 1.00 H new ATOM 0 HB2 LEU A 23 8.780 0.930 -8.199 1.00 1.00 H new ATOM 0 HB3 LEU A 23 7.121 1.002 -8.760 1.00 1.00 H new ATOM 0 HG LEU A 23 7.739 -1.119 -9.442 1.00 1.00 H new ATOM 0 HD11 LEU A 23 8.103 -1.106 -11.864 1.00 1.00 H new ATOM 0 HD12 LEU A 23 6.891 0.101 -11.374 1.00 1.00 H new ATOM 0 HD13 LEU A 23 8.543 0.617 -11.791 1.00 1.00 H new ATOM 0 HD21 LEU A 23 9.974 -1.693 -10.330 1.00 1.00 H new ATOM 0 HD22 LEU A 23 10.465 0.012 -10.189 1.00 1.00 H new ATOM 0 HD23 LEU A 23 10.087 -0.929 -8.727 1.00 1.00 H new ATOM 370 N PRO A 24 7.299 3.882 -11.247 1.00 1.00 N ATOM 371 CA PRO A 24 6.148 4.634 -11.760 1.00 1.00 C ATOM 372 C PRO A 24 5.033 3.715 -12.262 1.00 1.00 C ATOM 373 O PRO A 24 3.869 4.099 -12.300 1.00 1.00 O ATOM 374 CB PRO A 24 6.742 5.463 -12.914 1.00 1.00 C ATOM 375 CG PRO A 24 8.076 4.857 -13.194 1.00 1.00 C ATOM 376 CD PRO A 24 8.551 4.301 -11.888 1.00 1.00 C ATOM 0 HA PRO A 24 5.680 5.244 -10.988 1.00 1.00 H new ATOM 0 HB2 PRO A 24 6.101 5.425 -13.795 1.00 1.00 H new ATOM 0 HB3 PRO A 24 6.838 6.512 -12.635 1.00 1.00 H new ATOM 0 HG2 PRO A 24 8.000 4.074 -13.948 1.00 1.00 H new ATOM 0 HG3 PRO A 24 8.772 5.603 -13.578 1.00 1.00 H new ATOM 0 HD2 PRO A 24 9.235 3.464 -12.028 1.00 1.00 H new ATOM 0 HD3 PRO A 24 9.079 5.049 -11.297 1.00 1.00 H new ATOM 384 N ASP A 25 5.394 2.496 -12.658 1.00 1.00 N ATOM 385 CA ASP A 25 4.415 1.536 -13.169 1.00 1.00 C ATOM 386 C ASP A 25 3.540 0.994 -12.043 1.00 1.00 C ATOM 387 O ASP A 25 2.315 0.947 -12.152 1.00 1.00 O ATOM 388 CB ASP A 25 5.109 0.376 -13.894 1.00 1.00 C ATOM 389 CG ASP A 25 4.539 0.142 -15.277 1.00 1.00 C ATOM 390 OD1 ASP A 25 4.258 1.138 -15.977 1.00 1.00 O ATOM 391 OD2 ASP A 25 4.379 -1.035 -15.664 1.00 1.00 O ATOM 0 H ASP A 25 6.353 2.150 -12.635 1.00 1.00 H new ATOM 0 HA ASP A 25 3.780 2.064 -13.881 1.00 1.00 H new ATOM 0 HB2 ASP A 25 6.176 0.586 -13.973 1.00 1.00 H new ATOM 0 HB3 ASP A 25 5.006 -0.533 -13.302 1.00 1.00 H new ATOM 396 N ASP A 26 4.178 0.569 -10.971 1.00 1.00 N ATOM 397 CA ASP A 26 3.462 0.031 -9.831 1.00 1.00 C ATOM 398 C ASP A 26 2.598 1.095 -9.186 1.00 1.00 C ATOM 399 O ASP A 26 1.507 0.807 -8.681 1.00 1.00 O ATOM 400 CB ASP A 26 4.437 -0.530 -8.802 1.00 1.00 C ATOM 401 CG ASP A 26 4.035 -1.894 -8.288 1.00 1.00 C ATOM 402 OD1 ASP A 26 3.517 -2.705 -9.084 1.00 1.00 O ATOM 403 OD2 ASP A 26 4.231 -2.151 -7.081 1.00 1.00 O ATOM 0 H ASP A 26 5.192 0.586 -10.865 1.00 1.00 H new ATOM 0 HA ASP A 26 2.820 -0.774 -10.190 1.00 1.00 H new ATOM 0 HB2 ASP A 26 5.430 -0.594 -9.248 1.00 1.00 H new ATOM 0 HB3 ASP A 26 4.508 0.162 -7.963 1.00 1.00 H new ATOM 408 N LEU A 27 3.098 2.331 -9.197 1.00 1.00 N ATOM 409 CA LEU A 27 2.381 3.445 -8.601 1.00 1.00 C ATOM 410 C LEU A 27 1.056 3.679 -9.305 1.00 1.00 C ATOM 411 O LEU A 27 0.033 3.901 -8.665 1.00 1.00 O ATOM 412 CB LEU A 27 3.227 4.719 -8.643 1.00 1.00 C ATOM 413 CG LEU A 27 3.895 5.117 -7.329 1.00 1.00 C ATOM 414 CD1 LEU A 27 2.853 5.661 -6.365 1.00 1.00 C ATOM 415 CD2 LEU A 27 4.622 3.929 -6.714 1.00 1.00 C ATOM 0 H LEU A 27 3.996 2.580 -9.613 1.00 1.00 H new ATOM 0 HA LEU A 27 2.180 3.191 -7.560 1.00 1.00 H new ATOM 0 HB2 LEU A 27 4.002 4.593 -9.399 1.00 1.00 H new ATOM 0 HB3 LEU A 27 2.593 5.543 -8.971 1.00 1.00 H new ATOM 0 HG LEU A 27 4.631 5.896 -7.531 1.00 1.00 H new ATOM 0 HD11 LEU A 27 3.335 5.943 -5.429 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.373 6.535 -6.804 1.00 1.00 H new ATOM 0 HD13 LEU A 27 2.103 4.895 -6.170 1.00 1.00 H new ATOM 0 HD21 LEU A 27 5.091 4.234 -5.779 1.00 1.00 H new ATOM 0 HD22 LEU A 27 3.909 3.128 -6.518 1.00 1.00 H new ATOM 0 HD23 LEU A 27 5.387 3.573 -7.404 1.00 1.00 H new ATOM 427 N HIS A 28 1.068 3.608 -10.629 1.00 1.00 N ATOM 428 CA HIS A 28 -0.140 3.820 -11.412 1.00 1.00 C ATOM 429 C HIS A 28 -1.220 2.814 -11.015 1.00 1.00 C ATOM 430 O HIS A 28 -2.391 3.166 -10.883 1.00 1.00 O ATOM 431 CB HIS A 28 0.158 3.702 -12.904 1.00 1.00 C ATOM 432 CG HIS A 28 0.113 5.009 -13.630 1.00 1.00 C ATOM 433 ND1 HIS A 28 0.259 5.109 -14.997 1.00 1.00 N ATOM 434 CD2 HIS A 28 -0.041 6.275 -13.175 1.00 1.00 C ATOM 435 CE1 HIS A 28 0.196 6.380 -15.353 1.00 1.00 C ATOM 436 NE2 HIS A 28 0.014 7.107 -14.267 1.00 1.00 N ATOM 0 H HIS A 28 1.901 3.405 -11.182 1.00 1.00 H new ATOM 0 HA HIS A 28 -0.504 4.827 -11.207 1.00 1.00 H new ATOM 0 HB2 HIS A 28 1.145 3.257 -13.035 1.00 1.00 H new ATOM 0 HB3 HIS A 28 -0.562 3.020 -13.357 1.00 1.00 H new ATOM 0 HD2 HIS A 28 -0.181 6.575 -12.147 1.00 1.00 H new ATOM 0 HE1 HIS A 28 0.279 6.759 -16.361 1.00 1.00 H new ATOM 0 HE2 HIS A 28 -0.072 8.123 -14.242 1.00 1.00 H new ATOM 445 N TYR A 29 -0.797 1.563 -10.812 1.00 1.00 N ATOM 446 CA TYR A 29 -1.707 0.498 -10.402 1.00 1.00 C ATOM 447 C TYR A 29 -2.349 0.834 -9.065 1.00 1.00 C ATOM 448 O TYR A 29 -3.550 0.699 -8.875 1.00 1.00 O ATOM 449 CB TYR A 29 -0.962 -0.839 -10.301 1.00 1.00 C ATOM 450 CG TYR A 29 -1.840 -1.997 -9.895 1.00 1.00 C ATOM 451 CD1 TYR A 29 -2.146 -2.237 -8.561 1.00 1.00 C ATOM 452 CD2 TYR A 29 -2.362 -2.858 -10.853 1.00 1.00 C ATOM 453 CE1 TYR A 29 -2.947 -3.302 -8.193 1.00 1.00 C ATOM 454 CE2 TYR A 29 -3.163 -3.925 -10.492 1.00 1.00 C ATOM 455 CZ TYR A 29 -3.452 -4.143 -9.162 1.00 1.00 C ATOM 456 OH TYR A 29 -4.236 -5.213 -8.802 1.00 1.00 O ATOM 0 H TYR A 29 0.172 1.266 -10.926 1.00 1.00 H new ATOM 0 HA TYR A 29 -2.488 0.408 -11.157 1.00 1.00 H new ATOM 0 HB2 TYR A 29 -0.504 -1.063 -11.265 1.00 1.00 H new ATOM 0 HB3 TYR A 29 -0.152 -0.739 -9.579 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -1.752 -1.581 -7.799 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -2.138 -2.691 -11.896 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -3.176 -3.474 -7.152 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -3.561 -4.585 -11.249 1.00 1.00 H new ATOM 0 HH TYR A 29 -4.510 -5.703 -9.605 1.00 1.00 H new ATOM 466 N PHE A 30 -1.521 1.287 -8.117 1.00 1.00 N ATOM 467 CA PHE A 30 -2.012 1.647 -6.791 1.00 1.00 C ATOM 468 C PHE A 30 -3.029 2.785 -6.869 1.00 1.00 C ATOM 469 O PHE A 30 -4.086 2.737 -6.224 1.00 1.00 O ATOM 470 CB PHE A 30 -0.853 2.053 -5.885 1.00 1.00 C ATOM 471 CG PHE A 30 -1.237 3.041 -4.823 1.00 1.00 C ATOM 472 CD1 PHE A 30 -1.884 2.618 -3.675 1.00 1.00 C ATOM 473 CD2 PHE A 30 -0.956 4.389 -4.975 1.00 1.00 C ATOM 474 CE1 PHE A 30 -2.245 3.521 -2.694 1.00 1.00 C ATOM 475 CE2 PHE A 30 -1.317 5.298 -3.997 1.00 1.00 C ATOM 476 CZ PHE A 30 -1.962 4.864 -2.855 1.00 1.00 C ATOM 0 H PHE A 30 -0.517 1.411 -8.246 1.00 1.00 H new ATOM 0 HA PHE A 30 -2.506 0.771 -6.371 1.00 1.00 H new ATOM 0 HB2 PHE A 30 -0.445 1.161 -5.409 1.00 1.00 H new ATOM 0 HB3 PHE A 30 -0.058 2.480 -6.496 1.00 1.00 H new ATOM 0 HD1 PHE A 30 -2.109 1.570 -3.545 1.00 1.00 H new ATOM 0 HD2 PHE A 30 -0.451 4.733 -5.865 1.00 1.00 H new ATOM 0 HE1 PHE A 30 -2.748 3.178 -1.802 1.00 1.00 H new ATOM 0 HE2 PHE A 30 -1.095 6.347 -4.126 1.00 1.00 H new ATOM 0 HZ PHE A 30 -2.244 5.572 -2.090 1.00 1.00 H new ATOM 486 N ARG A 31 -2.705 3.811 -7.653 1.00 1.00 N ATOM 487 CA ARG A 31 -3.578 4.967 -7.805 1.00 1.00 C ATOM 488 C ARG A 31 -4.929 4.567 -8.400 1.00 1.00 C ATOM 489 O ARG A 31 -5.971 5.019 -7.936 1.00 1.00 O ATOM 490 CB ARG A 31 -2.913 6.009 -8.698 1.00 1.00 C ATOM 491 CG ARG A 31 -3.785 7.220 -8.961 1.00 1.00 C ATOM 492 CD ARG A 31 -3.905 8.093 -7.720 1.00 1.00 C ATOM 493 NE ARG A 31 -5.165 8.834 -7.697 1.00 1.00 N ATOM 494 CZ ARG A 31 -5.390 9.949 -8.392 1.00 1.00 C ATOM 495 NH1 ARG A 31 -4.435 10.475 -9.152 1.00 1.00 N ATOM 496 NH2 ARG A 31 -6.573 10.543 -8.327 1.00 1.00 N ATOM 0 H ARG A 31 -1.841 3.863 -8.193 1.00 1.00 H new ATOM 0 HA ARG A 31 -3.751 5.390 -6.815 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.982 6.335 -8.233 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.649 5.547 -9.649 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -3.364 7.803 -9.780 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -4.776 6.896 -9.278 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -3.834 7.470 -6.829 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -3.071 8.794 -7.686 1.00 1.00 H new ATOM 0 HE ARG A 31 -5.920 8.475 -7.112 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -3.521 10.025 -9.207 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -4.616 11.328 -9.680 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -7.311 10.147 -7.745 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -6.745 11.396 -8.859 1.00 1.00 H new ATOM 510 N ALA A 32 -4.907 3.713 -9.414 1.00 1.00 N ATOM 511 CA ALA A 32 -6.135 3.245 -10.057 1.00 1.00 C ATOM 512 C ALA A 32 -6.985 2.437 -9.084 1.00 1.00 C ATOM 513 O ALA A 32 -8.207 2.515 -9.090 1.00 1.00 O ATOM 514 CB ALA A 32 -5.806 2.427 -11.299 1.00 1.00 C ATOM 0 H ALA A 32 -4.051 3.327 -9.813 1.00 1.00 H new ATOM 0 HA ALA A 32 -6.715 4.116 -10.363 1.00 1.00 H new ATOM 0 HB1 ALA A 32 -6.730 2.086 -11.766 1.00 1.00 H new ATOM 0 HB2 ALA A 32 -5.249 3.044 -12.004 1.00 1.00 H new ATOM 0 HB3 ALA A 32 -5.202 1.564 -11.017 1.00 1.00 H new ATOM 520 N GLN A 33 -6.323 1.649 -8.247 1.00 1.00 N ATOM 521 CA GLN A 33 -7.000 0.816 -7.264 1.00 1.00 C ATOM 522 C GLN A 33 -7.746 1.657 -6.233 1.00 1.00 C ATOM 523 O GLN A 33 -8.834 1.315 -5.806 1.00 1.00 O ATOM 524 CB GLN A 33 -5.981 -0.076 -6.558 1.00 1.00 C ATOM 525 CG GLN A 33 -6.073 -1.535 -6.954 1.00 1.00 C ATOM 526 CD GLN A 33 -6.096 -2.474 -5.765 1.00 1.00 C ATOM 527 OE1 GLN A 33 -5.125 -3.193 -5.526 1.00 1.00 O ATOM 528 NE2 GLN A 33 -7.190 -2.474 -5.013 1.00 1.00 N ATOM 0 H GLN A 33 -5.306 1.570 -8.231 1.00 1.00 H new ATOM 0 HA GLN A 33 -7.731 0.203 -7.790 1.00 1.00 H new ATOM 0 HB2 GLN A 33 -4.978 0.289 -6.778 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -6.122 0.009 -5.480 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -6.974 -1.688 -7.547 1.00 1.00 H new ATOM 0 HG3 GLN A 33 -5.225 -1.786 -7.591 1.00 1.00 H new ATOM 0 HE21 GLN A 33 -7.971 -1.861 -5.249 1.00 1.00 H new ATOM 0 HE22 GLN A 33 -7.250 -3.087 -4.200 1.00 1.00 H new ATOM 537 N THR A 34 -7.138 2.758 -5.826 1.00 1.00 N ATOM 538 CA THR A 34 -7.736 3.638 -4.824 1.00 1.00 C ATOM 539 C THR A 34 -8.831 4.550 -5.408 1.00 1.00 C ATOM 540 O THR A 34 -9.394 5.385 -4.699 1.00 1.00 O ATOM 541 CB THR A 34 -6.649 4.492 -4.178 1.00 1.00 C ATOM 542 OG1 THR A 34 -5.869 5.119 -5.176 1.00 1.00 O ATOM 543 CG2 THR A 34 -5.696 3.700 -3.295 1.00 1.00 C ATOM 0 H THR A 34 -6.230 3.068 -6.171 1.00 1.00 H new ATOM 0 HA THR A 34 -8.212 3.000 -4.080 1.00 1.00 H new ATOM 0 HB THR A 34 -7.177 5.214 -3.555 1.00 1.00 H new ATOM 0 HG1 THR A 34 -6.286 4.980 -6.052 1.00 1.00 H new ATOM 0 HG21 THR A 34 -4.951 4.372 -2.870 1.00 1.00 H new ATOM 0 HG22 THR A 34 -6.256 3.224 -2.490 1.00 1.00 H new ATOM 0 HG23 THR A 34 -5.197 2.936 -3.891 1.00 1.00 H new ATOM 551 N VAL A 35 -9.147 4.376 -6.693 1.00 1.00 N ATOM 552 CA VAL A 35 -10.186 5.178 -7.345 1.00 1.00 C ATOM 553 C VAL A 35 -11.567 4.616 -7.069 1.00 1.00 C ATOM 554 O VAL A 35 -11.816 3.422 -7.263 1.00 1.00 O ATOM 555 CB VAL A 35 -9.980 5.259 -8.869 1.00 1.00 C ATOM 556 CG1 VAL A 35 -10.912 6.288 -9.493 1.00 1.00 C ATOM 557 CG2 VAL A 35 -8.542 5.583 -9.189 1.00 1.00 C ATOM 0 H VAL A 35 -8.701 3.690 -7.301 1.00 1.00 H new ATOM 0 HA VAL A 35 -10.107 6.181 -6.925 1.00 1.00 H new ATOM 0 HB VAL A 35 -10.221 4.285 -9.296 1.00 1.00 H new ATOM 0 HG11 VAL A 35 -10.745 6.324 -10.570 1.00 1.00 H new ATOM 0 HG12 VAL A 35 -11.947 6.009 -9.295 1.00 1.00 H new ATOM 0 HG13 VAL A 35 -10.712 7.269 -9.062 1.00 1.00 H new ATOM 0 HG21 VAL A 35 -8.413 5.637 -10.270 1.00 1.00 H new ATOM 0 HG22 VAL A 35 -8.277 6.542 -8.744 1.00 1.00 H new ATOM 0 HG23 VAL A 35 -7.895 4.805 -8.785 1.00 1.00 H new ATOM 567 N GLY A 36 -12.458 5.477 -6.592 1.00 1.00 N ATOM 568 CA GLY A 36 -13.805 5.054 -6.259 1.00 1.00 C ATOM 569 C GLY A 36 -13.888 4.354 -4.905 1.00 1.00 C ATOM 570 O GLY A 36 -14.850 3.630 -4.619 1.00 1.00 O ATOM 0 H GLY A 36 -12.270 6.466 -6.429 1.00 1.00 H new ATOM 0 HA2 GLY A 36 -14.463 5.923 -6.254 1.00 1.00 H new ATOM 0 HA3 GLY A 36 -14.171 4.381 -7.034 1.00 1.00 H new ATOM 574 N LYS A 37 -12.871 4.561 -4.073 1.00 1.00 N ATOM 575 CA LYS A 37 -12.832 3.937 -2.757 1.00 1.00 C ATOM 576 C LYS A 37 -12.277 4.909 -1.703 1.00 1.00 C ATOM 577 O LYS A 37 -11.535 5.842 -2.037 1.00 1.00 O ATOM 578 CB LYS A 37 -11.976 2.667 -2.789 1.00 1.00 C ATOM 579 CG LYS A 37 -11.976 1.957 -4.131 1.00 1.00 C ATOM 580 CD LYS A 37 -11.543 0.507 -4.001 1.00 1.00 C ATOM 581 CE LYS A 37 -12.159 -0.359 -5.082 1.00 1.00 C ATOM 582 NZ LYS A 37 -12.788 -1.588 -4.519 1.00 1.00 N ATOM 0 H LYS A 37 -12.068 5.153 -4.286 1.00 1.00 H new ATOM 0 HA LYS A 37 -13.854 3.672 -2.484 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -10.950 2.926 -2.526 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -12.337 1.978 -2.025 1.00 1.00 H new ATOM 0 HG2 LYS A 37 -12.975 2.001 -4.566 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -11.307 2.476 -4.817 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -10.456 0.445 -4.059 1.00 1.00 H new ATOM 0 HD3 LYS A 37 -11.832 0.127 -3.021 1.00 1.00 H new ATOM 0 HE2 LYS A 37 -12.909 0.217 -5.625 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -11.391 -0.642 -5.802 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 -12.708 -2.365 -5.206 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -12.304 -1.853 -3.638 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -13.792 -1.404 -4.320 1.00 1.00 H new ATOM 596 N ILE A 38 -12.629 4.683 -0.438 1.00 1.00 N ATOM 597 CA ILE A 38 -12.150 5.544 0.639 1.00 1.00 C ATOM 598 C ILE A 38 -10.818 5.036 1.167 1.00 1.00 C ATOM 599 O ILE A 38 -10.673 3.852 1.457 1.00 1.00 O ATOM 600 CB ILE A 38 -13.159 5.636 1.800 1.00 1.00 C ATOM 601 CG1 ILE A 38 -14.511 6.111 1.284 1.00 1.00 C ATOM 602 CG2 ILE A 38 -12.645 6.568 2.889 1.00 1.00 C ATOM 603 CD1 ILE A 38 -15.689 5.422 1.968 1.00 1.00 C ATOM 0 H ILE A 38 -13.236 3.921 -0.137 1.00 1.00 H new ATOM 0 HA ILE A 38 -12.027 6.543 0.220 1.00 1.00 H new ATOM 0 HB ILE A 38 -13.279 4.643 2.233 1.00 1.00 H new ATOM 0 HG12 ILE A 38 -14.592 7.188 1.432 1.00 1.00 H new ATOM 0 HG13 ILE A 38 -14.567 5.932 0.210 1.00 1.00 H new ATOM 0 HG21 ILE A 38 -13.373 6.618 3.699 1.00 1.00 H new ATOM 0 HG22 ILE A 38 -11.699 6.189 3.275 1.00 1.00 H new ATOM 0 HG23 ILE A 38 -12.495 7.565 2.474 1.00 1.00 H new ATOM 0 HD11 ILE A 38 -16.623 5.804 1.556 1.00 1.00 H new ATOM 0 HD12 ILE A 38 -15.630 4.347 1.798 1.00 1.00 H new ATOM 0 HD13 ILE A 38 -15.656 5.622 3.039 1.00 1.00 H new ATOM 615 N MET A 39 -9.839 5.931 1.272 1.00 1.00 N ATOM 616 CA MET A 39 -8.525 5.535 1.752 1.00 1.00 C ATOM 617 C MET A 39 -7.958 6.529 2.764 1.00 1.00 C ATOM 618 O MET A 39 -8.190 7.737 2.679 1.00 1.00 O ATOM 619 CB MET A 39 -7.558 5.393 0.569 1.00 1.00 C ATOM 620 CG MET A 39 -8.209 5.627 -0.798 1.00 1.00 C ATOM 621 SD MET A 39 -8.476 7.372 -1.138 1.00 1.00 S ATOM 622 CE MET A 39 -7.568 7.568 -2.664 1.00 1.00 C ATOM 0 H MET A 39 -9.931 6.919 1.035 1.00 1.00 H new ATOM 0 HA MET A 39 -8.638 4.576 2.258 1.00 1.00 H new ATOM 0 HB2 MET A 39 -6.738 6.100 0.696 1.00 1.00 H new ATOM 0 HB3 MET A 39 -7.122 4.394 0.587 1.00 1.00 H new ATOM 0 HG2 MET A 39 -7.577 5.200 -1.577 1.00 1.00 H new ATOM 0 HG3 MET A 39 -9.163 5.101 -0.838 1.00 1.00 H new ATOM 0 HE1 MET A 39 -7.536 8.623 -2.935 1.00 1.00 H new ATOM 0 HE2 MET A 39 -6.552 7.196 -2.533 1.00 1.00 H new ATOM 0 HE3 MET A 39 -8.061 7.005 -3.456 1.00 1.00 H new ATOM 632 N VAL A 40 -7.190 6.002 3.707 1.00 1.00 N ATOM 633 CA VAL A 40 -6.552 6.808 4.741 1.00 1.00 C ATOM 634 C VAL A 40 -5.042 6.638 4.674 1.00 1.00 C ATOM 635 O VAL A 40 -4.542 5.511 4.619 1.00 1.00 O ATOM 636 CB VAL A 40 -7.039 6.397 6.153 1.00 1.00 C ATOM 637 CG1 VAL A 40 -6.984 7.584 7.100 1.00 1.00 C ATOM 638 CG2 VAL A 40 -8.441 5.831 6.097 1.00 1.00 C ATOM 0 H VAL A 40 -6.991 5.004 3.778 1.00 1.00 H new ATOM 0 HA VAL A 40 -6.822 7.849 4.564 1.00 1.00 H new ATOM 0 HB VAL A 40 -6.373 5.620 6.529 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -7.329 7.278 8.087 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -5.958 7.946 7.170 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -7.625 8.381 6.722 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -8.760 5.550 7.101 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -9.121 6.583 5.697 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -8.453 4.952 5.453 1.00 1.00 H new ATOM 648 N VAL A 41 -4.312 7.745 4.666 1.00 1.00 N ATOM 649 CA VAL A 41 -2.856 7.704 4.592 1.00 1.00 C ATOM 650 C VAL A 41 -2.216 8.373 5.812 1.00 1.00 C ATOM 651 O VAL A 41 -2.566 9.502 6.158 1.00 1.00 O ATOM 652 CB VAL A 41 -2.342 8.408 3.317 1.00 1.00 C ATOM 653 CG1 VAL A 41 -1.764 7.393 2.337 1.00 1.00 C ATOM 654 CG2 VAL A 41 -3.462 9.200 2.668 1.00 1.00 C ATOM 0 H VAL A 41 -4.705 8.685 4.710 1.00 1.00 H new ATOM 0 HA VAL A 41 -2.573 6.652 4.567 1.00 1.00 H new ATOM 0 HB VAL A 41 -1.546 9.098 3.599 1.00 1.00 H new ATOM 0 HG11 VAL A 41 -1.408 7.910 1.446 1.00 1.00 H new ATOM 0 HG12 VAL A 41 -0.934 6.865 2.807 1.00 1.00 H new ATOM 0 HG13 VAL A 41 -2.537 6.677 2.057 1.00 1.00 H new ATOM 0 HG21 VAL A 41 -3.087 9.692 1.770 1.00 1.00 H new ATOM 0 HG22 VAL A 41 -4.276 8.526 2.400 1.00 1.00 H new ATOM 0 HG23 VAL A 41 -3.829 9.952 3.367 1.00 1.00 H new ATOM 664 N GLY A 42 -1.271 7.676 6.440 1.00 1.00 N ATOM 665 CA GLY A 42 -0.596 8.231 7.593 1.00 1.00 C ATOM 666 C GLY A 42 0.231 9.440 7.220 1.00 1.00 C ATOM 667 O GLY A 42 0.670 9.567 6.076 1.00 1.00 O ATOM 0 H GLY A 42 -0.965 6.741 6.170 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -1.332 8.510 8.347 1.00 1.00 H new ATOM 0 HA3 GLY A 42 0.047 7.473 8.040 1.00 1.00 H new ATOM 671 N ARG A 43 0.430 10.347 8.164 1.00 1.00 N ATOM 672 CA ARG A 43 1.206 11.554 7.893 1.00 1.00 C ATOM 673 C ARG A 43 2.655 11.227 7.491 1.00 1.00 C ATOM 674 O ARG A 43 3.190 11.787 6.554 1.00 1.00 O ATOM 675 CB ARG A 43 1.195 12.459 9.129 1.00 1.00 C ATOM 676 CG ARG A 43 1.193 13.938 8.795 1.00 1.00 C ATOM 677 CD ARG A 43 2.596 14.450 8.553 1.00 1.00 C ATOM 678 NE ARG A 43 2.707 15.193 7.306 1.00 1.00 N ATOM 679 CZ ARG A 43 3.853 15.682 6.833 1.00 1.00 C ATOM 680 NH1 ARG A 43 4.983 15.520 7.510 1.00 1.00 N ATOM 681 NH2 ARG A 43 3.872 16.338 5.681 1.00 1.00 N ATOM 0 H ARG A 43 0.071 10.275 9.116 1.00 1.00 H new ATOM 0 HA ARG A 43 0.742 12.070 7.052 1.00 1.00 H new ATOM 0 HB2 ARG A 43 0.315 12.229 9.730 1.00 1.00 H new ATOM 0 HB3 ARG A 43 2.068 12.234 9.742 1.00 1.00 H new ATOM 0 HG2 ARG A 43 0.583 14.112 7.909 1.00 1.00 H new ATOM 0 HG3 ARG A 43 0.736 14.497 9.612 1.00 1.00 H new ATOM 0 HD2 ARG A 43 2.894 15.091 9.383 1.00 1.00 H new ATOM 0 HD3 ARG A 43 3.289 13.609 8.535 1.00 1.00 H new ATOM 0 HE ARG A 43 1.858 15.348 6.762 1.00 1.00 H new ATOM 0 HH11 ARG A 43 4.978 15.019 8.398 1.00 1.00 H new ATOM 0 HH12 ARG A 43 5.856 15.897 7.142 1.00 1.00 H new ATOM 0 HH21 ARG A 43 3.008 16.469 5.155 1.00 1.00 H new ATOM 0 HH22 ARG A 43 4.750 16.711 5.321 1.00 1.00 H new ATOM 695 N ARG A 44 3.273 10.292 8.177 1.00 1.00 N ATOM 696 CA ARG A 44 4.643 9.929 7.855 1.00 1.00 C ATOM 697 C ARG A 44 4.709 9.440 6.413 1.00 1.00 C ATOM 698 O ARG A 44 5.670 9.697 5.696 1.00 1.00 O ATOM 699 CB ARG A 44 5.156 8.847 8.793 1.00 1.00 C ATOM 700 CG ARG A 44 6.558 9.113 9.333 1.00 1.00 C ATOM 701 CD ARG A 44 7.619 8.942 8.258 1.00 1.00 C ATOM 702 NE ARG A 44 8.403 10.157 8.076 1.00 1.00 N ATOM 703 CZ ARG A 44 9.329 10.584 8.933 1.00 1.00 C ATOM 704 NH1 ARG A 44 9.570 9.908 10.049 1.00 1.00 N ATOM 705 NH2 ARG A 44 10.015 11.688 8.672 1.00 1.00 N ATOM 0 H ARG A 44 2.860 9.773 8.952 1.00 1.00 H new ATOM 0 HA ARG A 44 5.275 10.809 7.976 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.466 8.750 9.632 1.00 1.00 H new ATOM 0 HB3 ARG A 44 5.155 7.893 8.267 1.00 1.00 H new ATOM 0 HG2 ARG A 44 6.607 10.125 9.734 1.00 1.00 H new ATOM 0 HG3 ARG A 44 6.765 8.432 10.159 1.00 1.00 H new ATOM 0 HD2 ARG A 44 8.281 8.119 8.528 1.00 1.00 H new ATOM 0 HD3 ARG A 44 7.142 8.672 7.316 1.00 1.00 H new ATOM 0 HE ARG A 44 8.232 10.715 7.240 1.00 1.00 H new ATOM 0 HH11 ARG A 44 9.045 9.058 10.254 1.00 1.00 H new ATOM 0 HH12 ARG A 44 10.280 10.239 10.702 1.00 1.00 H new ATOM 0 HH21 ARG A 44 9.834 12.210 7.815 1.00 1.00 H new ATOM 0 HH22 ARG A 44 10.724 12.015 9.328 1.00 1.00 H new ATOM 719 N THR A 45 3.677 8.753 6.000 1.00 1.00 N ATOM 720 CA THR A 45 3.608 8.231 4.643 1.00 1.00 C ATOM 721 C THR A 45 3.590 9.376 3.631 1.00 1.00 C ATOM 722 O THR A 45 4.298 9.328 2.620 1.00 1.00 O ATOM 723 CB THR A 45 2.371 7.340 4.475 1.00 1.00 C ATOM 724 OG1 THR A 45 2.485 6.180 5.280 1.00 1.00 O ATOM 725 CG2 THR A 45 2.149 6.895 3.042 1.00 1.00 C ATOM 0 H THR A 45 2.866 8.536 6.579 1.00 1.00 H new ATOM 0 HA THR A 45 4.495 7.625 4.458 1.00 1.00 H new ATOM 0 HB THR A 45 1.521 7.950 4.781 1.00 1.00 H new ATOM 0 HG1 THR A 45 1.701 6.109 5.864 1.00 1.00 H new ATOM 0 HG21 THR A 45 1.259 6.268 2.989 1.00 1.00 H new ATOM 0 HG22 THR A 45 2.014 7.770 2.406 1.00 1.00 H new ATOM 0 HG23 THR A 45 3.014 6.327 2.699 1.00 1.00 H new ATOM 733 N TYR A 46 2.784 10.397 3.913 1.00 1.00 N ATOM 734 CA TYR A 46 2.679 11.544 3.013 1.00 1.00 C ATOM 735 C TYR A 46 4.063 12.097 2.670 1.00 1.00 C ATOM 736 O TYR A 46 4.300 12.586 1.572 1.00 1.00 O ATOM 737 CB TYR A 46 1.822 12.640 3.658 1.00 1.00 C ATOM 738 CG TYR A 46 0.414 12.691 3.115 1.00 1.00 C ATOM 739 CD1 TYR A 46 0.120 13.349 1.929 1.00 1.00 C ATOM 740 CD2 TYR A 46 -0.625 12.072 3.798 1.00 1.00 C ATOM 741 CE1 TYR A 46 -1.170 13.391 1.437 1.00 1.00 C ATOM 742 CE2 TYR A 46 -1.918 12.109 3.314 1.00 1.00 C ATOM 743 CZ TYR A 46 -2.185 12.770 2.134 1.00 1.00 C ATOM 744 OH TYR A 46 -3.464 12.817 1.652 1.00 1.00 O ATOM 0 H TYR A 46 2.200 10.455 4.747 1.00 1.00 H new ATOM 0 HA TYR A 46 2.204 11.212 2.090 1.00 1.00 H new ATOM 0 HB2 TYR A 46 1.783 12.475 4.735 1.00 1.00 H new ATOM 0 HB3 TYR A 46 2.301 13.606 3.500 1.00 1.00 H new ATOM 0 HD1 TYR A 46 0.913 13.836 1.382 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -0.418 11.553 4.723 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -1.382 13.907 0.512 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -2.715 11.623 3.857 1.00 1.00 H new ATOM 0 HH TYR A 46 -4.060 12.331 2.259 1.00 1.00 H new ATOM 754 N GLU A 47 4.977 12.007 3.632 1.00 1.00 N ATOM 755 CA GLU A 47 6.331 12.491 3.430 1.00 1.00 C ATOM 756 C GLU A 47 6.971 11.834 2.202 1.00 1.00 C ATOM 757 O GLU A 47 7.883 12.397 1.593 1.00 1.00 O ATOM 758 CB GLU A 47 7.187 12.218 4.664 1.00 1.00 C ATOM 759 CG GLU A 47 7.768 13.474 5.280 1.00 1.00 C ATOM 760 CD GLU A 47 8.844 14.122 4.420 1.00 1.00 C ATOM 761 OE1 GLU A 47 9.266 13.499 3.422 1.00 1.00 O ATOM 762 OE2 GLU A 47 9.266 15.249 4.752 1.00 1.00 O ATOM 0 H GLU A 47 4.802 11.605 4.553 1.00 1.00 H new ATOM 0 HA GLU A 47 6.279 13.567 3.263 1.00 1.00 H new ATOM 0 HB2 GLU A 47 6.583 11.702 5.410 1.00 1.00 H new ATOM 0 HB3 GLU A 47 8.000 11.545 4.392 1.00 1.00 H new ATOM 0 HG2 GLU A 47 6.966 14.192 5.449 1.00 1.00 H new ATOM 0 HG3 GLU A 47 8.189 13.231 6.256 1.00 1.00 H new ATOM 769 N SER A 48 6.490 10.648 1.848 1.00 1.00 N ATOM 770 CA SER A 48 7.016 9.923 0.700 1.00 1.00 C ATOM 771 C SER A 48 6.213 10.237 -0.568 1.00 1.00 C ATOM 772 O SER A 48 6.753 10.196 -1.678 1.00 1.00 O ATOM 773 CB SER A 48 6.995 8.420 0.979 1.00 1.00 C ATOM 774 OG SER A 48 8.225 7.986 1.539 1.00 1.00 O ATOM 0 H SER A 48 5.736 10.169 2.340 1.00 1.00 H new ATOM 0 HA SER A 48 8.045 10.244 0.535 1.00 1.00 H new ATOM 0 HB2 SER A 48 6.178 8.185 1.662 1.00 1.00 H new ATOM 0 HB3 SER A 48 6.802 7.878 0.053 1.00 1.00 H new ATOM 0 HG SER A 48 8.055 7.270 2.186 1.00 1.00 H new ATOM 780 N PHE A 49 4.933 10.548 -0.403 1.00 1.00 N ATOM 781 CA PHE A 49 4.067 10.872 -1.529 1.00 1.00 C ATOM 782 C PHE A 49 4.736 11.888 -2.460 1.00 1.00 C ATOM 783 O PHE A 49 4.768 13.078 -2.157 1.00 1.00 O ATOM 784 CB PHE A 49 2.741 11.446 -1.035 1.00 1.00 C ATOM 785 CG PHE A 49 1.689 10.406 -0.810 1.00 1.00 C ATOM 786 CD1 PHE A 49 2.023 9.164 -0.291 1.00 1.00 C ATOM 787 CD2 PHE A 49 0.364 10.657 -1.127 1.00 1.00 C ATOM 788 CE1 PHE A 49 1.056 8.195 -0.095 1.00 1.00 C ATOM 789 CE2 PHE A 49 -0.606 9.694 -0.931 1.00 1.00 C ATOM 790 CZ PHE A 49 -0.260 8.461 -0.416 1.00 1.00 C ATOM 0 H PHE A 49 4.470 10.583 0.505 1.00 1.00 H new ATOM 0 HA PHE A 49 3.883 9.950 -2.081 1.00 1.00 H new ATOM 0 HB2 PHE A 49 2.912 11.986 -0.104 1.00 1.00 H new ATOM 0 HB3 PHE A 49 2.375 12.171 -1.762 1.00 1.00 H new ATOM 0 HD1 PHE A 49 3.051 8.951 -0.037 1.00 1.00 H new ATOM 0 HD2 PHE A 49 0.086 11.619 -1.533 1.00 1.00 H new ATOM 0 HE1 PHE A 49 1.330 7.231 0.309 1.00 1.00 H new ATOM 0 HE2 PHE A 49 -1.635 9.906 -1.181 1.00 1.00 H new ATOM 0 HZ PHE A 49 -1.017 7.706 -0.265 1.00 1.00 H new ATOM 800 N PRO A 50 5.275 11.436 -3.614 1.00 1.00 N ATOM 801 CA PRO A 50 5.936 12.324 -4.564 1.00 1.00 C ATOM 802 C PRO A 50 4.968 13.305 -5.210 1.00 1.00 C ATOM 803 O PRO A 50 5.335 14.431 -5.535 1.00 1.00 O ATOM 804 CB PRO A 50 6.513 11.371 -5.625 1.00 1.00 C ATOM 805 CG PRO A 50 6.458 10.015 -5.010 1.00 1.00 C ATOM 806 CD PRO A 50 5.279 10.038 -4.081 1.00 1.00 C ATOM 0 HA PRO A 50 6.690 12.941 -4.075 1.00 1.00 H new ATOM 0 HB2 PRO A 50 5.931 11.409 -6.546 1.00 1.00 H new ATOM 0 HB3 PRO A 50 7.536 11.644 -5.884 1.00 1.00 H new ATOM 0 HG2 PRO A 50 6.341 9.244 -5.772 1.00 1.00 H new ATOM 0 HG3 PRO A 50 7.378 9.793 -4.470 1.00 1.00 H new ATOM 0 HD2 PRO A 50 4.353 9.778 -4.593 1.00 1.00 H new ATOM 0 HD3 PRO A 50 5.397 9.334 -3.257 1.00 1.00 H new ATOM 814 N LYS A 51 3.723 12.875 -5.392 1.00 1.00 N ATOM 815 CA LYS A 51 2.697 13.721 -5.992 1.00 1.00 C ATOM 816 C LYS A 51 1.642 14.115 -4.955 1.00 1.00 C ATOM 817 O LYS A 51 0.528 13.596 -4.970 1.00 1.00 O ATOM 818 CB LYS A 51 2.032 12.995 -7.160 1.00 1.00 C ATOM 819 CG LYS A 51 2.661 13.286 -8.510 1.00 1.00 C ATOM 820 CD LYS A 51 1.694 14.024 -9.424 1.00 1.00 C ATOM 821 CE LYS A 51 0.988 13.086 -10.386 1.00 1.00 C ATOM 822 NZ LYS A 51 1.942 12.418 -11.327 1.00 1.00 N ATOM 0 H LYS A 51 3.400 11.943 -5.132 1.00 1.00 H new ATOM 0 HA LYS A 51 3.176 14.628 -6.360 1.00 1.00 H new ATOM 0 HB2 LYS A 51 2.072 11.921 -6.976 1.00 1.00 H new ATOM 0 HB3 LYS A 51 0.979 13.273 -7.194 1.00 1.00 H new ATOM 0 HG2 LYS A 51 3.562 13.884 -8.372 1.00 1.00 H new ATOM 0 HG3 LYS A 51 2.967 12.351 -8.980 1.00 1.00 H new ATOM 0 HD2 LYS A 51 0.953 14.548 -8.820 1.00 1.00 H new ATOM 0 HD3 LYS A 51 2.237 14.781 -9.990 1.00 1.00 H new ATOM 0 HE2 LYS A 51 0.447 12.327 -9.820 1.00 1.00 H new ATOM 0 HE3 LYS A 51 0.247 13.645 -10.958 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 1.439 12.143 -12.195 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 2.711 13.076 -11.566 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 2.340 11.570 -10.874 1.00 1.00 H new ATOM 836 N ARG A 52 2.006 15.024 -4.051 1.00 1.00 N ATOM 837 CA ARG A 52 1.088 15.473 -3.010 1.00 1.00 C ATOM 838 C ARG A 52 0.979 16.991 -3.013 1.00 1.00 C ATOM 839 O ARG A 52 1.905 17.697 -3.398 1.00 1.00 O ATOM 840 CB ARG A 52 1.571 14.972 -1.632 1.00 1.00 C ATOM 841 CG ARG A 52 1.936 16.091 -0.665 1.00 1.00 C ATOM 842 CD ARG A 52 2.593 15.539 0.598 1.00 1.00 C ATOM 843 NE ARG A 52 3.789 16.295 0.967 1.00 1.00 N ATOM 844 CZ ARG A 52 4.962 16.167 0.355 1.00 1.00 C ATOM 845 NH1 ARG A 52 5.092 15.347 -0.682 1.00 1.00 N ATOM 846 NH2 ARG A 52 6.009 16.862 0.779 1.00 1.00 N ATOM 0 H ARG A 52 2.927 15.461 -4.020 1.00 1.00 H new ATOM 0 HA ARG A 52 0.100 15.059 -3.211 1.00 1.00 H new ATOM 0 HB2 ARG A 52 0.789 14.358 -1.184 1.00 1.00 H new ATOM 0 HB3 ARG A 52 2.440 14.329 -1.774 1.00 1.00 H new ATOM 0 HG2 ARG A 52 2.614 16.791 -1.154 1.00 1.00 H new ATOM 0 HG3 ARG A 52 1.039 16.650 -0.397 1.00 1.00 H new ATOM 0 HD2 ARG A 52 1.878 15.567 1.420 1.00 1.00 H new ATOM 0 HD3 ARG A 52 2.859 14.494 0.442 1.00 1.00 H new ATOM 0 HE ARG A 52 3.719 16.959 1.738 1.00 1.00 H new ATOM 0 HH11 ARG A 52 4.289 14.812 -1.013 1.00 1.00 H new ATOM 0 HH12 ARG A 52 5.995 15.253 -1.148 1.00 1.00 H new ATOM 0 HH21 ARG A 52 5.914 17.494 1.574 1.00 1.00 H new ATOM 0 HH22 ARG A 52 6.910 16.765 0.310 1.00 1.00 H new ATOM 860 N PRO A 53 -0.178 17.531 -2.572 1.00 1.00 N ATOM 861 CA PRO A 53 -1.316 16.720 -2.102 1.00 1.00 C ATOM 862 C PRO A 53 -2.118 16.129 -3.258 1.00 1.00 C ATOM 863 O PRO A 53 -1.714 16.201 -4.416 1.00 1.00 O ATOM 864 CB PRO A 53 -2.155 17.736 -1.322 1.00 1.00 C ATOM 865 CG PRO A 53 -1.882 19.034 -2.004 1.00 1.00 C ATOM 866 CD PRO A 53 -0.465 18.970 -2.497 1.00 1.00 C ATOM 0 HA PRO A 53 -1.002 15.859 -1.512 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -3.215 17.485 -1.353 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -1.866 17.769 -0.272 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -2.574 19.190 -2.832 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -2.016 19.869 -1.316 1.00 1.00 H new ATOM 0 HD2 PRO A 53 -0.359 19.449 -3.470 1.00 1.00 H new ATOM 0 HD3 PRO A 53 0.218 19.478 -1.816 1.00 1.00 H new ATOM 874 N LEU A 54 -3.265 15.536 -2.937 1.00 1.00 N ATOM 875 CA LEU A 54 -4.123 14.943 -3.951 1.00 1.00 C ATOM 876 C LEU A 54 -5.586 15.266 -3.680 1.00 1.00 C ATOM 877 O LEU A 54 -6.351 14.408 -3.242 1.00 1.00 O ATOM 878 CB LEU A 54 -3.912 13.426 -4.000 1.00 1.00 C ATOM 879 CG LEU A 54 -2.984 12.934 -5.112 1.00 1.00 C ATOM 880 CD1 LEU A 54 -2.371 11.591 -4.748 1.00 1.00 C ATOM 881 CD2 LEU A 54 -3.733 12.844 -6.438 1.00 1.00 C ATOM 0 H LEU A 54 -3.619 15.455 -1.984 1.00 1.00 H new ATOM 0 HA LEU A 54 -3.855 15.368 -4.918 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -3.509 13.100 -3.041 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -4.882 12.944 -4.118 1.00 1.00 H new ATOM 0 HG LEU A 54 -2.176 13.656 -5.225 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -1.715 11.260 -5.553 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -1.795 11.691 -3.828 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -3.163 10.857 -4.601 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -3.055 12.492 -7.216 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -4.565 12.147 -6.339 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -4.115 13.829 -6.708 1.00 1.00 H new ATOM 893 N PRO A 55 -5.989 16.524 -3.928 1.00 1.00 N ATOM 894 CA PRO A 55 -7.370 16.978 -3.701 1.00 1.00 C ATOM 895 C PRO A 55 -8.325 16.570 -4.819 1.00 1.00 C ATOM 896 O PRO A 55 -8.933 17.416 -5.462 1.00 1.00 O ATOM 897 CB PRO A 55 -7.219 18.498 -3.670 1.00 1.00 C ATOM 898 CG PRO A 55 -6.040 18.790 -4.540 1.00 1.00 C ATOM 899 CD PRO A 55 -5.126 17.594 -4.441 1.00 1.00 C ATOM 0 HA PRO A 55 -7.799 16.542 -2.799 1.00 1.00 H new ATOM 0 HB2 PRO A 55 -8.116 18.991 -4.044 1.00 1.00 H new ATOM 0 HB3 PRO A 55 -7.058 18.857 -2.654 1.00 1.00 H new ATOM 0 HG2 PRO A 55 -6.351 18.956 -5.571 1.00 1.00 H new ATOM 0 HG3 PRO A 55 -5.530 19.696 -4.211 1.00 1.00 H new ATOM 0 HD2 PRO A 55 -4.703 17.334 -5.412 1.00 1.00 H new ATOM 0 HD3 PRO A 55 -4.289 17.787 -3.770 1.00 1.00 H new ATOM 907 N GLU A 56 -8.459 15.266 -5.032 1.00 1.00 N ATOM 908 CA GLU A 56 -9.347 14.750 -6.069 1.00 1.00 C ATOM 909 C GLU A 56 -9.918 13.392 -5.679 1.00 1.00 C ATOM 910 O GLU A 56 -10.335 12.621 -6.545 1.00 1.00 O ATOM 911 CB GLU A 56 -8.602 14.634 -7.410 1.00 1.00 C ATOM 912 CG GLU A 56 -8.768 15.844 -8.300 1.00 1.00 C ATOM 913 CD GLU A 56 -7.594 16.043 -9.235 1.00 1.00 C ATOM 914 OE1 GLU A 56 -6.445 16.061 -8.743 1.00 1.00 O ATOM 915 OE2 GLU A 56 -7.816 16.181 -10.456 1.00 1.00 O ATOM 0 H GLU A 56 -7.966 14.548 -4.502 1.00 1.00 H new ATOM 0 HA GLU A 56 -10.172 15.454 -6.178 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -7.541 14.480 -7.215 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -8.960 13.751 -7.940 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -9.681 15.737 -8.886 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -8.889 16.733 -7.680 1.00 1.00 H new ATOM 922 N ARG A 57 -9.943 13.095 -4.388 1.00 1.00 N ATOM 923 CA ARG A 57 -10.469 11.831 -3.898 1.00 1.00 C ATOM 924 C ARG A 57 -10.770 11.918 -2.407 1.00 1.00 C ATOM 925 O ARG A 57 -10.403 12.896 -1.752 1.00 1.00 O ATOM 926 CB ARG A 57 -9.483 10.681 -4.146 1.00 1.00 C ATOM 927 CG ARG A 57 -9.673 9.968 -5.472 1.00 1.00 C ATOM 928 CD ARG A 57 -11.110 9.516 -5.667 1.00 1.00 C ATOM 929 NE ARG A 57 -11.846 10.404 -6.563 1.00 1.00 N ATOM 930 CZ ARG A 57 -13.067 10.146 -7.030 1.00 1.00 C ATOM 931 NH1 ARG A 57 -13.688 9.022 -6.698 1.00 1.00 N ATOM 932 NH2 ARG A 57 -13.669 11.018 -7.827 1.00 1.00 N ATOM 0 H ARG A 57 -9.602 13.718 -3.656 1.00 1.00 H new ATOM 0 HA ARG A 57 -11.389 11.629 -4.446 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -8.467 11.073 -4.101 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -9.581 9.954 -3.339 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -9.387 10.633 -6.287 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -9.010 9.104 -5.519 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -11.120 8.504 -6.071 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -11.613 9.478 -4.701 1.00 1.00 H new ATOM 0 HE ARG A 57 -11.398 11.275 -6.849 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -13.231 8.350 -6.082 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -14.623 8.830 -7.059 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -13.197 11.886 -8.082 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -14.604 10.821 -8.185 1.00 1.00 H new ATOM 946 N THR A 58 -11.439 10.901 -1.880 1.00 1.00 N ATOM 947 CA THR A 58 -11.764 10.894 -0.465 1.00 1.00 C ATOM 948 C THR A 58 -10.562 10.432 0.358 1.00 1.00 C ATOM 949 O THR A 58 -10.503 9.289 0.812 1.00 1.00 O ATOM 950 CB THR A 58 -12.971 9.991 -0.207 1.00 1.00 C ATOM 951 OG1 THR A 58 -13.115 9.050 -1.256 1.00 1.00 O ATOM 952 CG2 THR A 58 -14.276 10.753 -0.107 1.00 1.00 C ATOM 0 H THR A 58 -11.761 10.086 -2.402 1.00 1.00 H new ATOM 0 HA THR A 58 -12.017 11.909 -0.159 1.00 1.00 H new ATOM 0 HB THR A 58 -12.774 9.505 0.748 1.00 1.00 H new ATOM 0 HG1 THR A 58 -13.890 8.477 -1.078 1.00 1.00 H new ATOM 0 HG21 THR A 58 -15.092 10.054 0.077 1.00 1.00 H new ATOM 0 HG22 THR A 58 -14.218 11.467 0.714 1.00 1.00 H new ATOM 0 HG23 THR A 58 -14.458 11.287 -1.040 1.00 1.00 H new ATOM 960 N ASN A 59 -9.607 11.346 0.552 1.00 1.00 N ATOM 961 CA ASN A 59 -8.405 11.042 1.333 1.00 1.00 C ATOM 962 C ASN A 59 -8.480 11.651 2.723 1.00 1.00 C ATOM 963 O ASN A 59 -8.959 12.763 2.903 1.00 1.00 O ATOM 964 CB ASN A 59 -7.161 11.563 0.616 1.00 1.00 C ATOM 965 CG ASN A 59 -6.255 10.441 0.172 1.00 1.00 C ATOM 966 OD1 ASN A 59 -5.251 10.135 0.813 1.00 1.00 O ATOM 967 ND2 ASN A 59 -6.594 9.829 -0.957 1.00 1.00 N ATOM 0 H ASN A 59 -9.642 12.296 0.182 1.00 1.00 H new ATOM 0 HA ASN A 59 -8.342 9.958 1.433 1.00 1.00 H new ATOM 0 HB2 ASN A 59 -7.462 12.151 -0.251 1.00 1.00 H new ATOM 0 HB3 ASN A 59 -6.613 12.231 1.280 1.00 1.00 H new ATOM 0 HD21 ASN A 59 -6.013 9.075 -1.322 1.00 1.00 H new ATOM 0 HD22 ASN A 59 -7.435 10.113 -1.458 1.00 1.00 H new ATOM 974 N VAL A 60 -7.979 10.913 3.707 1.00 1.00 N ATOM 975 CA VAL A 60 -7.956 11.378 5.081 1.00 1.00 C ATOM 976 C VAL A 60 -6.534 11.341 5.642 1.00 1.00 C ATOM 977 O VAL A 60 -5.857 10.318 5.570 1.00 1.00 O ATOM 978 CB VAL A 60 -8.875 10.513 5.971 1.00 1.00 C ATOM 979 CG1 VAL A 60 -8.823 10.964 7.432 1.00 1.00 C ATOM 980 CG2 VAL A 60 -10.309 10.543 5.450 1.00 1.00 C ATOM 0 H VAL A 60 -7.581 9.983 3.573 1.00 1.00 H new ATOM 0 HA VAL A 60 -8.318 12.406 5.085 1.00 1.00 H new ATOM 0 HB VAL A 60 -8.510 9.487 5.927 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.481 10.334 8.031 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.802 10.878 7.803 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -9.149 12.002 7.504 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -10.942 9.928 6.090 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -10.677 11.569 5.455 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -10.335 10.153 4.432 1.00 1.00 H new ATOM 990 N VAL A 61 -6.080 12.442 6.225 1.00 1.00 N ATOM 991 CA VAL A 61 -4.740 12.476 6.804 1.00 1.00 C ATOM 992 C VAL A 61 -4.790 12.060 8.273 1.00 1.00 C ATOM 993 O VAL A 61 -5.601 12.568 9.035 1.00 1.00 O ATOM 994 CB VAL A 61 -4.095 13.869 6.697 1.00 1.00 C ATOM 995 CG1 VAL A 61 -3.367 14.239 7.985 1.00 1.00 C ATOM 996 CG2 VAL A 61 -3.141 13.923 5.514 1.00 1.00 C ATOM 0 H VAL A 61 -6.608 13.311 6.310 1.00 1.00 H new ATOM 0 HA VAL A 61 -4.129 11.775 6.234 1.00 1.00 H new ATOM 0 HB VAL A 61 -4.891 14.597 6.539 1.00 1.00 H new ATOM 0 HG11 VAL A 61 -2.921 15.228 7.880 1.00 1.00 H new ATOM 0 HG12 VAL A 61 -4.075 14.246 8.814 1.00 1.00 H new ATOM 0 HG13 VAL A 61 -2.584 13.507 8.183 1.00 1.00 H new ATOM 0 HG21 VAL A 61 -2.693 14.915 5.453 1.00 1.00 H new ATOM 0 HG22 VAL A 61 -2.356 13.178 5.645 1.00 1.00 H new ATOM 0 HG23 VAL A 61 -3.689 13.715 4.595 1.00 1.00 H new ATOM 1006 N LEU A 62 -3.931 11.134 8.668 1.00 1.00 N ATOM 1007 CA LEU A 62 -3.907 10.676 10.052 1.00 1.00 C ATOM 1008 C LEU A 62 -2.770 11.351 10.822 1.00 1.00 C ATOM 1009 O LEU A 62 -1.618 11.302 10.404 1.00 1.00 O ATOM 1010 CB LEU A 62 -3.740 9.163 10.095 1.00 1.00 C ATOM 1011 CG LEU A 62 -5.036 8.369 10.240 1.00 1.00 C ATOM 1012 CD1 LEU A 62 -4.787 6.891 9.969 1.00 1.00 C ATOM 1013 CD2 LEU A 62 -5.636 8.571 11.621 1.00 1.00 C ATOM 0 H LEU A 62 -3.246 10.687 8.058 1.00 1.00 H new ATOM 0 HA LEU A 62 -4.852 10.945 10.524 1.00 1.00 H new ATOM 0 HB2 LEU A 62 -3.237 8.843 9.182 1.00 1.00 H new ATOM 0 HB3 LEU A 62 -3.083 8.910 10.927 1.00 1.00 H new ATOM 0 HG LEU A 62 -5.751 8.736 9.504 1.00 1.00 H new ATOM 0 HD11 LEU A 62 -5.721 6.339 10.076 1.00 1.00 H new ATOM 0 HD12 LEU A 62 -4.406 6.766 8.955 1.00 1.00 H new ATOM 0 HD13 LEU A 62 -4.056 6.509 10.681 1.00 1.00 H new ATOM 0 HD21 LEU A 62 -6.559 7.997 11.704 1.00 1.00 H new ATOM 0 HD22 LEU A 62 -4.929 8.233 12.378 1.00 1.00 H new ATOM 0 HD23 LEU A 62 -5.852 9.629 11.773 1.00 1.00 H new ATOM 1025 N THR A 63 -3.118 11.989 11.928 1.00 1.00 N ATOM 1026 CA THR A 63 -2.133 12.688 12.744 1.00 1.00 C ATOM 1027 C THR A 63 -2.337 12.385 14.215 1.00 1.00 C ATOM 1028 O THR A 63 -3.423 11.986 14.623 1.00 1.00 O ATOM 1029 CB THR A 63 -2.230 14.195 12.501 1.00 1.00 C ATOM 1030 OG1 THR A 63 -3.326 14.745 13.206 1.00 1.00 O ATOM 1031 CG2 THR A 63 -2.388 14.567 11.036 1.00 1.00 C ATOM 0 H THR A 63 -4.073 12.038 12.283 1.00 1.00 H new ATOM 0 HA THR A 63 -1.140 12.341 12.458 1.00 1.00 H new ATOM 0 HB THR A 63 -1.284 14.603 12.857 1.00 1.00 H new ATOM 0 HG1 THR A 63 -2.997 15.253 13.977 1.00 1.00 H new ATOM 0 HG21 THR A 63 -2.450 15.651 10.941 1.00 1.00 H new ATOM 0 HG22 THR A 63 -1.529 14.202 10.473 1.00 1.00 H new ATOM 0 HG23 THR A 63 -3.298 14.115 10.642 1.00 1.00 H new ATOM 1039 N HIS A 64 -1.298 12.581 14.995 1.00 1.00 N ATOM 1040 CA HIS A 64 -1.360 12.326 16.426 1.00 1.00 C ATOM 1041 C HIS A 64 -2.317 13.293 17.107 1.00 1.00 C ATOM 1042 O HIS A 64 -3.073 12.912 17.995 1.00 1.00 O ATOM 1043 CB HIS A 64 0.035 12.425 17.048 1.00 1.00 C ATOM 1044 CG HIS A 64 0.643 11.095 17.390 1.00 1.00 C ATOM 1045 ND1 HIS A 64 0.554 9.897 16.766 1.00 1.00 N flip ATOM 1046 CD2 HIS A 64 1.428 10.886 18.504 1.00 1.00 C flip ATOM 1047 CE1 HIS A 64 1.279 8.996 17.506 1.00 1.00 C flip ATOM 1048 NE2 HIS A 64 1.797 9.617 18.549 1.00 1.00 N flip ATOM 0 H HIS A 64 -0.393 12.918 14.665 1.00 1.00 H new ATOM 0 HA HIS A 64 -1.736 11.314 16.576 1.00 1.00 H new ATOM 0 HB2 HIS A 64 0.695 12.948 16.356 1.00 1.00 H new ATOM 0 HB3 HIS A 64 -0.023 13.031 17.952 1.00 1.00 H new ATOM 0 HD2 HIS A 64 1.699 11.641 19.227 1.00 1.00 H new ATOM 0 HE1 HIS A 64 1.405 7.949 17.273 1.00 1.00 H new ATOM 0 HE2 HIS A 64 2.382 9.191 19.267 1.00 1.00 H new ATOM 1057 N GLN A 65 -2.271 14.565 16.703 1.00 1.00 N ATOM 1058 CA GLN A 65 -3.127 15.586 17.307 1.00 1.00 C ATOM 1059 C GLN A 65 -4.286 15.978 16.402 1.00 1.00 C ATOM 1060 O GLN A 65 -4.104 16.265 15.215 1.00 1.00 O ATOM 1061 CB GLN A 65 -2.311 16.824 17.659 1.00 1.00 C ATOM 1062 CG GLN A 65 -2.925 17.666 18.775 1.00 1.00 C ATOM 1063 CD GLN A 65 -3.086 16.892 20.068 1.00 1.00 C ATOM 1064 OE1 GLN A 65 -4.169 16.403 20.383 1.00 1.00 O ATOM 1065 NE2 GLN A 65 -1.998 16.763 20.820 1.00 1.00 N ATOM 0 H GLN A 65 -1.655 14.909 15.966 1.00 1.00 H new ATOM 0 HA GLN A 65 -3.546 15.151 18.214 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -1.309 16.515 17.958 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -2.202 17.442 16.768 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -2.297 18.539 18.954 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -3.899 18.035 18.453 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -1.119 17.185 20.521 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -2.042 16.242 21.696 1.00 1.00 H new ATOM 1074 N GLU A 66 -5.472 16.011 16.997 1.00 1.00 N ATOM 1075 CA GLU A 66 -6.701 16.384 16.304 1.00 1.00 C ATOM 1076 C GLU A 66 -6.658 17.850 15.884 1.00 1.00 C ATOM 1077 O GLU A 66 -7.172 18.221 14.827 1.00 1.00 O ATOM 1078 CB GLU A 66 -7.915 16.141 17.204 1.00 1.00 C ATOM 1079 CG GLU A 66 -7.837 16.844 18.555 1.00 1.00 C ATOM 1080 CD GLU A 66 -9.083 16.612 19.393 1.00 1.00 C ATOM 1081 OE1 GLU A 66 -10.079 17.335 19.175 1.00 1.00 O ATOM 1082 OE2 GLU A 66 -9.070 15.710 20.256 1.00 1.00 O ATOM 0 H GLU A 66 -5.610 15.778 17.980 1.00 1.00 H new ATOM 0 HA GLU A 66 -6.788 15.765 15.411 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -8.813 16.475 16.684 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -8.023 15.069 17.370 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -6.963 16.486 19.099 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -7.700 17.914 18.399 1.00 1.00 H new ATOM 1089 N ASP A 67 -6.049 18.665 16.741 1.00 1.00 N ATOM 1090 CA ASP A 67 -5.920 20.099 16.522 1.00 1.00 C ATOM 1091 C ASP A 67 -5.064 20.401 15.298 1.00 1.00 C ATOM 1092 O ASP A 67 -5.302 21.386 14.610 1.00 1.00 O ATOM 1093 CB ASP A 67 -5.322 20.765 17.760 1.00 1.00 C ATOM 1094 CG ASP A 67 -6.126 21.962 18.214 1.00 1.00 C ATOM 1095 OD1 ASP A 67 -7.368 21.849 18.299 1.00 1.00 O ATOM 1096 OD2 ASP A 67 -5.517 23.021 18.472 1.00 1.00 O ATOM 0 H ASP A 67 -5.629 18.344 17.613 1.00 1.00 H new ATOM 0 HA ASP A 67 -6.916 20.503 16.341 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -5.268 20.038 18.570 1.00 1.00 H new ATOM 0 HB3 ASP A 67 -4.300 21.077 17.544 1.00 1.00 H new ATOM 1101 N TYR A 68 -4.069 19.562 15.028 1.00 1.00 N ATOM 1102 CA TYR A 68 -3.204 19.787 13.881 1.00 1.00 C ATOM 1103 C TYR A 68 -4.033 19.790 12.584 1.00 1.00 C ATOM 1104 O TYR A 68 -4.938 18.968 12.411 1.00 1.00 O ATOM 1105 CB TYR A 68 -2.118 18.719 13.813 1.00 1.00 C ATOM 1106 CG TYR A 68 -0.716 19.281 13.934 1.00 1.00 C ATOM 1107 CD1 TYR A 68 -0.326 20.012 15.052 1.00 1.00 C ATOM 1108 CD2 TYR A 68 0.214 19.086 12.919 1.00 1.00 C ATOM 1109 CE1 TYR A 68 0.951 20.530 15.154 1.00 1.00 C ATOM 1110 CE2 TYR A 68 1.493 19.601 13.015 1.00 1.00 C ATOM 1111 CZ TYR A 68 1.856 20.322 14.133 1.00 1.00 C ATOM 1112 OH TYR A 68 3.127 20.830 14.234 1.00 1.00 O ATOM 0 H TYR A 68 -3.846 18.733 15.579 1.00 1.00 H new ATOM 0 HA TYR A 68 -2.724 20.759 13.993 1.00 1.00 H new ATOM 0 HB2 TYR A 68 -2.281 17.994 14.610 1.00 1.00 H new ATOM 0 HB3 TYR A 68 -2.206 18.181 12.869 1.00 1.00 H new ATOM 0 HD1 TYR A 68 -1.032 20.177 15.852 1.00 1.00 H new ATOM 0 HD2 TYR A 68 -0.068 18.523 12.041 1.00 1.00 H new ATOM 0 HE1 TYR A 68 1.239 21.095 16.028 1.00 1.00 H new ATOM 0 HE2 TYR A 68 2.204 19.440 12.219 1.00 1.00 H new ATOM 0 HH TYR A 68 3.638 20.594 13.432 1.00 1.00 H new ATOM 1122 N GLN A 69 -3.722 20.736 11.701 1.00 1.00 N ATOM 1123 CA GLN A 69 -4.442 20.871 10.438 1.00 1.00 C ATOM 1124 C GLN A 69 -3.651 20.282 9.259 1.00 1.00 C ATOM 1125 O GLN A 69 -2.444 20.473 9.119 1.00 1.00 O ATOM 1126 CB GLN A 69 -4.765 22.348 10.172 1.00 1.00 C ATOM 1127 CG GLN A 69 -3.538 23.247 10.022 1.00 1.00 C ATOM 1128 CD GLN A 69 -3.875 24.722 10.074 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -3.545 25.483 9.165 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -4.542 25.133 11.147 1.00 1.00 N ATOM 0 H GLN A 69 -2.977 21.419 11.837 1.00 1.00 H new ATOM 0 HA GLN A 69 -5.369 20.305 10.526 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -5.365 22.418 9.264 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -5.379 22.726 10.990 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -2.825 23.015 10.813 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -3.046 23.026 9.075 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -4.795 24.466 11.876 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -4.801 26.115 11.241 1.00 1.00 H new ATOM 1139 N ALA A 70 -4.376 19.551 8.405 1.00 1.00 N ATOM 1140 CA ALA A 70 -3.790 18.914 7.229 1.00 1.00 C ATOM 1141 C ALA A 70 -4.560 19.320 5.969 1.00 1.00 C ATOM 1142 O ALA A 70 -5.767 19.553 6.017 1.00 1.00 O ATOM 1143 CB ALA A 70 -3.796 17.403 7.390 1.00 1.00 C ATOM 0 H ALA A 70 -5.377 19.387 8.511 1.00 1.00 H new ATOM 0 HA ALA A 70 -2.757 19.247 7.128 1.00 1.00 H new ATOM 0 HB1 ALA A 70 -3.356 16.941 6.506 1.00 1.00 H new ATOM 0 HB2 ALA A 70 -3.214 17.129 8.270 1.00 1.00 H new ATOM 0 HB3 ALA A 70 -4.822 17.054 7.510 1.00 1.00 H new ATOM 1149 N GLN A 71 -3.853 19.442 4.853 1.00 1.00 N ATOM 1150 CA GLN A 71 -4.494 19.856 3.613 1.00 1.00 C ATOM 1151 C GLN A 71 -4.653 18.682 2.644 1.00 1.00 C ATOM 1152 O GLN A 71 -3.740 17.891 2.447 1.00 1.00 O ATOM 1153 CB GLN A 71 -3.687 20.973 2.958 1.00 1.00 C ATOM 1154 CG GLN A 71 -3.948 21.109 1.465 1.00 1.00 C ATOM 1155 CD GLN A 71 -3.391 22.404 0.893 1.00 1.00 C ATOM 1156 OE1 GLN A 71 -3.280 23.416 1.587 1.00 1.00 O ATOM 1157 NE2 GLN A 71 -3.055 22.377 -0.391 1.00 1.00 N ATOM 0 H GLN A 71 -2.851 19.263 4.781 1.00 1.00 H new ATOM 0 HA GLN A 71 -5.491 20.224 3.856 1.00 1.00 H new ATOM 0 HB2 GLN A 71 -3.923 21.918 3.448 1.00 1.00 H new ATOM 0 HB3 GLN A 71 -2.625 20.787 3.119 1.00 1.00 H new ATOM 0 HG2 GLN A 71 -3.502 20.263 0.943 1.00 1.00 H new ATOM 0 HG3 GLN A 71 -5.022 21.066 1.282 1.00 1.00 H new ATOM 0 HE21 GLN A 71 -3.163 21.517 -0.929 1.00 1.00 H new ATOM 0 HE22 GLN A 71 -2.688 23.216 -0.840 1.00 1.00 H new ATOM 1166 N GLY A 72 -5.832 18.563 2.063 1.00 1.00 N ATOM 1167 CA GLY A 72 -6.088 17.501 1.117 1.00 1.00 C ATOM 1168 C GLY A 72 -6.704 16.276 1.763 1.00 1.00 C ATOM 1169 O GLY A 72 -7.339 15.464 1.093 1.00 1.00 O ATOM 0 H GLY A 72 -6.622 19.186 2.230 1.00 1.00 H new ATOM 0 HA2 GLY A 72 -6.754 17.868 0.336 1.00 1.00 H new ATOM 0 HA3 GLY A 72 -5.153 17.219 0.632 1.00 1.00 H new ATOM 1173 N ALA A 73 -6.537 16.128 3.073 1.00 1.00 N ATOM 1174 CA ALA A 73 -7.114 14.983 3.766 1.00 1.00 C ATOM 1175 C ALA A 73 -7.534 15.315 5.188 1.00 1.00 C ATOM 1176 O ALA A 73 -6.842 16.032 5.892 1.00 1.00 O ATOM 1177 CB ALA A 73 -6.109 13.854 3.738 1.00 1.00 C ATOM 0 H ALA A 73 -6.017 16.774 3.667 1.00 1.00 H new ATOM 0 HA ALA A 73 -8.027 14.683 3.252 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -6.522 12.986 4.252 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -5.886 13.591 2.704 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -5.193 14.170 4.238 1.00 1.00 H new ATOM 1183 N VAL A 74 -8.665 14.753 5.619 1.00 1.00 N ATOM 1184 CA VAL A 74 -9.206 14.988 6.961 1.00 1.00 C ATOM 1185 C VAL A 74 -8.275 14.483 8.079 1.00 1.00 C ATOM 1186 O VAL A 74 -7.672 13.423 7.959 1.00 1.00 O ATOM 1187 CB VAL A 74 -10.578 14.318 7.123 1.00 1.00 C ATOM 1188 CG1 VAL A 74 -10.917 14.187 8.600 1.00 1.00 C ATOM 1189 CG2 VAL A 74 -11.647 15.124 6.390 1.00 1.00 C ATOM 0 H VAL A 74 -9.231 14.124 5.050 1.00 1.00 H new ATOM 0 HA VAL A 74 -9.300 16.070 7.059 1.00 1.00 H new ATOM 0 HB VAL A 74 -10.544 13.320 6.685 1.00 1.00 H new ATOM 0 HG11 VAL A 74 -11.892 13.711 8.709 1.00 1.00 H new ATOM 0 HG12 VAL A 74 -10.159 13.580 9.095 1.00 1.00 H new ATOM 0 HG13 VAL A 74 -10.944 15.177 9.056 1.00 1.00 H new ATOM 0 HG21 VAL A 74 -12.616 14.639 6.512 1.00 1.00 H new ATOM 0 HG22 VAL A 74 -11.691 16.131 6.804 1.00 1.00 H new ATOM 0 HG23 VAL A 74 -11.399 15.178 5.330 1.00 1.00 H new ATOM 1199 N VAL A 75 -8.152 15.283 9.147 1.00 1.00 N ATOM 1200 CA VAL A 75 -7.270 14.933 10.260 1.00 1.00 C ATOM 1201 C VAL A 75 -8.027 14.250 11.392 1.00 1.00 C ATOM 1202 O VAL A 75 -8.876 14.864 12.047 1.00 1.00 O ATOM 1203 CB VAL A 75 -6.570 16.182 10.819 1.00 1.00 C ATOM 1204 CG1 VAL A 75 -5.555 15.816 11.899 1.00 1.00 C ATOM 1205 CG2 VAL A 75 -5.889 16.949 9.703 1.00 1.00 C ATOM 0 H VAL A 75 -8.648 16.167 9.260 1.00 1.00 H new ATOM 0 HA VAL A 75 -6.529 14.239 9.863 1.00 1.00 H new ATOM 0 HB VAL A 75 -7.333 16.814 11.273 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -5.078 16.722 12.273 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -6.063 15.309 12.719 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -4.798 15.155 11.477 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -5.398 17.831 10.115 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -5.147 16.311 9.223 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -6.632 17.258 8.968 1.00 1.00 H new ATOM 1215 N VAL A 76 -7.675 12.983 11.616 1.00 1.00 N ATOM 1216 CA VAL A 76 -8.274 12.188 12.683 1.00 1.00 C ATOM 1217 C VAL A 76 -7.191 11.575 13.573 1.00 1.00 C ATOM 1218 O VAL A 76 -6.251 10.946 13.080 1.00 1.00 O ATOM 1219 CB VAL A 76 -9.169 11.061 12.142 1.00 1.00 C ATOM 1220 CG1 VAL A 76 -9.965 10.432 13.273 1.00 1.00 C ATOM 1221 CG2 VAL A 76 -10.083 11.588 11.052 1.00 1.00 C ATOM 0 H VAL A 76 -6.974 12.485 11.068 1.00 1.00 H new ATOM 0 HA VAL A 76 -8.895 12.870 13.264 1.00 1.00 H new ATOM 0 HB VAL A 76 -8.538 10.288 11.704 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -10.594 9.636 12.876 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -9.280 10.018 14.014 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -10.592 11.190 13.742 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -10.710 10.778 10.680 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -10.714 12.379 11.457 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -9.482 11.987 10.235 1.00 1.00 H new ATOM 1231 N HIS A 77 -7.327 11.741 14.888 1.00 1.00 N ATOM 1232 CA HIS A 77 -6.354 11.190 15.820 1.00 1.00 C ATOM 1233 C HIS A 77 -6.834 9.902 16.500 1.00 1.00 C ATOM 1234 O HIS A 77 -6.073 9.273 17.241 1.00 1.00 O ATOM 1235 CB HIS A 77 -5.952 12.210 16.875 1.00 1.00 C ATOM 1236 CG HIS A 77 -6.934 12.335 18.001 1.00 1.00 C ATOM 1237 ND1 HIS A 77 -8.228 12.775 17.818 1.00 1.00 N ATOM 1238 CD2 HIS A 77 -6.812 12.067 19.322 1.00 1.00 C ATOM 1239 CE1 HIS A 77 -8.860 12.772 18.978 1.00 1.00 C ATOM 1240 NE2 HIS A 77 -8.023 12.345 19.906 1.00 1.00 N ATOM 0 H HIS A 77 -8.096 12.249 15.326 1.00 1.00 H new ATOM 0 HA HIS A 77 -5.482 10.936 15.217 1.00 1.00 H new ATOM 0 HB2 HIS A 77 -4.980 11.933 17.282 1.00 1.00 H new ATOM 0 HB3 HIS A 77 -5.833 13.183 16.399 1.00 1.00 H new ATOM 0 HD2 HIS A 77 -5.927 11.703 19.823 1.00 1.00 H new ATOM 0 HE1 HIS A 77 -9.886 13.068 19.140 1.00 1.00 H new ATOM 0 HE2 HIS A 77 -8.241 12.239 20.897 1.00 1.00 H new ATOM 1249 N ASP A 78 -8.088 9.529 16.279 1.00 1.00 N ATOM 1250 CA ASP A 78 -8.642 8.336 16.906 1.00 1.00 C ATOM 1251 C ASP A 78 -8.606 7.130 15.974 1.00 1.00 C ATOM 1252 O ASP A 78 -9.304 7.096 14.961 1.00 1.00 O ATOM 1253 CB ASP A 78 -10.080 8.613 17.352 1.00 1.00 C ATOM 1254 CG ASP A 78 -10.190 9.847 18.222 1.00 1.00 C ATOM 1255 OD1 ASP A 78 -9.376 9.974 19.162 1.00 1.00 O ATOM 1256 OD2 ASP A 78 -11.080 10.685 17.971 1.00 1.00 O ATOM 0 H ASP A 78 -8.737 10.032 15.674 1.00 1.00 H new ATOM 0 HA ASP A 78 -8.024 8.095 17.771 1.00 1.00 H new ATOM 0 HB2 ASP A 78 -10.713 8.735 16.473 1.00 1.00 H new ATOM 0 HB3 ASP A 78 -10.459 7.751 17.900 1.00 1.00 H new ATOM 1261 N VAL A 79 -7.799 6.148 16.331 1.00 1.00 N ATOM 1262 CA VAL A 79 -7.676 4.930 15.544 1.00 1.00 C ATOM 1263 C VAL A 79 -9.001 4.175 15.496 1.00 1.00 C ATOM 1264 O VAL A 79 -9.386 3.682 14.443 1.00 1.00 O ATOM 1265 CB VAL A 79 -6.589 4.004 16.108 1.00 1.00 C ATOM 1266 CG1 VAL A 79 -5.254 4.732 16.174 1.00 1.00 C ATOM 1267 CG2 VAL A 79 -6.988 3.464 17.473 1.00 1.00 C ATOM 0 H VAL A 79 -7.214 6.169 17.166 1.00 1.00 H new ATOM 0 HA VAL A 79 -7.394 5.231 14.535 1.00 1.00 H new ATOM 0 HB VAL A 79 -6.480 3.153 15.436 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -4.494 4.062 16.576 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -4.964 5.051 15.173 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -5.347 5.605 16.820 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -6.201 2.811 17.850 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -7.133 4.294 18.164 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -7.916 2.899 17.384 1.00 1.00 H new ATOM 1277 N ALA A 80 -9.672 4.078 16.634 1.00 1.00 N ATOM 1278 CA ALA A 80 -10.935 3.372 16.738 1.00 1.00 C ATOM 1279 C ALA A 80 -12.013 4.031 15.879 1.00 1.00 C ATOM 1280 O ALA A 80 -12.845 3.350 15.272 1.00 1.00 O ATOM 1281 CB ALA A 80 -11.380 3.295 18.188 1.00 1.00 C ATOM 0 H ALA A 80 -9.353 4.488 17.512 1.00 1.00 H new ATOM 0 HA ALA A 80 -10.786 2.359 16.363 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -12.329 2.762 18.250 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -10.628 2.765 18.772 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -11.503 4.303 18.585 1.00 1.00 H new ATOM 1287 N ALA A 81 -12.003 5.361 15.828 1.00 1.00 N ATOM 1288 CA ALA A 81 -12.995 6.089 15.042 1.00 1.00 C ATOM 1289 C ALA A 81 -12.848 5.768 13.563 1.00 1.00 C ATOM 1290 O ALA A 81 -13.851 5.622 12.851 1.00 1.00 O ATOM 1291 CB ALA A 81 -12.868 7.589 15.254 1.00 1.00 C ATOM 0 H ALA A 81 -11.328 5.950 16.315 1.00 1.00 H new ATOM 0 HA ALA A 81 -13.981 5.771 15.380 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -13.619 8.106 14.656 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -13.020 7.822 16.308 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -11.874 7.917 14.950 1.00 1.00 H new ATOM 1297 N VAL A 82 -11.618 5.625 13.103 1.00 1.00 N ATOM 1298 CA VAL A 82 -11.359 5.289 11.694 1.00 1.00 C ATOM 1299 C VAL A 82 -11.953 3.925 11.366 1.00 1.00 C ATOM 1300 O VAL A 82 -12.607 3.759 10.333 1.00 1.00 O ATOM 1301 CB VAL A 82 -9.851 5.276 11.386 1.00 1.00 C ATOM 1302 CG1 VAL A 82 -9.619 5.245 9.885 1.00 1.00 C ATOM 1303 CG2 VAL A 82 -9.170 6.483 12.012 1.00 1.00 C ATOM 0 H VAL A 82 -10.779 5.733 13.673 1.00 1.00 H new ATOM 0 HA VAL A 82 -11.829 6.056 11.078 1.00 1.00 H new ATOM 0 HB VAL A 82 -9.414 4.376 11.819 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -8.548 5.236 9.682 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -10.075 4.349 9.465 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -10.067 6.128 9.429 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -8.104 6.458 11.784 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -9.606 7.397 11.608 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -9.311 6.460 13.093 1.00 1.00 H new ATOM 1313 N PHE A 83 -11.749 2.966 12.252 1.00 1.00 N ATOM 1314 CA PHE A 83 -12.282 1.616 12.071 1.00 1.00 C ATOM 1315 C PHE A 83 -13.806 1.661 12.001 1.00 1.00 C ATOM 1316 O PHE A 83 -14.425 1.041 11.147 1.00 1.00 O ATOM 1317 CB PHE A 83 -11.831 0.709 13.206 1.00 1.00 C ATOM 1318 CG PHE A 83 -12.443 -0.657 13.143 1.00 1.00 C ATOM 1319 CD1 PHE A 83 -12.893 -1.187 11.944 1.00 1.00 C ATOM 1320 CD2 PHE A 83 -12.574 -1.413 14.298 1.00 1.00 C ATOM 1321 CE1 PHE A 83 -13.461 -2.446 11.897 1.00 1.00 C ATOM 1322 CE2 PHE A 83 -13.142 -2.672 14.257 1.00 1.00 C ATOM 1323 CZ PHE A 83 -13.586 -3.189 13.055 1.00 1.00 C ATOM 0 H PHE A 83 -11.215 3.093 13.112 1.00 1.00 H new ATOM 0 HA PHE A 83 -11.898 1.211 11.135 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -10.745 0.616 13.180 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -12.088 1.173 14.158 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -12.799 -0.610 11.036 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -12.228 -1.013 15.240 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -13.807 -2.848 10.956 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -13.239 -3.251 15.163 1.00 1.00 H new ATOM 0 HZ PHE A 83 -14.030 -4.173 13.021 1.00 1.00 H new ATOM 1333 N ALA A 84 -14.401 2.415 12.920 1.00 1.00 N ATOM 1334 CA ALA A 84 -15.850 2.554 12.981 1.00 1.00 C ATOM 1335 C ALA A 84 -16.406 3.208 11.715 1.00 1.00 C ATOM 1336 O ALA A 84 -17.474 2.826 11.241 1.00 1.00 O ATOM 1337 CB ALA A 84 -16.259 3.351 14.212 1.00 1.00 C ATOM 0 H ALA A 84 -13.899 2.941 13.635 1.00 1.00 H new ATOM 0 HA ALA A 84 -16.274 1.552 13.052 1.00 1.00 H new ATOM 0 HB1 ALA A 84 -17.345 3.445 14.241 1.00 1.00 H new ATOM 0 HB2 ALA A 84 -15.915 2.836 15.109 1.00 1.00 H new ATOM 0 HB3 ALA A 84 -15.810 4.343 14.169 1.00 1.00 H new ATOM 1343 N TYR A 85 -15.672 4.185 11.179 1.00 1.00 N ATOM 1344 CA TYR A 85 -16.100 4.874 9.978 1.00 1.00 C ATOM 1345 C TYR A 85 -16.242 3.894 8.814 1.00 1.00 C ATOM 1346 O TYR A 85 -17.254 3.894 8.104 1.00 1.00 O ATOM 1347 CB TYR A 85 -15.097 5.979 9.620 1.00 1.00 C ATOM 1348 CG TYR A 85 -15.609 7.379 9.865 1.00 1.00 C ATOM 1349 CD1 TYR A 85 -16.344 8.044 8.890 1.00 1.00 C ATOM 1350 CD2 TYR A 85 -15.380 8.027 11.071 1.00 1.00 C ATOM 1351 CE1 TYR A 85 -16.834 9.317 9.112 1.00 1.00 C ATOM 1352 CE2 TYR A 85 -15.868 9.300 11.300 1.00 1.00 C ATOM 1353 CZ TYR A 85 -16.594 9.940 10.318 1.00 1.00 C ATOM 1354 OH TYR A 85 -17.093 11.199 10.542 1.00 1.00 O ATOM 0 H TYR A 85 -14.784 4.510 11.561 1.00 1.00 H new ATOM 0 HA TYR A 85 -17.074 5.325 10.167 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -14.186 5.830 10.200 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -14.825 5.882 8.569 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -16.535 7.558 7.945 1.00 1.00 H new ATOM 0 HD2 TYR A 85 -14.812 7.529 11.843 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -17.402 9.821 8.344 1.00 1.00 H new ATOM 0 HE2 TYR A 85 -15.681 9.791 12.244 1.00 1.00 H new ATOM 0 HH TYR A 85 -16.837 11.497 11.440 1.00 1.00 H new ATOM 1364 N ALA A 86 -15.234 3.053 8.633 1.00 1.00 N ATOM 1365 CA ALA A 86 -15.258 2.067 7.558 1.00 1.00 C ATOM 1366 C ALA A 86 -16.394 1.079 7.779 1.00 1.00 C ATOM 1367 O ALA A 86 -17.057 0.653 6.836 1.00 1.00 O ATOM 1368 CB ALA A 86 -13.923 1.337 7.477 1.00 1.00 C ATOM 0 H ALA A 86 -14.394 3.032 9.211 1.00 1.00 H new ATOM 0 HA ALA A 86 -15.425 2.583 6.613 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -13.957 0.605 6.670 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -13.127 2.055 7.282 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -13.729 0.828 8.421 1.00 1.00 H new ATOM 1374 N LYS A 87 -16.622 0.738 9.043 1.00 1.00 N ATOM 1375 CA LYS A 87 -17.681 -0.192 9.411 1.00 1.00 C ATOM 1376 C LYS A 87 -19.035 0.388 9.019 1.00 1.00 C ATOM 1377 O LYS A 87 -19.922 -0.340 8.583 1.00 1.00 O ATOM 1378 CB LYS A 87 -17.650 -0.474 10.909 1.00 1.00 C ATOM 1379 CG LYS A 87 -18.912 -1.145 11.440 1.00 1.00 C ATOM 1380 CD LYS A 87 -19.775 -0.177 12.213 1.00 1.00 C ATOM 1381 CE LYS A 87 -19.085 0.294 13.486 1.00 1.00 C ATOM 1382 NZ LYS A 87 -19.680 -0.325 14.698 1.00 1.00 N ATOM 0 H LYS A 87 -16.084 1.095 9.833 1.00 1.00 H new ATOM 0 HA LYS A 87 -17.522 -1.130 8.879 1.00 1.00 H new ATOM 0 HB2 LYS A 87 -16.792 -1.109 11.131 1.00 1.00 H new ATOM 0 HB3 LYS A 87 -17.498 0.465 11.442 1.00 1.00 H new ATOM 0 HG2 LYS A 87 -19.483 -1.557 10.608 1.00 1.00 H new ATOM 0 HG3 LYS A 87 -18.637 -1.981 12.083 1.00 1.00 H new ATOM 0 HD2 LYS A 87 -20.010 0.683 11.586 1.00 1.00 H new ATOM 0 HD3 LYS A 87 -20.721 -0.655 12.467 1.00 1.00 H new ATOM 0 HE2 LYS A 87 -18.024 0.049 13.436 1.00 1.00 H new ATOM 0 HE3 LYS A 87 -19.158 1.379 13.559 1.00 1.00 H new ATOM 0 HZ1 LYS A 87 -19.183 0.021 15.544 1.00 1.00 H new ATOM 0 HZ2 LYS A 87 -20.686 -0.070 14.759 1.00 1.00 H new ATOM 0 HZ3 LYS A 87 -19.587 -1.359 14.641 1.00 1.00 H new ATOM 1396 N GLN A 88 -19.176 1.699 9.188 1.00 1.00 N ATOM 1397 CA GLN A 88 -20.404 2.386 8.866 1.00 1.00 C ATOM 1398 C GLN A 88 -20.690 2.307 7.373 1.00 1.00 C ATOM 1399 O GLN A 88 -21.841 2.168 6.970 1.00 1.00 O ATOM 1400 CB GLN A 88 -20.327 3.845 9.303 1.00 1.00 C ATOM 1401 CG GLN A 88 -20.596 4.059 10.794 1.00 1.00 C ATOM 1402 CD GLN A 88 -22.040 3.768 11.173 1.00 1.00 C ATOM 1403 OE1 GLN A 88 -22.335 2.500 11.435 1.00 1.00 O flip ATOM 1404 NE2 GLN A 88 -22.878 4.668 11.222 1.00 1.00 N flip ATOM 0 H GLN A 88 -18.441 2.305 9.551 1.00 1.00 H new ATOM 0 HA GLN A 88 -21.217 1.897 9.403 1.00 1.00 H new ATOM 0 HB2 GLN A 88 -19.338 4.235 9.062 1.00 1.00 H new ATOM 0 HB3 GLN A 88 -21.047 4.426 8.727 1.00 1.00 H new ATOM 0 HG2 GLN A 88 -19.935 3.416 11.375 1.00 1.00 H new ATOM 0 HG3 GLN A 88 -20.354 5.088 11.059 1.00 1.00 H new ATOM 0 HE21 GLN A 88 -22.607 5.629 11.013 1.00 1.00 H new ATOM 0 HE22 GLN A 88 -23.843 4.453 11.472 1.00 1.00 H new ATOM 1413 N HIS A 89 -19.648 2.417 6.558 1.00 1.00 N ATOM 1414 CA HIS A 89 -19.805 2.376 5.102 1.00 1.00 C ATOM 1415 C HIS A 89 -19.277 1.061 4.525 1.00 1.00 C ATOM 1416 O HIS A 89 -18.245 1.040 3.854 1.00 1.00 O ATOM 1417 CB HIS A 89 -19.078 3.550 4.452 1.00 1.00 C ATOM 1418 CG HIS A 89 -19.557 4.886 4.909 1.00 1.00 C ATOM 1419 ND1 HIS A 89 -20.015 5.851 4.036 1.00 1.00 N ATOM 1420 CD2 HIS A 89 -19.653 5.424 6.146 1.00 1.00 C ATOM 1421 CE1 HIS A 89 -20.370 6.925 4.718 1.00 1.00 C ATOM 1422 NE2 HIS A 89 -20.161 6.692 6.001 1.00 1.00 N ATOM 0 H HIS A 89 -18.686 2.535 6.876 1.00 1.00 H new ATOM 0 HA HIS A 89 -20.870 2.447 4.883 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -18.012 3.466 4.663 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -19.196 3.483 3.370 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -19.381 4.946 7.075 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -20.764 7.838 4.298 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -20.347 7.347 6.761 1.00 1.00 H new ATOM 1431 N PRO A 90 -19.991 -0.054 4.773 1.00 1.00 N ATOM 1432 CA PRO A 90 -19.615 -1.382 4.283 1.00 1.00 C ATOM 1433 C PRO A 90 -19.554 -1.436 2.758 1.00 1.00 C ATOM 1434 O PRO A 90 -18.816 -2.225 2.166 1.00 1.00 O ATOM 1435 CB PRO A 90 -20.719 -2.307 4.818 1.00 1.00 C ATOM 1436 CG PRO A 90 -21.851 -1.407 5.161 1.00 1.00 C ATOM 1437 CD PRO A 90 -21.243 -0.088 5.545 1.00 1.00 C ATOM 0 HA PRO A 90 -18.619 -1.669 4.619 1.00 1.00 H new ATOM 0 HB2 PRO A 90 -21.014 -3.042 4.069 1.00 1.00 H new ATOM 0 HB3 PRO A 90 -20.378 -2.862 5.692 1.00 1.00 H new ATOM 0 HG2 PRO A 90 -22.526 -1.291 4.313 1.00 1.00 H new ATOM 0 HG3 PRO A 90 -22.439 -1.818 5.982 1.00 1.00 H new ATOM 0 HD2 PRO A 90 -21.896 0.746 5.288 1.00 1.00 H new ATOM 0 HD3 PRO A 90 -21.056 -0.028 6.617 1.00 1.00 H new ATOM 1445 N ASP A 91 -20.360 -0.597 2.125 1.00 1.00 N ATOM 1446 CA ASP A 91 -20.439 -0.544 0.668 1.00 1.00 C ATOM 1447 C ASP A 91 -19.118 -0.102 0.041 1.00 1.00 C ATOM 1448 O ASP A 91 -18.757 -0.568 -1.039 1.00 1.00 O ATOM 1449 CB ASP A 91 -21.549 0.408 0.237 1.00 1.00 C ATOM 1450 CG ASP A 91 -22.581 -0.267 -0.654 1.00 1.00 C ATOM 1451 OD1 ASP A 91 -23.250 -1.210 -0.182 1.00 1.00 O ATOM 1452 OD2 ASP A 91 -22.719 0.153 -1.822 1.00 1.00 O ATOM 0 H ASP A 91 -20.975 0.063 2.600 1.00 1.00 H new ATOM 0 HA ASP A 91 -20.658 -1.553 0.318 1.00 1.00 H new ATOM 0 HB2 ASP A 91 -22.044 0.809 1.122 1.00 1.00 H new ATOM 0 HB3 ASP A 91 -21.112 1.254 -0.294 1.00 1.00 H new ATOM 1457 N GLN A 92 -18.398 0.800 0.694 1.00 1.00 N ATOM 1458 CA GLN A 92 -17.144 1.281 0.152 1.00 1.00 C ATOM 1459 C GLN A 92 -15.942 0.671 0.878 1.00 1.00 C ATOM 1460 O GLN A 92 -15.850 0.724 2.107 1.00 1.00 O ATOM 1461 CB GLN A 92 -17.081 2.808 0.249 1.00 1.00 C ATOM 1462 CG GLN A 92 -17.279 3.521 -1.082 1.00 1.00 C ATOM 1463 CD GLN A 92 -18.055 4.823 -0.941 1.00 1.00 C ATOM 1464 OE1 GLN A 92 -19.217 4.821 -0.536 1.00 1.00 O ATOM 1465 NE2 GLN A 92 -17.412 5.936 -1.262 1.00 1.00 N ATOM 0 H GLN A 92 -18.661 1.208 1.591 1.00 1.00 H new ATOM 0 HA GLN A 92 -17.099 0.975 -0.893 1.00 1.00 H new ATOM 0 HB2 GLN A 92 -17.843 3.149 0.949 1.00 1.00 H new ATOM 0 HB3 GLN A 92 -16.115 3.096 0.664 1.00 1.00 H new ATOM 0 HG2 GLN A 92 -16.306 3.729 -1.526 1.00 1.00 H new ATOM 0 HG3 GLN A 92 -17.808 2.860 -1.769 1.00 1.00 H new ATOM 0 HE21 GLN A 92 -16.449 5.891 -1.594 1.00 1.00 H new ATOM 0 HE22 GLN A 92 -17.880 6.838 -1.177 1.00 1.00 H new ATOM 1474 N GLU A 93 -15.031 0.088 0.104 1.00 1.00 N ATOM 1475 CA GLU A 93 -13.837 -0.542 0.654 1.00 1.00 C ATOM 1476 C GLU A 93 -12.874 0.500 1.208 1.00 1.00 C ATOM 1477 O GLU A 93 -12.751 1.599 0.658 1.00 1.00 O ATOM 1478 CB GLU A 93 -13.152 -1.392 -0.413 1.00 1.00 C ATOM 1479 CG GLU A 93 -12.118 -2.361 0.141 1.00 1.00 C ATOM 1480 CD GLU A 93 -11.079 -2.745 -0.891 1.00 1.00 C ATOM 1481 OE1 GLU A 93 -11.007 -2.060 -1.933 1.00 1.00 O ATOM 1482 OE2 GLU A 93 -10.342 -3.727 -0.665 1.00 1.00 O ATOM 0 H GLU A 93 -15.099 0.039 -0.913 1.00 1.00 H new ATOM 0 HA GLU A 93 -14.140 -1.189 1.478 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -13.910 -1.956 -0.956 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -12.668 -0.733 -1.134 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -11.623 -1.909 1.000 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -12.621 -3.260 0.499 1.00 1.00 H new ATOM 1489 N LEU A 94 -12.194 0.144 2.289 1.00 1.00 N ATOM 1490 CA LEU A 94 -11.238 1.049 2.912 1.00 1.00 C ATOM 1491 C LEU A 94 -9.802 0.568 2.691 1.00 1.00 C ATOM 1492 O LEU A 94 -9.467 -0.577 3.005 1.00 1.00 O ATOM 1493 CB LEU A 94 -11.531 1.179 4.414 1.00 1.00 C ATOM 1494 CG LEU A 94 -11.069 2.492 5.057 1.00 1.00 C ATOM 1495 CD1 LEU A 94 -12.088 3.592 4.827 1.00 1.00 C ATOM 1496 CD2 LEU A 94 -10.825 2.289 6.547 1.00 1.00 C ATOM 0 H LEU A 94 -12.286 -0.761 2.751 1.00 1.00 H new ATOM 0 HA LEU A 94 -11.343 2.028 2.445 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -12.605 1.075 4.569 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -11.052 0.350 4.935 1.00 1.00 H new ATOM 0 HG LEU A 94 -10.133 2.796 4.588 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -11.739 4.514 5.292 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -12.216 3.751 3.756 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -13.042 3.302 5.267 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -10.497 3.228 6.993 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -11.748 1.962 7.026 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -10.055 1.531 6.690 1.00 1.00 H new ATOM 1508 N VAL A 95 -8.973 1.446 2.157 1.00 1.00 N ATOM 1509 CA VAL A 95 -7.574 1.116 1.892 1.00 1.00 C ATOM 1510 C VAL A 95 -6.646 2.096 2.594 1.00 1.00 C ATOM 1511 O VAL A 95 -6.825 3.312 2.491 1.00 1.00 O ATOM 1512 CB VAL A 95 -7.261 1.129 0.382 1.00 1.00 C ATOM 1513 CG1 VAL A 95 -7.118 -0.300 -0.141 1.00 1.00 C ATOM 1514 CG2 VAL A 95 -8.349 1.878 -0.384 1.00 1.00 C ATOM 0 H VAL A 95 -9.239 2.395 1.896 1.00 1.00 H new ATOM 0 HA VAL A 95 -7.409 0.110 2.277 1.00 1.00 H new ATOM 0 HB VAL A 95 -6.316 1.650 0.226 1.00 1.00 H new ATOM 0 HG11 VAL A 95 -6.897 -0.276 -1.208 1.00 1.00 H new ATOM 0 HG12 VAL A 95 -6.306 -0.801 0.387 1.00 1.00 H new ATOM 0 HG13 VAL A 95 -8.048 -0.843 0.025 1.00 1.00 H new ATOM 0 HG21 VAL A 95 -8.111 1.877 -1.448 1.00 1.00 H new ATOM 0 HG22 VAL A 95 -9.309 1.387 -0.226 1.00 1.00 H new ATOM 0 HG23 VAL A 95 -8.404 2.906 -0.026 1.00 1.00 H new ATOM 1524 N ILE A 96 -5.658 1.578 3.309 1.00 1.00 N ATOM 1525 CA ILE A 96 -4.711 2.438 4.012 1.00 1.00 C ATOM 1526 C ILE A 96 -3.308 2.318 3.423 1.00 1.00 C ATOM 1527 O ILE A 96 -2.745 1.220 3.323 1.00 1.00 O ATOM 1528 CB ILE A 96 -4.663 2.112 5.516 1.00 1.00 C ATOM 1529 CG1 ILE A 96 -5.946 2.605 6.193 1.00 1.00 C ATOM 1530 CG2 ILE A 96 -3.435 2.744 6.144 1.00 1.00 C ATOM 1531 CD1 ILE A 96 -7.194 1.890 5.715 1.00 1.00 C ATOM 0 H ILE A 96 -5.490 0.578 3.419 1.00 1.00 H new ATOM 0 HA ILE A 96 -5.062 3.462 3.885 1.00 1.00 H new ATOM 0 HB ILE A 96 -4.596 1.033 5.653 1.00 1.00 H new ATOM 0 HG12 ILE A 96 -5.852 2.474 7.271 1.00 1.00 H new ATOM 0 HG13 ILE A 96 -6.056 3.674 6.010 1.00 1.00 H new ATOM 0 HG21 ILE A 96 -3.408 2.509 7.208 1.00 1.00 H new ATOM 0 HG22 ILE A 96 -2.538 2.353 5.663 1.00 1.00 H new ATOM 0 HG23 ILE A 96 -3.475 3.825 6.012 1.00 1.00 H new ATOM 0 HD11 ILE A 96 -8.064 2.289 6.236 1.00 1.00 H new ATOM 0 HD12 ILE A 96 -7.312 2.042 4.642 1.00 1.00 H new ATOM 0 HD13 ILE A 96 -7.105 0.824 5.923 1.00 1.00 H new ATOM 1543 N ALA A 97 -2.729 3.443 3.046 1.00 1.00 N ATOM 1544 CA ALA A 97 -1.389 3.449 2.482 1.00 1.00 C ATOM 1545 C ALA A 97 -0.391 3.918 3.524 1.00 1.00 C ATOM 1546 O ALA A 97 0.142 5.014 3.441 1.00 1.00 O ATOM 1547 CB ALA A 97 -1.331 4.339 1.253 1.00 1.00 C ATOM 0 H ALA A 97 -3.163 4.363 3.119 1.00 1.00 H new ATOM 0 HA ALA A 97 -1.132 2.434 2.180 1.00 1.00 H new ATOM 0 HB1 ALA A 97 -0.320 4.331 0.845 1.00 1.00 H new ATOM 0 HB2 ALA A 97 -2.029 3.968 0.502 1.00 1.00 H new ATOM 0 HB3 ALA A 97 -1.603 5.358 1.529 1.00 1.00 H new ATOM 1553 N GLY A 98 -0.159 3.068 4.522 1.00 1.00 N ATOM 1554 CA GLY A 98 0.769 3.386 5.589 1.00 1.00 C ATOM 1555 C GLY A 98 0.101 3.917 6.843 1.00 1.00 C ATOM 1556 O GLY A 98 -1.066 4.315 6.814 1.00 1.00 O ATOM 0 H GLY A 98 -0.605 2.155 4.608 1.00 1.00 H new ATOM 0 HA2 GLY A 98 1.337 2.491 5.842 1.00 1.00 H new ATOM 0 HA3 GLY A 98 1.484 4.126 5.228 1.00 1.00 H new ATOM 1560 N GLY A 99 0.840 3.929 7.947 1.00 1.00 N ATOM 1561 CA GLY A 99 2.226 3.463 7.966 1.00 1.00 C ATOM 1562 C GLY A 99 2.354 1.984 8.325 1.00 1.00 C ATOM 1563 O GLY A 99 1.367 1.294 8.586 1.00 1.00 O ATOM 0 H GLY A 99 0.500 4.260 8.850 1.00 1.00 H new ATOM 0 HA2 GLY A 99 2.674 3.634 6.987 1.00 1.00 H new ATOM 0 HA3 GLY A 99 2.793 4.056 8.684 1.00 1.00 H new ATOM 1567 N ALA A 100 3.592 1.486 8.345 1.00 1.00 N ATOM 1568 CA ALA A 100 3.862 0.102 8.680 1.00 1.00 C ATOM 1569 C ALA A 100 3.452 -0.219 10.110 1.00 1.00 C ATOM 1570 O ALA A 100 2.973 -1.317 10.379 1.00 1.00 O ATOM 1571 CB ALA A 100 5.332 -0.222 8.454 1.00 1.00 C ATOM 0 H ALA A 100 4.425 2.033 8.130 1.00 1.00 H new ATOM 0 HA ALA A 100 3.261 -0.524 8.020 1.00 1.00 H new ATOM 0 HB1 ALA A 100 5.518 -1.265 8.710 1.00 1.00 H new ATOM 0 HB2 ALA A 100 5.585 -0.055 7.407 1.00 1.00 H new ATOM 0 HB3 ALA A 100 5.947 0.422 9.083 1.00 1.00 H new ATOM 1577 N GLN A 101 3.640 0.737 11.007 1.00 1.00 N ATOM 1578 CA GLN A 101 3.287 0.547 12.404 1.00 1.00 C ATOM 1579 C GLN A 101 1.790 0.292 12.515 1.00 1.00 C ATOM 1580 O GLN A 101 1.335 -0.539 13.293 1.00 1.00 O ATOM 1581 CB GLN A 101 3.679 1.767 13.230 1.00 1.00 C ATOM 1582 CG GLN A 101 4.828 1.512 14.190 1.00 1.00 C ATOM 1583 CD GLN A 101 5.033 2.650 15.177 1.00 1.00 C ATOM 1584 OE1 GLN A 101 4.170 2.942 16.004 1.00 1.00 O ATOM 1585 NE2 GLN A 101 6.194 3.291 15.097 1.00 1.00 N ATOM 0 H GLN A 101 4.035 1.652 10.792 1.00 1.00 H new ATOM 0 HA GLN A 101 3.831 -0.313 12.794 1.00 1.00 H new ATOM 0 HB2 GLN A 101 3.954 2.578 12.556 1.00 1.00 H new ATOM 0 HB3 GLN A 101 2.812 2.104 13.797 1.00 1.00 H new ATOM 0 HG2 GLN A 101 4.639 0.590 14.740 1.00 1.00 H new ATOM 0 HG3 GLN A 101 5.745 1.361 13.620 1.00 1.00 H new ATOM 0 HE21 GLN A 101 6.881 3.016 14.396 1.00 1.00 H new ATOM 0 HE22 GLN A 101 6.398 4.059 15.737 1.00 1.00 H new ATOM 1594 N ILE A 102 1.029 1.007 11.692 1.00 1.00 N ATOM 1595 CA ILE A 102 -0.412 0.855 11.639 1.00 1.00 C ATOM 1596 C ILE A 102 -0.763 -0.545 11.139 1.00 1.00 C ATOM 1597 O ILE A 102 -1.682 -1.188 11.637 1.00 1.00 O ATOM 1598 CB ILE A 102 -1.071 1.912 10.726 1.00 1.00 C ATOM 1599 CG1 ILE A 102 -1.188 3.254 11.461 1.00 1.00 C ATOM 1600 CG2 ILE A 102 -2.448 1.434 10.253 1.00 1.00 C ATOM 1601 CD1 ILE A 102 0.146 3.854 11.841 1.00 1.00 C ATOM 0 H ILE A 102 1.398 1.705 11.046 1.00 1.00 H new ATOM 0 HA ILE A 102 -0.798 1.001 12.648 1.00 1.00 H new ATOM 0 HB ILE A 102 -0.440 2.052 9.849 1.00 1.00 H new ATOM 0 HG12 ILE A 102 -1.727 3.959 10.829 1.00 1.00 H new ATOM 0 HG13 ILE A 102 -1.784 3.114 12.363 1.00 1.00 H new ATOM 0 HG21 ILE A 102 -2.896 2.193 9.611 1.00 1.00 H new ATOM 0 HG22 ILE A 102 -2.338 0.505 9.694 1.00 1.00 H new ATOM 0 HG23 ILE A 102 -3.091 1.264 11.117 1.00 1.00 H new ATOM 0 HD11 ILE A 102 -0.015 4.801 12.357 1.00 1.00 H new ATOM 0 HD12 ILE A 102 0.679 3.168 12.499 1.00 1.00 H new ATOM 0 HD13 ILE A 102 0.737 4.026 10.941 1.00 1.00 H new ATOM 1613 N PHE A 103 -0.015 -1.000 10.126 1.00 1.00 N ATOM 1614 CA PHE A 103 -0.239 -2.311 9.518 1.00 1.00 C ATOM 1615 C PHE A 103 -0.084 -3.420 10.554 1.00 1.00 C ATOM 1616 O PHE A 103 -0.911 -4.321 10.632 1.00 1.00 O ATOM 1617 CB PHE A 103 0.799 -2.572 8.414 1.00 1.00 C ATOM 1618 CG PHE A 103 0.778 -1.604 7.271 1.00 1.00 C ATOM 1619 CD1 PHE A 103 -0.129 -0.558 7.228 1.00 1.00 C ATOM 1620 CD2 PHE A 103 1.694 -1.736 6.241 1.00 1.00 C ATOM 1621 CE1 PHE A 103 -0.124 0.338 6.176 1.00 1.00 C ATOM 1622 CE2 PHE A 103 1.705 -0.844 5.188 1.00 1.00 C ATOM 1623 CZ PHE A 103 0.795 0.195 5.155 1.00 1.00 C ATOM 0 H PHE A 103 0.754 -0.474 9.711 1.00 1.00 H new ATOM 0 HA PHE A 103 -1.249 -2.311 9.109 1.00 1.00 H new ATOM 0 HB2 PHE A 103 1.793 -2.558 8.862 1.00 1.00 H new ATOM 0 HB3 PHE A 103 0.641 -3.576 8.021 1.00 1.00 H new ATOM 0 HD1 PHE A 103 -0.848 -0.441 8.025 1.00 1.00 H new ATOM 0 HD2 PHE A 103 2.408 -2.546 6.262 1.00 1.00 H new ATOM 0 HE1 PHE A 103 -0.837 1.149 6.152 1.00 1.00 H new ATOM 0 HE2 PHE A 103 2.424 -0.958 4.391 1.00 1.00 H new ATOM 0 HZ PHE A 103 0.802 0.894 4.332 1.00 1.00 H new ATOM 1633 N THR A 104 0.999 -3.365 11.339 1.00 1.00 N ATOM 1634 CA THR A 104 1.240 -4.411 12.348 1.00 1.00 C ATOM 1635 C THR A 104 0.133 -4.433 13.405 1.00 1.00 C ATOM 1636 O THR A 104 -0.385 -5.492 13.751 1.00 1.00 O ATOM 1637 CB THR A 104 2.609 -4.213 13.009 1.00 1.00 C ATOM 1638 OG1 THR A 104 2.781 -5.117 14.076 1.00 1.00 O ATOM 1639 CG2 THR A 104 2.827 -2.824 13.561 1.00 1.00 C ATOM 0 H THR A 104 1.706 -2.631 11.301 1.00 1.00 H new ATOM 0 HA THR A 104 1.233 -5.374 11.838 1.00 1.00 H new ATOM 0 HB THR A 104 3.332 -4.385 12.211 1.00 1.00 H new ATOM 0 HG1 THR A 104 3.661 -4.977 14.485 1.00 1.00 H new ATOM 0 HG21 THR A 104 3.817 -2.763 14.012 1.00 1.00 H new ATOM 0 HG22 THR A 104 2.750 -2.096 12.754 1.00 1.00 H new ATOM 0 HG23 THR A 104 2.071 -2.610 14.316 1.00 1.00 H new ATOM 1647 N ALA A 105 -0.221 -3.258 13.909 1.00 1.00 N ATOM 1648 CA ALA A 105 -1.263 -3.130 14.920 1.00 1.00 C ATOM 1649 C ALA A 105 -2.629 -3.543 14.393 1.00 1.00 C ATOM 1650 O ALA A 105 -3.440 -4.126 15.103 1.00 1.00 O ATOM 1651 CB ALA A 105 -1.312 -1.708 15.458 1.00 1.00 C ATOM 0 H ALA A 105 0.202 -2.373 13.631 1.00 1.00 H new ATOM 0 HA ALA A 105 -1.008 -3.811 15.732 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -2.096 -1.631 16.212 1.00 1.00 H new ATOM 0 HB2 ALA A 105 -0.351 -1.455 15.906 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -1.524 -1.017 14.642 1.00 1.00 H new ATOM 1657 N PHE A 106 -2.893 -3.213 13.125 1.00 1.00 N ATOM 1658 CA PHE A 106 -4.179 -3.518 12.510 1.00 1.00 C ATOM 1659 C PHE A 106 -4.113 -4.703 11.561 1.00 1.00 C ATOM 1660 O PHE A 106 -5.040 -4.917 10.789 1.00 1.00 O ATOM 1661 CB PHE A 106 -4.706 -2.310 11.741 1.00 1.00 C ATOM 1662 CG PHE A 106 -5.370 -1.294 12.617 1.00 1.00 C ATOM 1663 CD1 PHE A 106 -4.671 -0.707 13.656 1.00 1.00 C ATOM 1664 CD2 PHE A 106 -6.689 -0.922 12.405 1.00 1.00 C ATOM 1665 CE1 PHE A 106 -5.272 0.232 14.472 1.00 1.00 C ATOM 1666 CE2 PHE A 106 -7.296 0.017 13.219 1.00 1.00 C ATOM 1667 CZ PHE A 106 -6.586 0.595 14.253 1.00 1.00 C ATOM 0 H PHE A 106 -2.233 -2.737 12.510 1.00 1.00 H new ATOM 0 HA PHE A 106 -4.851 -3.774 13.329 1.00 1.00 H new ATOM 0 HB2 PHE A 106 -3.880 -1.837 11.210 1.00 1.00 H new ATOM 0 HB3 PHE A 106 -5.416 -2.650 10.987 1.00 1.00 H new ATOM 0 HD1 PHE A 106 -3.643 -0.986 13.832 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -7.248 -1.370 11.596 1.00 1.00 H new ATOM 0 HE1 PHE A 106 -4.715 0.682 15.280 1.00 1.00 H new ATOM 0 HE2 PHE A 106 -8.324 0.298 13.046 1.00 1.00 H new ATOM 0 HZ PHE A 106 -7.058 1.329 14.889 1.00 1.00 H new ATOM 1677 N LYS A 107 -3.028 -5.464 11.598 1.00 1.00 N ATOM 1678 CA LYS A 107 -2.872 -6.615 10.709 1.00 1.00 C ATOM 1679 C LYS A 107 -3.965 -7.655 10.961 1.00 1.00 C ATOM 1680 O LYS A 107 -4.540 -8.199 10.024 1.00 1.00 O ATOM 1681 CB LYS A 107 -1.500 -7.257 10.913 1.00 1.00 C ATOM 1682 CG LYS A 107 -1.552 -8.745 11.246 1.00 1.00 C ATOM 1683 CD LYS A 107 -0.162 -9.363 11.279 1.00 1.00 C ATOM 1684 CE LYS A 107 0.803 -8.531 12.120 1.00 1.00 C ATOM 1685 NZ LYS A 107 1.765 -9.390 12.880 1.00 1.00 N ATOM 0 H LYS A 107 -2.243 -5.309 12.231 1.00 1.00 H new ATOM 0 HA LYS A 107 -2.959 -6.260 9.682 1.00 1.00 H new ATOM 0 HB2 LYS A 107 -0.908 -7.119 10.008 1.00 1.00 H new ATOM 0 HB3 LYS A 107 -0.982 -6.734 11.716 1.00 1.00 H new ATOM 0 HG2 LYS A 107 -2.036 -8.885 12.213 1.00 1.00 H new ATOM 0 HG3 LYS A 107 -2.163 -9.262 10.506 1.00 1.00 H new ATOM 0 HD2 LYS A 107 -0.222 -10.373 11.685 1.00 1.00 H new ATOM 0 HD3 LYS A 107 0.222 -9.450 10.263 1.00 1.00 H new ATOM 0 HE2 LYS A 107 1.357 -7.852 11.472 1.00 1.00 H new ATOM 0 HE3 LYS A 107 0.237 -7.914 12.818 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 2.403 -8.787 13.438 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 1.238 -10.021 13.518 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 2.323 -9.960 12.213 1.00 1.00 H new ATOM 1699 N ASP A 108 -4.241 -7.937 12.226 1.00 1.00 N ATOM 1700 CA ASP A 108 -5.266 -8.921 12.580 1.00 1.00 C ATOM 1701 C ASP A 108 -6.648 -8.463 12.135 1.00 1.00 C ATOM 1702 O ASP A 108 -7.487 -9.274 11.749 1.00 1.00 O ATOM 1703 CB ASP A 108 -5.265 -9.182 14.088 1.00 1.00 C ATOM 1704 CG ASP A 108 -4.503 -10.436 14.463 1.00 1.00 C ATOM 1705 OD1 ASP A 108 -5.120 -11.522 14.497 1.00 1.00 O ATOM 1706 OD2 ASP A 108 -3.288 -10.331 14.732 1.00 1.00 O ATOM 0 H ASP A 108 -3.775 -7.504 13.024 1.00 1.00 H new ATOM 0 HA ASP A 108 -5.027 -9.848 12.059 1.00 1.00 H new ATOM 0 HB2 ASP A 108 -4.824 -8.327 14.600 1.00 1.00 H new ATOM 0 HB3 ASP A 108 -6.294 -9.268 14.438 1.00 1.00 H new ATOM 1711 N ASP A 109 -6.867 -7.157 12.218 1.00 1.00 N ATOM 1712 CA ASP A 109 -8.143 -6.565 11.852 1.00 1.00 C ATOM 1713 C ASP A 109 -8.307 -6.407 10.332 1.00 1.00 C ATOM 1714 O ASP A 109 -9.373 -6.009 9.865 1.00 1.00 O ATOM 1715 CB ASP A 109 -8.284 -5.199 12.519 1.00 1.00 C ATOM 1716 CG ASP A 109 -8.781 -5.316 13.938 1.00 1.00 C ATOM 1717 OD1 ASP A 109 -8.032 -5.835 14.792 1.00 1.00 O ATOM 1718 OD2 ASP A 109 -9.931 -4.900 14.197 1.00 1.00 O ATOM 0 H ASP A 109 -6.170 -6.485 12.538 1.00 1.00 H new ATOM 0 HA ASP A 109 -8.923 -7.243 12.197 1.00 1.00 H new ATOM 0 HB2 ASP A 109 -7.320 -4.690 12.513 1.00 1.00 H new ATOM 0 HB3 ASP A 109 -8.974 -4.583 11.942 1.00 1.00 H new ATOM 1723 N VAL A 110 -7.263 -6.708 9.552 1.00 1.00 N ATOM 1724 CA VAL A 110 -7.363 -6.575 8.105 1.00 1.00 C ATOM 1725 C VAL A 110 -7.514 -7.938 7.430 1.00 1.00 C ATOM 1726 O VAL A 110 -6.623 -8.782 7.511 1.00 1.00 O ATOM 1727 CB VAL A 110 -6.126 -5.854 7.527 1.00 1.00 C ATOM 1728 CG1 VAL A 110 -6.267 -5.618 6.033 1.00 1.00 C ATOM 1729 CG2 VAL A 110 -5.904 -4.538 8.250 1.00 1.00 C ATOM 0 H VAL A 110 -6.360 -7.038 9.894 1.00 1.00 H new ATOM 0 HA VAL A 110 -8.253 -5.979 7.900 1.00 1.00 H new ATOM 0 HB VAL A 110 -5.260 -6.497 7.681 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -5.379 -5.109 5.660 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -6.378 -6.575 5.522 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -7.145 -5.001 5.843 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -5.029 -4.038 7.835 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -6.780 -3.902 8.124 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -5.743 -4.728 9.311 1.00 1.00 H new ATOM 1739 N ASP A 111 -8.648 -8.131 6.774 1.00 1.00 N ATOM 1740 CA ASP A 111 -8.932 -9.384 6.086 1.00 1.00 C ATOM 1741 C ASP A 111 -7.984 -9.630 4.921 1.00 1.00 C ATOM 1742 O ASP A 111 -7.637 -10.774 4.635 1.00 1.00 O ATOM 1743 CB ASP A 111 -10.370 -9.395 5.588 1.00 1.00 C ATOM 1744 CG ASP A 111 -11.362 -9.656 6.710 1.00 1.00 C ATOM 1745 OD1 ASP A 111 -10.910 -9.939 7.839 1.00 1.00 O ATOM 1746 OD2 ASP A 111 -12.583 -9.565 6.463 1.00 1.00 O ATOM 0 H ASP A 111 -9.390 -7.434 6.703 1.00 1.00 H new ATOM 0 HA ASP A 111 -8.784 -10.187 6.808 1.00 1.00 H new ATOM 0 HB2 ASP A 111 -10.598 -8.438 5.119 1.00 1.00 H new ATOM 0 HB3 ASP A 111 -10.482 -10.161 4.821 1.00 1.00 H new ATOM 1751 N THR A 112 -7.595 -8.566 4.225 1.00 1.00 N ATOM 1752 CA THR A 112 -6.706 -8.700 3.071 1.00 1.00 C ATOM 1753 C THR A 112 -5.422 -7.896 3.221 1.00 1.00 C ATOM 1754 O THR A 112 -5.457 -6.691 3.496 1.00 1.00 O ATOM 1755 CB THR A 112 -7.436 -8.276 1.802 1.00 1.00 C ATOM 1756 OG1 THR A 112 -8.648 -9.003 1.665 1.00 1.00 O ATOM 1757 CG2 THR A 112 -6.627 -8.492 0.540 1.00 1.00 C ATOM 0 H THR A 112 -7.877 -7.609 4.436 1.00 1.00 H new ATOM 0 HA THR A 112 -6.421 -9.750 3.007 1.00 1.00 H new ATOM 0 HB THR A 112 -7.619 -7.207 1.913 1.00 1.00 H new ATOM 0 HG1 THR A 112 -9.108 -8.720 0.847 1.00 1.00 H new ATOM 0 HG21 THR A 112 -7.207 -8.169 -0.324 1.00 1.00 H new ATOM 0 HG22 THR A 112 -5.705 -7.913 0.595 1.00 1.00 H new ATOM 0 HG23 THR A 112 -6.385 -9.550 0.439 1.00 1.00 H new ATOM 1765 N LEU A 113 -4.284 -8.559 3.009 1.00 1.00 N ATOM 1766 CA LEU A 113 -2.976 -7.907 3.078 1.00 1.00 C ATOM 1767 C LEU A 113 -2.300 -7.922 1.711 1.00 1.00 C ATOM 1768 O LEU A 113 -2.160 -8.979 1.093 1.00 1.00 O ATOM 1769 CB LEU A 113 -2.079 -8.608 4.109 1.00 1.00 C ATOM 1770 CG LEU A 113 -2.726 -8.852 5.466 1.00 1.00 C ATOM 1771 CD1 LEU A 113 -2.559 -10.314 5.859 1.00 1.00 C ATOM 1772 CD2 LEU A 113 -2.124 -7.932 6.523 1.00 1.00 C ATOM 0 H LEU A 113 -4.243 -9.554 2.787 1.00 1.00 H new ATOM 0 HA LEU A 113 -3.127 -6.873 3.387 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -1.759 -9.566 3.698 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -1.181 -8.008 4.254 1.00 1.00 H new ATOM 0 HG LEU A 113 -3.790 -8.627 5.397 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -3.023 -10.485 6.830 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -3.036 -10.948 5.112 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -1.498 -10.556 5.916 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -2.600 -8.122 7.485 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -1.054 -8.122 6.604 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -2.287 -6.893 6.237 1.00 1.00 H new ATOM 1784 N LEU A 114 -1.870 -6.761 1.238 1.00 1.00 N ATOM 1785 CA LEU A 114 -1.208 -6.675 -0.055 1.00 1.00 C ATOM 1786 C LEU A 114 0.289 -6.476 0.109 1.00 1.00 C ATOM 1787 O LEU A 114 0.734 -5.530 0.775 1.00 1.00 O ATOM 1788 CB LEU A 114 -1.800 -5.527 -0.881 1.00 1.00 C ATOM 1789 CG LEU A 114 -2.954 -5.923 -1.793 1.00 1.00 C ATOM 1790 CD1 LEU A 114 -4.266 -5.965 -1.023 1.00 1.00 C ATOM 1791 CD2 LEU A 114 -3.043 -4.950 -2.959 1.00 1.00 C ATOM 0 H LEU A 114 -1.967 -5.871 1.727 1.00 1.00 H new ATOM 0 HA LEU A 114 -1.374 -7.616 -0.580 1.00 1.00 H new ATOM 0 HB2 LEU A 114 -2.145 -4.749 -0.200 1.00 1.00 H new ATOM 0 HB3 LEU A 114 -1.008 -5.090 -1.490 1.00 1.00 H new ATOM 0 HG LEU A 114 -2.767 -6.924 -2.181 1.00 1.00 H new ATOM 0 HD11 LEU A 114 -5.074 -6.250 -1.697 1.00 1.00 H new ATOM 0 HD12 LEU A 114 -4.191 -6.694 -0.216 1.00 1.00 H new ATOM 0 HD13 LEU A 114 -4.473 -4.980 -0.604 1.00 1.00 H new ATOM 0 HD21 LEU A 114 -3.870 -5.236 -3.609 1.00 1.00 H new ATOM 0 HD22 LEU A 114 -3.212 -3.942 -2.580 1.00 1.00 H new ATOM 0 HD23 LEU A 114 -2.111 -4.974 -3.524 1.00 1.00 H new ATOM 1803 N VAL A 115 1.063 -7.358 -0.501 1.00 1.00 N ATOM 1804 CA VAL A 115 2.512 -7.279 -0.424 1.00 1.00 C ATOM 1805 C VAL A 115 3.148 -7.212 -1.811 1.00 1.00 C ATOM 1806 O VAL A 115 2.844 -8.000 -2.706 1.00 1.00 O ATOM 1807 CB VAL A 115 3.103 -8.476 0.354 1.00 1.00 C ATOM 1808 CG1 VAL A 115 2.067 -9.051 1.307 1.00 1.00 C ATOM 1809 CG2 VAL A 115 3.622 -9.547 -0.586 1.00 1.00 C ATOM 0 H VAL A 115 0.711 -8.138 -1.056 1.00 1.00 H new ATOM 0 HA VAL A 115 2.744 -6.359 0.112 1.00 1.00 H new ATOM 0 HB VAL A 115 3.950 -8.113 0.937 1.00 1.00 H new ATOM 0 HG11 VAL A 115 2.498 -9.893 1.848 1.00 1.00 H new ATOM 0 HG12 VAL A 115 1.760 -8.283 2.017 1.00 1.00 H new ATOM 0 HG13 VAL A 115 1.199 -9.389 0.740 1.00 1.00 H new ATOM 0 HG21 VAL A 115 4.031 -10.374 -0.005 1.00 1.00 H new ATOM 0 HG22 VAL A 115 2.805 -9.910 -1.210 1.00 1.00 H new ATOM 0 HG23 VAL A 115 4.404 -9.128 -1.219 1.00 1.00 H new ATOM 1819 N THR A 116 4.051 -6.253 -1.978 1.00 1.00 N ATOM 1820 CA THR A 116 4.755 -6.066 -3.232 1.00 1.00 C ATOM 1821 C THR A 116 6.244 -6.300 -3.015 1.00 1.00 C ATOM 1822 O THR A 116 6.846 -5.694 -2.127 1.00 1.00 O ATOM 1823 CB THR A 116 4.518 -4.652 -3.780 1.00 1.00 C ATOM 1824 OG1 THR A 116 3.644 -4.708 -4.890 1.00 1.00 O ATOM 1825 CG2 THR A 116 5.777 -3.960 -4.231 1.00 1.00 C ATOM 0 H THR A 116 4.312 -5.588 -1.249 1.00 1.00 H new ATOM 0 HA THR A 116 4.376 -6.782 -3.961 1.00 1.00 H new ATOM 0 HB THR A 116 4.095 -4.082 -2.953 1.00 1.00 H new ATOM 0 HG1 THR A 116 2.800 -4.264 -4.664 1.00 1.00 H new ATOM 0 HG21 THR A 116 5.532 -2.966 -4.606 1.00 1.00 H new ATOM 0 HG22 THR A 116 6.465 -3.871 -3.390 1.00 1.00 H new ATOM 0 HG23 THR A 116 6.247 -4.541 -5.024 1.00 1.00 H new ATOM 1833 N ARG A 117 6.835 -7.163 -3.838 1.00 1.00 N ATOM 1834 CA ARG A 117 8.271 -7.447 -3.724 1.00 1.00 C ATOM 1835 C ARG A 117 9.052 -6.796 -4.866 1.00 1.00 C ATOM 1836 O ARG A 117 8.649 -6.864 -6.027 1.00 1.00 O ATOM 1837 CB ARG A 117 8.530 -8.948 -3.733 1.00 1.00 C ATOM 1838 CG ARG A 117 9.880 -9.335 -3.148 1.00 1.00 C ATOM 1839 CD ARG A 117 10.296 -10.713 -3.613 1.00 1.00 C ATOM 1840 NE ARG A 117 11.203 -11.351 -2.676 1.00 1.00 N ATOM 1841 CZ ARG A 117 11.802 -12.518 -2.899 1.00 1.00 C ATOM 1842 NH1 ARG A 117 11.560 -13.195 -4.015 1.00 1.00 N ATOM 1843 NH2 ARG A 117 12.646 -13.011 -2.002 1.00 1.00 N ATOM 0 H ARG A 117 6.355 -7.672 -4.580 1.00 1.00 H new ATOM 0 HA ARG A 117 8.610 -7.029 -2.776 1.00 1.00 H new ATOM 0 HB2 ARG A 117 7.742 -9.448 -3.170 1.00 1.00 H new ATOM 0 HB3 ARG A 117 8.469 -9.313 -4.758 1.00 1.00 H new ATOM 0 HG2 ARG A 117 10.632 -8.604 -3.445 1.00 1.00 H new ATOM 0 HG3 ARG A 117 9.828 -9.315 -2.059 1.00 1.00 H new ATOM 0 HD2 ARG A 117 9.410 -11.335 -3.741 1.00 1.00 H new ATOM 0 HD3 ARG A 117 10.776 -10.637 -4.588 1.00 1.00 H new ATOM 0 HE ARG A 117 11.392 -10.876 -1.793 1.00 1.00 H new ATOM 0 HH11 ARG A 117 10.911 -12.821 -4.708 1.00 1.00 H new ATOM 0 HH12 ARG A 117 12.023 -14.089 -4.180 1.00 1.00 H new ATOM 0 HH21 ARG A 117 12.835 -12.496 -1.142 1.00 1.00 H new ATOM 0 HH22 ARG A 117 13.106 -13.906 -2.172 1.00 1.00 H new ATOM 1857 N LEU A 118 10.170 -6.157 -4.520 1.00 1.00 N ATOM 1858 CA LEU A 118 11.007 -5.473 -5.508 1.00 1.00 C ATOM 1859 C LEU A 118 12.306 -6.229 -5.745 1.00 1.00 C ATOM 1860 O LEU A 118 12.998 -6.604 -4.798 1.00 1.00 O ATOM 1861 CB LEU A 118 11.297 -4.044 -5.043 1.00 1.00 C ATOM 1862 CG LEU A 118 10.185 -3.031 -5.334 1.00 1.00 C ATOM 1863 CD1 LEU A 118 10.481 -2.280 -6.614 1.00 1.00 C ATOM 1864 CD2 LEU A 118 8.841 -3.737 -5.429 1.00 1.00 C ATOM 0 H LEU A 118 10.518 -6.098 -3.563 1.00 1.00 H new ATOM 0 HA LEU A 118 10.465 -5.438 -6.453 1.00 1.00 H new ATOM 0 HB2 LEU A 118 11.483 -4.058 -3.969 1.00 1.00 H new ATOM 0 HB3 LEU A 118 12.215 -3.701 -5.521 1.00 1.00 H new ATOM 0 HG LEU A 118 10.142 -2.313 -4.515 1.00 1.00 H new ATOM 0 HD11 LEU A 118 9.683 -1.564 -6.808 1.00 1.00 H new ATOM 0 HD12 LEU A 118 11.428 -1.750 -6.514 1.00 1.00 H new ATOM 0 HD13 LEU A 118 10.546 -2.985 -7.443 1.00 1.00 H new ATOM 0 HD21 LEU A 118 8.060 -3.006 -5.636 1.00 1.00 H new ATOM 0 HD22 LEU A 118 8.872 -4.472 -6.233 1.00 1.00 H new ATOM 0 HD23 LEU A 118 8.627 -4.240 -4.486 1.00 1.00 H new ATOM 1876 N ALA A 119 12.643 -6.450 -7.022 1.00 1.00 N ATOM 1877 CA ALA A 119 13.864 -7.159 -7.374 1.00 1.00 C ATOM 1878 C ALA A 119 15.080 -6.369 -6.912 1.00 1.00 C ATOM 1879 O ALA A 119 16.066 -6.934 -6.450 1.00 1.00 O ATOM 1880 CB ALA A 119 13.934 -7.428 -8.869 1.00 1.00 C ATOM 0 H ALA A 119 12.085 -6.147 -7.820 1.00 1.00 H new ATOM 0 HA ALA A 119 13.857 -8.123 -6.865 1.00 1.00 H new ATOM 0 HB1 ALA A 119 14.857 -7.959 -9.100 1.00 1.00 H new ATOM 0 HB2 ALA A 119 13.081 -8.036 -9.170 1.00 1.00 H new ATOM 0 HB3 ALA A 119 13.914 -6.482 -9.410 1.00 1.00 H new ATOM 1886 N GLY A 120 14.991 -5.051 -7.033 1.00 1.00 N ATOM 1887 CA GLY A 120 16.089 -4.207 -6.613 1.00 1.00 C ATOM 1888 C GLY A 120 16.254 -4.168 -5.104 1.00 1.00 C ATOM 1889 O GLY A 120 15.360 -4.573 -4.357 1.00 1.00 O ATOM 0 H GLY A 120 14.184 -4.555 -7.412 1.00 1.00 H new ATOM 0 HA2 GLY A 120 17.013 -4.567 -7.066 1.00 1.00 H new ATOM 0 HA3 GLY A 120 15.926 -3.195 -6.983 1.00 1.00 H new ATOM 1893 N SER A 121 17.402 -3.668 -4.641 1.00 1.00 N ATOM 1894 CA SER A 121 17.658 -3.588 -3.204 1.00 1.00 C ATOM 1895 C SER A 121 18.254 -2.241 -2.827 1.00 1.00 C ATOM 1896 O SER A 121 18.953 -1.607 -3.627 1.00 1.00 O ATOM 1897 CB SER A 121 18.612 -4.707 -2.776 1.00 1.00 C ATOM 1898 OG SER A 121 18.066 -5.972 -3.090 1.00 1.00 O ATOM 0 H SER A 121 18.157 -3.318 -5.231 1.00 1.00 H new ATOM 0 HA SER A 121 16.705 -3.702 -2.687 1.00 1.00 H new ATOM 0 HB2 SER A 121 19.573 -4.585 -3.277 1.00 1.00 H new ATOM 0 HB3 SER A 121 18.800 -4.642 -1.704 1.00 1.00 H new ATOM 0 HG SER A 121 18.689 -6.675 -2.811 1.00 1.00 H new ATOM 1904 N PHE A 122 17.960 -1.788 -1.610 1.00 1.00 N ATOM 1905 CA PHE A 122 18.460 -0.517 -1.117 1.00 1.00 C ATOM 1906 C PHE A 122 18.778 -0.585 0.365 1.00 1.00 C ATOM 1907 O PHE A 122 18.244 -1.418 1.096 1.00 1.00 O ATOM 1908 CB PHE A 122 17.425 0.589 -1.381 1.00 1.00 C ATOM 1909 CG PHE A 122 17.498 1.163 -2.772 1.00 1.00 C ATOM 1910 CD1 PHE A 122 17.022 0.447 -3.860 1.00 1.00 C ATOM 1911 CD2 PHE A 122 18.042 2.419 -2.987 1.00 1.00 C ATOM 1912 CE1 PHE A 122 17.088 0.974 -5.136 1.00 1.00 C ATOM 1913 CE2 PHE A 122 18.112 2.951 -4.260 1.00 1.00 C ATOM 1914 CZ PHE A 122 17.634 2.227 -5.336 1.00 1.00 C ATOM 0 H PHE A 122 17.372 -2.291 -0.946 1.00 1.00 H new ATOM 0 HA PHE A 122 19.383 -0.288 -1.649 1.00 1.00 H new ATOM 0 HB2 PHE A 122 16.426 0.187 -1.215 1.00 1.00 H new ATOM 0 HB3 PHE A 122 17.570 1.391 -0.658 1.00 1.00 H new ATOM 0 HD1 PHE A 122 16.595 -0.533 -3.709 1.00 1.00 H new ATOM 0 HD2 PHE A 122 18.416 2.989 -2.149 1.00 1.00 H new ATOM 0 HE1 PHE A 122 16.713 0.407 -5.975 1.00 1.00 H new ATOM 0 HE2 PHE A 122 18.539 3.931 -4.414 1.00 1.00 H new ATOM 0 HZ PHE A 122 17.687 2.641 -6.332 1.00 1.00 H new ATOM 1924 N GLU A 123 19.658 0.314 0.811 1.00 1.00 N ATOM 1925 CA GLU A 123 20.065 0.378 2.211 1.00 1.00 C ATOM 1926 C GLU A 123 19.218 1.391 2.973 1.00 1.00 C ATOM 1927 O GLU A 123 18.895 2.463 2.456 1.00 1.00 O ATOM 1928 CB GLU A 123 21.541 0.761 2.309 1.00 1.00 C ATOM 1929 CG GLU A 123 22.476 -0.269 1.683 1.00 1.00 C ATOM 1930 CD GLU A 123 22.326 -1.627 2.331 1.00 1.00 C ATOM 1931 OE1 GLU A 123 21.381 -2.363 1.977 1.00 1.00 O ATOM 1932 OE2 GLU A 123 23.165 -1.957 3.194 1.00 1.00 O ATOM 0 H GLU A 123 20.104 1.012 0.215 1.00 1.00 H new ATOM 0 HA GLU A 123 19.917 -0.605 2.657 1.00 1.00 H new ATOM 0 HB2 GLU A 123 21.692 1.723 1.820 1.00 1.00 H new ATOM 0 HB3 GLU A 123 21.806 0.892 3.358 1.00 1.00 H new ATOM 0 HG2 GLU A 123 22.267 -0.350 0.616 1.00 1.00 H new ATOM 0 HG3 GLU A 123 23.508 0.069 1.781 1.00 1.00 H new ATOM 1939 N GLY A 124 18.834 1.040 4.197 1.00 1.00 N ATOM 1940 CA GLY A 124 18.007 1.936 4.996 1.00 1.00 C ATOM 1941 C GLY A 124 17.929 1.527 6.458 1.00 1.00 C ATOM 1942 O GLY A 124 18.355 0.437 6.831 1.00 1.00 O ATOM 0 H GLY A 124 19.077 0.159 4.650 1.00 1.00 H new ATOM 0 HA2 GLY A 124 18.407 2.948 4.928 1.00 1.00 H new ATOM 0 HA3 GLY A 124 17.001 1.962 4.578 1.00 1.00 H new ATOM 1946 N ASP A 125 17.391 2.411 7.284 1.00 1.00 N ATOM 1947 CA ASP A 125 17.262 2.145 8.710 1.00 1.00 C ATOM 1948 C ASP A 125 15.936 1.482 9.063 1.00 1.00 C ATOM 1949 O ASP A 125 15.693 1.158 10.229 1.00 1.00 O ATOM 1950 CB ASP A 125 17.411 3.444 9.493 1.00 1.00 C ATOM 1951 CG ASP A 125 18.822 3.660 10.010 1.00 1.00 C ATOM 1952 OD1 ASP A 125 19.780 3.197 9.358 1.00 1.00 O ATOM 1953 OD2 ASP A 125 18.962 4.288 11.081 1.00 1.00 O ATOM 0 H ASP A 125 17.036 3.321 6.991 1.00 1.00 H new ATOM 0 HA ASP A 125 18.056 1.449 8.981 1.00 1.00 H new ATOM 0 HB2 ASP A 125 17.130 4.282 8.855 1.00 1.00 H new ATOM 0 HB3 ASP A 125 16.718 3.438 10.334 1.00 1.00 H new ATOM 1958 N THR A 126 15.070 1.261 8.076 1.00 1.00 N ATOM 1959 CA THR A 126 13.782 0.632 8.343 1.00 1.00 C ATOM 1960 C THR A 126 13.669 -0.711 7.643 1.00 1.00 C ATOM 1961 O THR A 126 13.876 -0.827 6.432 1.00 1.00 O ATOM 1962 CB THR A 126 12.648 1.538 7.891 1.00 1.00 C ATOM 1963 OG1 THR A 126 13.136 2.799 7.478 1.00 1.00 O ATOM 1964 CG2 THR A 126 11.609 1.779 8.972 1.00 1.00 C ATOM 0 H THR A 126 15.234 1.504 7.099 1.00 1.00 H new ATOM 0 HA THR A 126 13.710 0.469 9.418 1.00 1.00 H new ATOM 0 HB THR A 126 12.177 1.012 7.061 1.00 1.00 H new ATOM 0 HG1 THR A 126 13.329 2.776 6.518 1.00 1.00 H new ATOM 0 HG21 THR A 126 10.827 2.433 8.586 1.00 1.00 H new ATOM 0 HG22 THR A 126 11.170 0.828 9.274 1.00 1.00 H new ATOM 0 HG23 THR A 126 12.083 2.249 9.834 1.00 1.00 H new ATOM 1972 N LYS A 127 13.326 -1.722 8.428 1.00 1.00 N ATOM 1973 CA LYS A 127 13.168 -3.075 7.925 1.00 1.00 C ATOM 1974 C LYS A 127 11.762 -3.602 8.204 1.00 1.00 C ATOM 1975 O LYS A 127 11.201 -3.341 9.267 1.00 1.00 O ATOM 1976 CB LYS A 127 14.199 -4.000 8.568 1.00 1.00 C ATOM 1977 CG LYS A 127 14.985 -3.340 9.696 1.00 1.00 C ATOM 1978 CD LYS A 127 15.961 -4.326 10.351 1.00 1.00 C ATOM 1979 CE LYS A 127 16.771 -3.654 11.448 1.00 1.00 C ATOM 1980 NZ LYS A 127 16.144 -3.826 12.780 1.00 1.00 N ATOM 0 H LYS A 127 13.150 -1.626 9.428 1.00 1.00 H new ATOM 0 HA LYS A 127 13.323 -3.053 6.846 1.00 1.00 H new ATOM 0 HB2 LYS A 127 13.692 -4.883 8.957 1.00 1.00 H new ATOM 0 HB3 LYS A 127 14.895 -4.344 7.803 1.00 1.00 H new ATOM 0 HG2 LYS A 127 15.537 -2.485 9.305 1.00 1.00 H new ATOM 0 HG3 LYS A 127 14.294 -2.957 10.447 1.00 1.00 H new ATOM 0 HD2 LYS A 127 15.407 -5.167 10.768 1.00 1.00 H new ATOM 0 HD3 LYS A 127 16.634 -4.731 9.595 1.00 1.00 H new ATOM 0 HE2 LYS A 127 17.778 -4.071 11.464 1.00 1.00 H new ATOM 0 HE3 LYS A 127 16.870 -2.591 11.227 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 16.726 -3.354 13.501 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 15.193 -3.405 12.773 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 16.073 -4.840 13.002 1.00 1.00 H new ATOM 1994 N MET A 128 11.195 -4.329 7.243 1.00 1.00 N ATOM 1995 CA MET A 128 9.857 -4.871 7.397 1.00 1.00 C ATOM 1996 C MET A 128 9.858 -6.076 8.325 1.00 1.00 C ATOM 1997 O MET A 128 10.780 -6.890 8.307 1.00 1.00 O ATOM 1998 CB MET A 128 9.293 -5.266 6.030 1.00 1.00 C ATOM 1999 CG MET A 128 7.949 -4.610 5.721 1.00 1.00 C ATOM 2000 SD MET A 128 6.571 -5.438 6.540 1.00 1.00 S ATOM 2001 CE MET A 128 5.518 -4.043 6.916 1.00 1.00 C ATOM 0 H MET A 128 11.644 -4.553 6.355 1.00 1.00 H new ATOM 0 HA MET A 128 9.226 -4.100 7.840 1.00 1.00 H new ATOM 0 HB2 MET A 128 10.010 -4.993 5.256 1.00 1.00 H new ATOM 0 HB3 MET A 128 9.179 -6.349 5.991 1.00 1.00 H new ATOM 0 HG2 MET A 128 7.978 -3.566 6.032 1.00 1.00 H new ATOM 0 HG3 MET A 128 7.784 -4.617 4.644 1.00 1.00 H new ATOM 0 HE1 MET A 128 4.655 -4.383 7.488 1.00 1.00 H new ATOM 0 HE2 MET A 128 6.077 -3.313 7.501 1.00 1.00 H new ATOM 0 HE3 MET A 128 5.179 -3.582 5.988 1.00 1.00 H new ATOM 2011 N ILE A 129 8.803 -6.196 9.131 1.00 1.00 N ATOM 2012 CA ILE A 129 8.675 -7.319 10.055 1.00 1.00 C ATOM 2013 C ILE A 129 8.423 -8.625 9.309 1.00 1.00 C ATOM 2014 O ILE A 129 8.003 -8.612 8.156 1.00 1.00 O ATOM 2015 CB ILE A 129 7.539 -7.096 11.055 1.00 1.00 C ATOM 2016 CG1 ILE A 129 6.184 -7.265 10.376 1.00 1.00 C ATOM 2017 CG2 ILE A 129 7.656 -5.713 11.683 1.00 1.00 C ATOM 2018 CD1 ILE A 129 5.057 -6.555 11.088 1.00 1.00 C ATOM 0 H ILE A 129 8.029 -5.532 9.162 1.00 1.00 H new ATOM 0 HA ILE A 129 9.620 -7.387 10.595 1.00 1.00 H new ATOM 0 HB ILE A 129 7.618 -7.844 11.844 1.00 1.00 H new ATOM 0 HG12 ILE A 129 6.250 -6.891 9.354 1.00 1.00 H new ATOM 0 HG13 ILE A 129 5.949 -8.328 10.312 1.00 1.00 H new ATOM 0 HG21 ILE A 129 6.842 -5.566 12.393 1.00 1.00 H new ATOM 0 HG22 ILE A 129 8.610 -5.629 12.203 1.00 1.00 H new ATOM 0 HG23 ILE A 129 7.599 -4.953 10.903 1.00 1.00 H new ATOM 0 HD11 ILE A 129 4.125 -6.720 10.548 1.00 1.00 H new ATOM 0 HD12 ILE A 129 4.963 -6.946 12.101 1.00 1.00 H new ATOM 0 HD13 ILE A 129 5.269 -5.487 11.129 1.00 1.00 H new ATOM 2030 N PRO A 130 8.693 -9.774 9.957 1.00 1.00 N ATOM 2031 CA PRO A 130 8.509 -11.100 9.345 1.00 1.00 C ATOM 2032 C PRO A 130 7.056 -11.368 8.948 1.00 1.00 C ATOM 2033 O PRO A 130 6.116 -10.952 9.638 1.00 1.00 O ATOM 2034 CB PRO A 130 8.943 -12.074 10.440 1.00 1.00 C ATOM 2035 CG PRO A 130 9.772 -11.267 11.380 1.00 1.00 C ATOM 2036 CD PRO A 130 9.215 -9.873 11.329 1.00 1.00 C ATOM 0 HA PRO A 130 9.081 -11.194 8.422 1.00 1.00 H new ATOM 0 HB2 PRO A 130 8.080 -12.505 10.948 1.00 1.00 H new ATOM 0 HB3 PRO A 130 9.515 -12.903 10.024 1.00 1.00 H new ATOM 0 HG2 PRO A 130 9.721 -11.671 12.391 1.00 1.00 H new ATOM 0 HG3 PRO A 130 10.821 -11.279 11.084 1.00 1.00 H new ATOM 0 HD2 PRO A 130 8.430 -9.725 12.071 1.00 1.00 H new ATOM 0 HD3 PRO A 130 9.983 -9.124 11.523 1.00 1.00 H new ATOM 2044 N LEU A 131 6.866 -12.069 7.837 1.00 1.00 N ATOM 2045 CA LEU A 131 5.532 -12.405 7.347 1.00 1.00 C ATOM 2046 C LEU A 131 5.250 -13.898 7.511 1.00 1.00 C ATOM 2047 O LEU A 131 6.021 -14.751 7.082 1.00 1.00 O ATOM 2048 CB LEU A 131 5.397 -12.018 5.874 1.00 1.00 C ATOM 2049 CG LEU A 131 5.706 -10.562 5.543 1.00 1.00 C ATOM 2050 CD1 LEU A 131 7.205 -10.355 5.423 1.00 1.00 C ATOM 2051 CD2 LEU A 131 5.009 -10.143 4.249 1.00 1.00 C ATOM 0 H LEU A 131 7.625 -12.419 7.253 1.00 1.00 H new ATOM 0 HA LEU A 131 4.806 -11.845 7.937 1.00 1.00 H new ATOM 0 HB2 LEU A 131 6.061 -12.654 5.288 1.00 1.00 H new ATOM 0 HB3 LEU A 131 4.379 -12.237 5.551 1.00 1.00 H new ATOM 0 HG LEU A 131 5.330 -9.939 6.354 1.00 1.00 H new ATOM 0 HD11 LEU A 131 7.410 -9.311 5.186 1.00 1.00 H new ATOM 0 HD12 LEU A 131 7.685 -10.614 6.367 1.00 1.00 H new ATOM 0 HD13 LEU A 131 7.598 -10.991 4.630 1.00 1.00 H new ATOM 0 HD21 LEU A 131 5.242 -9.101 4.031 1.00 1.00 H new ATOM 0 HD22 LEU A 131 5.356 -10.772 3.429 1.00 1.00 H new ATOM 0 HD23 LEU A 131 3.931 -10.257 4.363 1.00 1.00 H new ATOM 2063 N ASN A 132 4.110 -14.222 8.126 1.00 1.00 N ATOM 2064 CA ASN A 132 3.744 -15.611 8.330 1.00 1.00 C ATOM 2065 C ASN A 132 2.963 -16.147 7.136 1.00 1.00 C ATOM 2066 O ASN A 132 1.794 -15.822 6.939 1.00 1.00 O ATOM 2067 CB ASN A 132 2.923 -15.771 9.617 1.00 1.00 C ATOM 2068 CG ASN A 132 3.684 -16.505 10.696 1.00 1.00 C ATOM 2069 OD1 ASN A 132 3.578 -17.726 10.827 1.00 1.00 O ATOM 2070 ND2 ASN A 132 4.463 -15.766 11.478 1.00 1.00 N ATOM 0 H ASN A 132 3.437 -13.545 8.485 1.00 1.00 H new ATOM 0 HA ASN A 132 4.662 -16.190 8.429 1.00 1.00 H new ATOM 0 HB2 ASN A 132 2.634 -14.787 9.985 1.00 1.00 H new ATOM 0 HB3 ASN A 132 2.003 -16.311 9.393 1.00 1.00 H new ATOM 0 HD21 ASN A 132 5.003 -16.207 12.222 1.00 1.00 H new ATOM 0 HD22 ASN A 132 4.521 -14.758 11.334 1.00 1.00 H new ATOM 2077 N TRP A 133 3.630 -16.975 6.345 1.00 1.00 N ATOM 2078 CA TRP A 133 3.016 -17.569 5.166 1.00 1.00 C ATOM 2079 C TRP A 133 1.810 -18.425 5.532 1.00 1.00 C ATOM 2080 O TRP A 133 0.806 -18.427 4.831 1.00 1.00 O ATOM 2081 CB TRP A 133 4.037 -18.406 4.394 1.00 1.00 C ATOM 2082 CG TRP A 133 4.708 -17.649 3.301 1.00 1.00 C ATOM 2083 CD1 TRP A 133 4.907 -16.301 3.245 1.00 1.00 C ATOM 2084 CD2 TRP A 133 5.258 -18.190 2.099 1.00 1.00 C ATOM 2085 NE1 TRP A 133 5.550 -15.971 2.076 1.00 1.00 N ATOM 2086 CE2 TRP A 133 5.775 -17.114 1.356 1.00 1.00 C ATOM 2087 CE3 TRP A 133 5.363 -19.482 1.578 1.00 1.00 C ATOM 2088 CZ2 TRP A 133 6.388 -17.289 0.122 1.00 1.00 C ATOM 2089 CZ3 TRP A 133 5.972 -19.656 0.351 1.00 1.00 C ATOM 2090 CH2 TRP A 133 6.478 -18.564 -0.365 1.00 1.00 C ATOM 0 H TRP A 133 4.600 -17.251 6.499 1.00 1.00 H new ATOM 0 HA TRP A 133 2.670 -16.753 4.532 1.00 1.00 H new ATOM 0 HB2 TRP A 133 4.792 -18.777 5.087 1.00 1.00 H new ATOM 0 HB3 TRP A 133 3.537 -19.277 3.971 1.00 1.00 H new ATOM 0 HD1 TRP A 133 4.604 -15.597 4.006 1.00 1.00 H new ATOM 0 HE1 TRP A 133 5.816 -15.028 1.791 1.00 1.00 H new ATOM 0 HE3 TRP A 133 4.975 -20.329 2.125 1.00 1.00 H new ATOM 0 HZ2 TRP A 133 6.779 -16.449 -0.433 1.00 1.00 H new ATOM 0 HZ3 TRP A 133 6.059 -20.650 -0.063 1.00 1.00 H new ATOM 0 HH2 TRP A 133 6.949 -18.732 -1.322 1.00 1.00 H new ATOM 2101 N ASP A 134 1.927 -19.171 6.622 1.00 1.00 N ATOM 2102 CA ASP A 134 0.858 -20.068 7.078 1.00 1.00 C ATOM 2103 C ASP A 134 -0.398 -19.310 7.494 1.00 1.00 C ATOM 2104 O ASP A 134 -1.518 -19.794 7.301 1.00 1.00 O ATOM 2105 CB ASP A 134 1.354 -20.906 8.259 1.00 1.00 C ATOM 2106 CG ASP A 134 0.956 -22.364 8.153 1.00 1.00 C ATOM 2107 OD1 ASP A 134 -0.130 -22.631 7.594 1.00 1.00 O ATOM 2108 OD2 ASP A 134 1.709 -23.236 8.635 1.00 1.00 O ATOM 0 H ASP A 134 2.756 -19.177 7.216 1.00 1.00 H new ATOM 0 HA ASP A 134 0.596 -20.710 6.237 1.00 1.00 H new ATOM 0 HB2 ASP A 134 2.440 -20.834 8.319 1.00 1.00 H new ATOM 0 HB3 ASP A 134 0.956 -20.492 9.185 1.00 1.00 H new ATOM 2113 N ASP A 135 -0.207 -18.139 8.080 1.00 1.00 N ATOM 2114 CA ASP A 135 -1.323 -17.323 8.551 1.00 1.00 C ATOM 2115 C ASP A 135 -2.216 -16.831 7.415 1.00 1.00 C ATOM 2116 O ASP A 135 -3.428 -16.713 7.595 1.00 1.00 O ATOM 2117 CB ASP A 135 -0.795 -16.115 9.325 1.00 1.00 C ATOM 2118 CG ASP A 135 -1.803 -15.595 10.330 1.00 1.00 C ATOM 2119 OD1 ASP A 135 -2.694 -16.369 10.738 1.00 1.00 O ATOM 2120 OD2 ASP A 135 -1.691 -14.413 10.721 1.00 1.00 O ATOM 0 H ASP A 135 0.712 -17.728 8.243 1.00 1.00 H new ATOM 0 HA ASP A 135 -1.927 -17.961 9.196 1.00 1.00 H new ATOM 0 HB2 ASP A 135 0.123 -16.391 9.843 1.00 1.00 H new ATOM 0 HB3 ASP A 135 -0.539 -15.320 8.624 1.00 1.00 H new ATOM 2125 N PHE A 136 -1.620 -16.517 6.262 1.00 1.00 N ATOM 2126 CA PHE A 136 -2.392 -16.006 5.131 1.00 1.00 C ATOM 2127 C PHE A 136 -2.078 -16.764 3.839 1.00 1.00 C ATOM 2128 O PHE A 136 -0.966 -17.230 3.632 1.00 1.00 O ATOM 2129 CB PHE A 136 -2.085 -14.523 4.957 1.00 1.00 C ATOM 2130 CG PHE A 136 -2.581 -13.697 6.092 1.00 1.00 C ATOM 2131 CD1 PHE A 136 -3.902 -13.279 6.133 1.00 1.00 C ATOM 2132 CD2 PHE A 136 -1.738 -13.347 7.135 1.00 1.00 C ATOM 2133 CE1 PHE A 136 -4.372 -12.527 7.193 1.00 1.00 C ATOM 2134 CE2 PHE A 136 -2.203 -12.595 8.197 1.00 1.00 C ATOM 2135 CZ PHE A 136 -3.521 -12.185 8.227 1.00 1.00 C ATOM 0 H PHE A 136 -0.619 -16.607 6.090 1.00 1.00 H new ATOM 0 HA PHE A 136 -3.452 -16.151 5.340 1.00 1.00 H new ATOM 0 HB2 PHE A 136 -1.008 -14.388 4.858 1.00 1.00 H new ATOM 0 HB3 PHE A 136 -2.537 -14.169 4.030 1.00 1.00 H new ATOM 0 HD1 PHE A 136 -4.571 -13.544 5.328 1.00 1.00 H new ATOM 0 HD2 PHE A 136 -0.706 -13.666 7.118 1.00 1.00 H new ATOM 0 HE1 PHE A 136 -5.403 -12.207 7.213 1.00 1.00 H new ATOM 0 HE2 PHE A 136 -1.536 -12.328 9.003 1.00 1.00 H new ATOM 0 HZ PHE A 136 -3.886 -11.598 9.057 1.00 1.00 H new ATOM 2145 N THR A 137 -3.073 -16.860 2.973 1.00 1.00 N ATOM 2146 CA THR A 137 -2.908 -17.534 1.698 1.00 1.00 C ATOM 2147 C THR A 137 -3.129 -16.548 0.552 1.00 1.00 C ATOM 2148 O THR A 137 -4.137 -15.835 0.535 1.00 1.00 O ATOM 2149 CB THR A 137 -3.894 -18.709 1.579 1.00 1.00 C ATOM 2150 OG1 THR A 137 -3.303 -19.796 0.902 1.00 1.00 O ATOM 2151 CG2 THR A 137 -5.168 -18.347 0.850 1.00 1.00 C ATOM 0 H THR A 137 -4.006 -16.478 3.131 1.00 1.00 H new ATOM 0 HA THR A 137 -1.892 -17.925 1.640 1.00 1.00 H new ATOM 0 HB THR A 137 -4.146 -18.978 2.605 1.00 1.00 H new ATOM 0 HG1 THR A 137 -3.947 -20.532 0.840 1.00 1.00 H new ATOM 0 HG21 THR A 137 -5.819 -19.219 0.801 1.00 1.00 H new ATOM 0 HG22 THR A 137 -5.677 -17.544 1.383 1.00 1.00 H new ATOM 0 HG23 THR A 137 -4.928 -18.016 -0.160 1.00 1.00 H new ATOM 2159 N LYS A 138 -2.192 -16.487 -0.394 1.00 1.00 N ATOM 2160 CA LYS A 138 -2.327 -15.558 -1.512 1.00 1.00 C ATOM 2161 C LYS A 138 -3.496 -15.938 -2.417 1.00 1.00 C ATOM 2162 O LYS A 138 -3.574 -17.053 -2.916 1.00 1.00 O ATOM 2163 CB LYS A 138 -1.035 -15.528 -2.337 1.00 1.00 C ATOM 2164 CG LYS A 138 -0.720 -16.844 -3.020 1.00 1.00 C ATOM 2165 CD LYS A 138 0.749 -17.199 -2.917 1.00 1.00 C ATOM 2166 CE LYS A 138 1.270 -17.854 -4.186 1.00 1.00 C ATOM 2167 NZ LYS A 138 2.499 -17.194 -4.688 1.00 1.00 N ATOM 0 H LYS A 138 -1.347 -17.058 -0.409 1.00 1.00 H new ATOM 0 HA LYS A 138 -2.520 -14.570 -1.095 1.00 1.00 H new ATOM 0 HB2 LYS A 138 -1.114 -14.746 -3.092 1.00 1.00 H new ATOM 0 HB3 LYS A 138 -0.204 -15.258 -1.685 1.00 1.00 H new ATOM 0 HG2 LYS A 138 -1.317 -17.638 -2.571 1.00 1.00 H new ATOM 0 HG3 LYS A 138 -1.006 -16.785 -4.070 1.00 1.00 H new ATOM 0 HD2 LYS A 138 1.326 -16.297 -2.712 1.00 1.00 H new ATOM 0 HD3 LYS A 138 0.900 -17.873 -2.074 1.00 1.00 H new ATOM 0 HE2 LYS A 138 1.477 -18.906 -3.992 1.00 1.00 H new ATOM 0 HE3 LYS A 138 0.499 -17.818 -4.956 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 2.821 -17.672 -5.554 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 2.296 -16.196 -4.898 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 3.244 -17.251 -3.964 1.00 1.00 H new ATOM 2181 N VAL A 139 -4.376 -14.972 -2.665 1.00 1.00 N ATOM 2182 CA VAL A 139 -5.512 -15.163 -3.552 1.00 1.00 C ATOM 2183 C VAL A 139 -5.017 -15.430 -4.966 1.00 1.00 C ATOM 2184 O VAL A 139 -5.519 -16.287 -5.678 1.00 1.00 O ATOM 2185 CB VAL A 139 -6.451 -13.939 -3.579 1.00 1.00 C ATOM 2186 CG1 VAL A 139 -7.902 -14.391 -3.673 1.00 1.00 C ATOM 2187 CG2 VAL A 139 -6.232 -13.064 -2.355 1.00 1.00 C ATOM 0 H VAL A 139 -4.319 -14.039 -2.257 1.00 1.00 H new ATOM 0 HA VAL A 139 -6.077 -16.013 -3.170 1.00 1.00 H new ATOM 0 HB VAL A 139 -6.219 -13.342 -4.461 1.00 1.00 H new ATOM 0 HG11 VAL A 139 -8.555 -13.518 -3.691 1.00 1.00 H new ATOM 0 HG12 VAL A 139 -8.044 -14.970 -4.586 1.00 1.00 H new ATOM 0 HG13 VAL A 139 -8.147 -15.009 -2.809 1.00 1.00 H new ATOM 0 HG21 VAL A 139 -6.905 -12.207 -2.395 1.00 1.00 H new ATOM 0 HG22 VAL A 139 -6.434 -13.642 -1.453 1.00 1.00 H new ATOM 0 HG23 VAL A 139 -5.200 -12.714 -2.338 1.00 1.00 H new ATOM 2197 N SER A 140 -4.020 -14.642 -5.367 1.00 1.00 N ATOM 2198 CA SER A 140 -3.430 -14.739 -6.700 1.00 1.00 C ATOM 2199 C SER A 140 -2.037 -14.118 -6.725 1.00 1.00 C ATOM 2200 O SER A 140 -1.645 -13.390 -5.799 1.00 1.00 O ATOM 2201 CB SER A 140 -4.329 -14.057 -7.738 1.00 1.00 C ATOM 2202 OG SER A 140 -4.577 -14.911 -8.842 1.00 1.00 O ATOM 0 H SER A 140 -3.601 -13.922 -4.779 1.00 1.00 H new ATOM 0 HA SER A 140 -3.341 -15.796 -6.952 1.00 1.00 H new ATOM 0 HB2 SER A 140 -5.274 -13.774 -7.274 1.00 1.00 H new ATOM 0 HB3 SER A 140 -3.856 -13.138 -8.085 1.00 1.00 H new ATOM 0 HG SER A 140 -5.154 -14.452 -9.488 1.00 1.00 H new ATOM 2208 N SER A 141 -1.288 -14.398 -7.771 1.00 1.00 N ATOM 2209 CA SER A 141 0.056 -13.874 -7.906 1.00 1.00 C ATOM 2210 C SER A 141 0.291 -13.292 -9.294 1.00 1.00 C ATOM 2211 O SER A 141 -0.269 -13.748 -10.286 1.00 1.00 O ATOM 2212 CB SER A 141 1.085 -14.976 -7.626 1.00 1.00 C ATOM 2213 OG SER A 141 0.451 -16.234 -7.481 1.00 1.00 O ATOM 0 H SER A 141 -1.589 -14.990 -8.545 1.00 1.00 H new ATOM 0 HA SER A 141 0.173 -13.073 -7.177 1.00 1.00 H new ATOM 0 HB2 SER A 141 1.807 -15.020 -8.441 1.00 1.00 H new ATOM 0 HB3 SER A 141 1.641 -14.738 -6.719 1.00 1.00 H new ATOM 0 HG SER A 141 1.126 -16.922 -7.305 1.00 1.00 H new ATOM 2219 N ARG A 142 1.127 -12.262 -9.351 1.00 1.00 N ATOM 2220 CA ARG A 142 1.436 -11.594 -10.609 1.00 1.00 C ATOM 2221 C ARG A 142 2.946 -11.434 -10.791 1.00 1.00 C ATOM 2222 O ARG A 142 3.676 -11.193 -9.826 1.00 1.00 O ATOM 2223 CB ARG A 142 0.751 -10.225 -10.667 1.00 1.00 C ATOM 2224 CG ARG A 142 -0.520 -10.195 -11.501 1.00 1.00 C ATOM 2225 CD ARG A 142 -1.264 -8.877 -11.324 1.00 1.00 C ATOM 2226 NE ARG A 142 -2.490 -8.833 -12.127 1.00 1.00 N ATOM 2227 CZ ARG A 142 -3.639 -9.399 -11.762 1.00 1.00 C ATOM 2228 NH1 ARG A 142 -3.727 -10.072 -10.621 1.00 1.00 N ATOM 2229 NH2 ARG A 142 -4.708 -9.285 -12.539 1.00 1.00 N ATOM 0 H ARG A 142 1.604 -11.871 -8.539 1.00 1.00 H new ATOM 0 HA ARG A 142 1.059 -12.215 -11.421 1.00 1.00 H new ATOM 0 HB2 ARG A 142 0.513 -9.908 -9.652 1.00 1.00 H new ATOM 0 HB3 ARG A 142 1.454 -9.497 -11.072 1.00 1.00 H new ATOM 0 HG2 ARG A 142 -0.271 -10.337 -12.553 1.00 1.00 H new ATOM 0 HG3 ARG A 142 -1.167 -11.023 -11.212 1.00 1.00 H new ATOM 0 HD2 ARG A 142 -1.513 -8.738 -10.272 1.00 1.00 H new ATOM 0 HD3 ARG A 142 -0.613 -8.051 -11.609 1.00 1.00 H new ATOM 0 HE ARG A 142 -2.461 -8.339 -13.019 1.00 1.00 H new ATOM 0 HH11 ARG A 142 -2.911 -10.159 -10.016 1.00 1.00 H new ATOM 0 HH12 ARG A 142 -4.611 -10.502 -10.350 1.00 1.00 H new ATOM 0 HH21 ARG A 142 -4.649 -8.765 -13.414 1.00 1.00 H new ATOM 0 HH22 ARG A 142 -5.589 -9.718 -12.261 1.00 1.00 H new ATOM 2243 N THR A 143 3.406 -11.565 -12.037 1.00 1.00 N ATOM 2244 CA THR A 143 4.820 -11.448 -12.361 1.00 1.00 C ATOM 2245 C THR A 143 5.088 -10.321 -13.362 1.00 1.00 C ATOM 2246 O THR A 143 4.420 -10.202 -14.391 1.00 1.00 O ATOM 2247 CB THR A 143 5.343 -12.773 -12.921 1.00 1.00 C ATOM 2248 OG1 THR A 143 5.545 -13.707 -11.874 1.00 1.00 O ATOM 2249 CG2 THR A 143 6.651 -12.636 -13.689 1.00 1.00 C ATOM 0 H THR A 143 2.809 -11.754 -12.842 1.00 1.00 H new ATOM 0 HA THR A 143 5.347 -11.205 -11.438 1.00 1.00 H new ATOM 0 HB THR A 143 4.578 -13.117 -13.617 1.00 1.00 H new ATOM 0 HG1 THR A 143 5.878 -14.550 -12.247 1.00 1.00 H new ATOM 0 HG21 THR A 143 6.961 -13.614 -14.056 1.00 1.00 H new ATOM 0 HG22 THR A 143 6.509 -11.960 -14.532 1.00 1.00 H new ATOM 0 HG23 THR A 143 7.420 -12.236 -13.029 1.00 1.00 H new ATOM 2257 N VAL A 144 6.068 -9.480 -13.038 1.00 1.00 N ATOM 2258 CA VAL A 144 6.432 -8.357 -13.900 1.00 1.00 C ATOM 2259 C VAL A 144 7.871 -8.501 -14.396 1.00 1.00 C ATOM 2260 O VAL A 144 8.789 -8.750 -13.610 1.00 1.00 O ATOM 2261 CB VAL A 144 6.273 -7.011 -13.167 1.00 1.00 C ATOM 2262 CG1 VAL A 144 6.343 -5.857 -14.158 1.00 1.00 C ATOM 2263 CG2 VAL A 144 4.971 -6.979 -12.388 1.00 1.00 C ATOM 0 H VAL A 144 6.624 -9.555 -12.186 1.00 1.00 H new ATOM 0 HA VAL A 144 5.754 -8.370 -14.753 1.00 1.00 H new ATOM 0 HB VAL A 144 7.093 -6.902 -12.457 1.00 1.00 H new ATOM 0 HG11 VAL A 144 6.229 -4.913 -13.626 1.00 1.00 H new ATOM 0 HG12 VAL A 144 7.307 -5.873 -14.667 1.00 1.00 H new ATOM 0 HG13 VAL A 144 5.543 -5.958 -14.892 1.00 1.00 H new ATOM 0 HG21 VAL A 144 4.876 -6.021 -11.877 1.00 1.00 H new ATOM 0 HG22 VAL A 144 4.134 -7.109 -13.073 1.00 1.00 H new ATOM 0 HG23 VAL A 144 4.967 -7.784 -11.653 1.00 1.00 H new ATOM 2273 N GLU A 145 8.055 -8.375 -15.707 1.00 1.00 N ATOM 2274 CA GLU A 145 9.374 -8.515 -16.313 1.00 1.00 C ATOM 2275 C GLU A 145 9.799 -7.232 -17.017 1.00 1.00 C ATOM 2276 O GLU A 145 8.977 -6.522 -17.588 1.00 1.00 O ATOM 2277 CB GLU A 145 9.378 -9.685 -17.308 1.00 1.00 C ATOM 2278 CG GLU A 145 8.320 -10.736 -17.002 1.00 1.00 C ATOM 2279 CD GLU A 145 8.502 -11.994 -17.831 1.00 1.00 C ATOM 2280 OE1 GLU A 145 7.938 -12.060 -18.944 1.00 1.00 O ATOM 2281 OE2 GLU A 145 9.214 -12.911 -17.369 1.00 1.00 O ATOM 0 H GLU A 145 7.306 -8.176 -16.370 1.00 1.00 H new ATOM 0 HA GLU A 145 10.089 -8.717 -15.516 1.00 1.00 H new ATOM 0 HB2 GLU A 145 9.216 -9.298 -18.314 1.00 1.00 H new ATOM 0 HB3 GLU A 145 10.361 -10.156 -17.301 1.00 1.00 H new ATOM 0 HG2 GLU A 145 8.361 -10.992 -15.943 1.00 1.00 H new ATOM 0 HG3 GLU A 145 7.331 -10.319 -17.191 1.00 1.00 H new ATOM 2288 N ASP A 146 11.094 -6.925 -16.951 1.00 1.00 N ATOM 2289 CA ASP A 146 11.651 -5.715 -17.560 1.00 1.00 C ATOM 2290 C ASP A 146 13.125 -5.897 -17.928 1.00 1.00 C ATOM 2291 O ASP A 146 13.747 -6.871 -17.524 1.00 1.00 O ATOM 2292 CB ASP A 146 11.497 -4.536 -16.604 1.00 1.00 C ATOM 2293 CG ASP A 146 10.371 -3.632 -17.013 1.00 1.00 C ATOM 2294 OD1 ASP A 146 9.201 -4.031 -16.844 1.00 1.00 O ATOM 2295 OD2 ASP A 146 10.650 -2.523 -17.516 1.00 1.00 O ATOM 0 H ASP A 146 11.786 -7.505 -16.476 1.00 1.00 H new ATOM 0 HA ASP A 146 11.099 -5.518 -18.479 1.00 1.00 H new ATOM 0 HB2 ASP A 146 11.317 -4.907 -15.595 1.00 1.00 H new ATOM 0 HB3 ASP A 146 12.427 -3.968 -16.574 1.00 1.00 H new ATOM 2300 N THR A 147 13.673 -4.959 -18.700 1.00 1.00 N ATOM 2301 CA THR A 147 15.068 -5.040 -19.118 1.00 1.00 C ATOM 2302 C THR A 147 16.004 -5.010 -17.912 1.00 1.00 C ATOM 2303 O THR A 147 16.950 -5.805 -17.819 1.00 1.00 O ATOM 2304 CB THR A 147 15.404 -3.889 -20.079 1.00 1.00 C ATOM 2305 OG1 THR A 147 15.599 -4.368 -21.400 1.00 1.00 O ATOM 2306 CG2 THR A 147 16.633 -3.107 -19.673 1.00 1.00 C ATOM 0 H THR A 147 13.174 -4.139 -19.046 1.00 1.00 H new ATOM 0 HA THR A 147 15.211 -5.988 -19.637 1.00 1.00 H new ATOM 0 HB THR A 147 14.545 -3.220 -20.035 1.00 1.00 H new ATOM 0 HG1 THR A 147 15.810 -3.617 -21.993 1.00 1.00 H new ATOM 0 HG21 THR A 147 16.812 -2.310 -20.395 1.00 1.00 H new ATOM 0 HG22 THR A 147 16.478 -2.674 -18.685 1.00 1.00 H new ATOM 0 HG23 THR A 147 17.496 -3.773 -19.646 1.00 1.00 H new ATOM 2314 N ASN A 148 15.739 -4.091 -16.994 1.00 1.00 N ATOM 2315 CA ASN A 148 16.548 -3.962 -15.784 1.00 1.00 C ATOM 2316 C ASN A 148 16.021 -4.906 -14.696 1.00 1.00 C ATOM 2317 O ASN A 148 14.818 -4.912 -14.417 1.00 1.00 O ATOM 2318 CB ASN A 148 16.518 -2.514 -15.295 1.00 1.00 C ATOM 2319 CG ASN A 148 16.939 -2.374 -13.846 1.00 1.00 C ATOM 2320 OD1 ASN A 148 17.690 -3.203 -13.332 1.00 1.00 O ATOM 2321 ND2 ASN A 148 16.472 -1.322 -13.185 1.00 1.00 N ATOM 0 H ASN A 148 14.971 -3.423 -17.061 1.00 1.00 H new ATOM 0 HA ASN A 148 17.579 -4.236 -16.010 1.00 1.00 H new ATOM 0 HB2 ASN A 148 17.177 -1.911 -15.920 1.00 1.00 H new ATOM 0 HB3 ASN A 148 15.511 -2.115 -15.416 1.00 1.00 H new ATOM 0 HD21 ASN A 148 16.733 -1.175 -12.210 1.00 1.00 H new ATOM 0 HD22 ASN A 148 15.852 -0.660 -13.652 1.00 1.00 H new ATOM 2328 N PRO A 149 16.893 -5.732 -14.090 1.00 1.00 N ATOM 2329 CA PRO A 149 16.480 -6.693 -13.054 1.00 1.00 C ATOM 2330 C PRO A 149 15.786 -6.012 -11.888 1.00 1.00 C ATOM 2331 O PRO A 149 14.838 -6.546 -11.320 1.00 1.00 O ATOM 2332 CB PRO A 149 17.799 -7.319 -12.606 1.00 1.00 C ATOM 2333 CG PRO A 149 18.736 -7.110 -13.737 1.00 1.00 C ATOM 2334 CD PRO A 149 18.341 -5.816 -14.377 1.00 1.00 C ATOM 0 HA PRO A 149 15.759 -7.419 -13.429 1.00 1.00 H new ATOM 0 HB2 PRO A 149 18.169 -6.847 -11.696 1.00 1.00 H new ATOM 0 HB3 PRO A 149 17.677 -8.380 -12.388 1.00 1.00 H new ATOM 0 HG2 PRO A 149 19.767 -7.071 -13.385 1.00 1.00 H new ATOM 0 HG3 PRO A 149 18.673 -7.932 -14.451 1.00 1.00 H new ATOM 0 HD2 PRO A 149 18.886 -4.973 -13.953 1.00 1.00 H new ATOM 0 HD3 PRO A 149 18.541 -5.818 -15.449 1.00 1.00 H new ATOM 2342 N ALA A 150 16.253 -4.807 -11.543 1.00 1.00 N ATOM 2343 CA ALA A 150 15.665 -4.034 -10.458 1.00 1.00 C ATOM 2344 C ALA A 150 14.229 -3.655 -10.794 1.00 1.00 C ATOM 2345 O ALA A 150 13.348 -3.646 -9.932 1.00 1.00 O ATOM 2346 CB ALA A 150 16.512 -2.802 -10.199 1.00 1.00 C ATOM 0 H ALA A 150 17.039 -4.350 -12.005 1.00 1.00 H new ATOM 0 HA ALA A 150 15.643 -4.638 -9.551 1.00 1.00 H new ATOM 0 HB1 ALA A 150 16.073 -2.223 -9.387 1.00 1.00 H new ATOM 0 HB2 ALA A 150 17.522 -3.106 -9.923 1.00 1.00 H new ATOM 0 HB3 ALA A 150 16.551 -2.191 -11.101 1.00 1.00 H new ATOM 2352 N LEU A 151 14.005 -3.339 -12.074 1.00 1.00 N ATOM 2353 CA LEU A 151 12.681 -2.949 -12.558 1.00 1.00 C ATOM 2354 C LEU A 151 11.673 -4.098 -12.418 1.00 1.00 C ATOM 2355 O LEU A 151 10.501 -3.880 -12.101 1.00 1.00 O ATOM 2356 CB LEU A 151 12.760 -2.503 -14.026 1.00 1.00 C ATOM 2357 CG LEU A 151 12.847 -0.994 -14.236 1.00 1.00 C ATOM 2358 CD1 LEU A 151 12.959 -0.662 -15.719 1.00 1.00 C ATOM 2359 CD2 LEU A 151 11.642 -0.307 -13.617 1.00 1.00 C ATOM 0 H LEU A 151 14.728 -3.347 -12.794 1.00 1.00 H new ATOM 0 HA LEU A 151 12.336 -2.116 -11.945 1.00 1.00 H new ATOM 0 HB2 LEU A 151 13.631 -2.970 -14.486 1.00 1.00 H new ATOM 0 HB3 LEU A 151 11.882 -2.878 -14.552 1.00 1.00 H new ATOM 0 HG LEU A 151 13.745 -0.625 -13.741 1.00 1.00 H new ATOM 0 HD11 LEU A 151 13.020 0.419 -15.846 1.00 1.00 H new ATOM 0 HD12 LEU A 151 13.856 -1.127 -16.129 1.00 1.00 H new ATOM 0 HD13 LEU A 151 12.082 -1.040 -16.244 1.00 1.00 H new ATOM 0 HD21 LEU A 151 11.716 0.769 -13.774 1.00 1.00 H new ATOM 0 HD22 LEU A 151 10.731 -0.680 -14.085 1.00 1.00 H new ATOM 0 HD23 LEU A 151 11.613 -0.517 -12.548 1.00 1.00 H new ATOM 2371 N THR A 152 12.128 -5.318 -12.672 1.00 1.00 N ATOM 2372 CA THR A 152 11.255 -6.481 -12.574 1.00 1.00 C ATOM 2373 C THR A 152 10.798 -6.672 -11.130 1.00 1.00 C ATOM 2374 O THR A 152 11.590 -6.569 -10.198 1.00 1.00 O ATOM 2375 CB THR A 152 11.988 -7.729 -13.062 1.00 1.00 C ATOM 2376 OG1 THR A 152 11.830 -7.883 -14.457 1.00 1.00 O ATOM 2377 CG2 THR A 152 11.504 -9.004 -12.399 1.00 1.00 C ATOM 0 H THR A 152 13.088 -5.528 -12.945 1.00 1.00 H new ATOM 0 HA THR A 152 10.379 -6.319 -13.202 1.00 1.00 H new ATOM 0 HB THR A 152 13.034 -7.577 -12.797 1.00 1.00 H new ATOM 0 HG1 THR A 152 12.697 -8.089 -14.864 1.00 1.00 H new ATOM 0 HG21 THR A 152 12.065 -9.853 -12.790 1.00 1.00 H new ATOM 0 HG22 THR A 152 11.655 -8.934 -11.322 1.00 1.00 H new ATOM 0 HG23 THR A 152 10.443 -9.143 -12.608 1.00 1.00 H new ATOM 2385 N HIS A 153 9.495 -6.940 -10.966 1.00 1.00 N ATOM 2386 CA HIS A 153 8.923 -7.125 -9.637 1.00 1.00 C ATOM 2387 C HIS A 153 7.750 -8.103 -9.661 1.00 1.00 C ATOM 2388 O HIS A 153 7.177 -8.380 -10.712 1.00 1.00 O ATOM 2389 CB HIS A 153 8.453 -5.784 -9.078 1.00 1.00 C ATOM 2390 CG HIS A 153 7.159 -5.299 -9.655 1.00 1.00 C ATOM 2391 ND1 HIS A 153 7.095 -4.455 -10.743 1.00 1.00 N ATOM 2392 CD2 HIS A 153 5.876 -5.536 -9.290 1.00 1.00 C ATOM 2393 CE1 HIS A 153 5.831 -4.193 -11.022 1.00 1.00 C ATOM 2394 NE2 HIS A 153 5.071 -4.838 -10.155 1.00 1.00 N ATOM 0 H HIS A 153 8.828 -7.032 -11.732 1.00 1.00 H new ATOM 0 HA HIS A 153 9.702 -7.541 -8.998 1.00 1.00 H new ATOM 0 HB2 HIS A 153 8.346 -5.871 -7.997 1.00 1.00 H new ATOM 0 HB3 HIS A 153 9.224 -5.036 -9.263 1.00 1.00 H new ATOM 0 HD2 HIS A 153 5.548 -6.158 -8.471 1.00 1.00 H new ATOM 0 HE1 HIS A 153 5.479 -3.559 -11.823 1.00 1.00 H new ATOM 0 HE2 HIS A 153 4.051 -4.820 -10.132 1.00 1.00 H new ATOM 2403 N THR A 154 7.391 -8.617 -8.480 1.00 1.00 N ATOM 2404 CA THR A 154 6.289 -9.553 -8.356 1.00 1.00 C ATOM 2405 C THR A 154 5.207 -8.998 -7.426 1.00 1.00 C ATOM 2406 O THR A 154 5.484 -8.629 -6.282 1.00 1.00 O ATOM 2407 CB THR A 154 6.784 -10.886 -7.822 1.00 1.00 C ATOM 2408 OG1 THR A 154 8.122 -10.779 -7.364 1.00 1.00 O ATOM 2409 CG2 THR A 154 6.726 -11.996 -8.850 1.00 1.00 C ATOM 0 H THR A 154 7.854 -8.394 -7.599 1.00 1.00 H new ATOM 0 HA THR A 154 5.860 -9.700 -9.347 1.00 1.00 H new ATOM 0 HB THR A 154 6.113 -11.141 -7.002 1.00 1.00 H new ATOM 0 HG1 THR A 154 8.421 -11.647 -7.023 1.00 1.00 H new ATOM 0 HG21 THR A 154 7.093 -12.922 -8.407 1.00 1.00 H new ATOM 0 HG22 THR A 154 5.696 -12.134 -9.179 1.00 1.00 H new ATOM 0 HG23 THR A 154 7.347 -11.732 -9.706 1.00 1.00 H new ATOM 2417 N TYR A 155 3.967 -8.967 -7.917 1.00 1.00 N ATOM 2418 CA TYR A 155 2.851 -8.481 -7.126 1.00 1.00 C ATOM 2419 C TYR A 155 1.991 -9.642 -6.655 1.00 1.00 C ATOM 2420 O TYR A 155 1.627 -10.518 -7.447 1.00 1.00 O ATOM 2421 CB TYR A 155 2.017 -7.494 -7.944 1.00 1.00 C ATOM 2422 CG TYR A 155 1.326 -6.447 -7.096 1.00 1.00 C ATOM 2423 CD1 TYR A 155 0.219 -6.769 -6.322 1.00 1.00 C ATOM 2424 CD2 TYR A 155 1.784 -5.136 -7.078 1.00 1.00 C ATOM 2425 CE1 TYR A 155 -0.415 -5.812 -5.551 1.00 1.00 C ATOM 2426 CE2 TYR A 155 1.156 -4.172 -6.310 1.00 1.00 C ATOM 2427 CZ TYR A 155 0.057 -4.515 -5.549 1.00 1.00 C ATOM 2428 OH TYR A 155 -0.572 -3.554 -4.788 1.00 1.00 O ATOM 0 H TYR A 155 3.717 -9.273 -8.857 1.00 1.00 H new ATOM 0 HA TYR A 155 3.241 -7.964 -6.249 1.00 1.00 H new ATOM 0 HB2 TYR A 155 2.662 -6.997 -8.668 1.00 1.00 H new ATOM 0 HB3 TYR A 155 1.267 -8.045 -8.511 1.00 1.00 H new ATOM 0 HD1 TYR A 155 -0.153 -7.783 -6.322 1.00 1.00 H new ATOM 0 HD2 TYR A 155 2.644 -4.865 -7.673 1.00 1.00 H new ATOM 0 HE1 TYR A 155 -1.275 -6.078 -4.954 1.00 1.00 H new ATOM 0 HE2 TYR A 155 1.524 -3.157 -6.306 1.00 1.00 H new ATOM 0 HH TYR A 155 -0.112 -2.696 -4.900 1.00 1.00 H new ATOM 2438 N GLU A 156 1.682 -9.665 -5.363 1.00 1.00 N ATOM 2439 CA GLU A 156 0.877 -10.741 -4.790 1.00 1.00 C ATOM 2440 C GLU A 156 -0.223 -10.197 -3.880 1.00 1.00 C ATOM 2441 O GLU A 156 -0.041 -9.191 -3.193 1.00 1.00 O ATOM 2442 CB GLU A 156 1.770 -11.718 -4.004 1.00 1.00 C ATOM 2443 CG GLU A 156 2.535 -12.690 -4.885 1.00 1.00 C ATOM 2444 CD GLU A 156 3.985 -12.295 -5.088 1.00 1.00 C ATOM 2445 OE1 GLU A 156 4.531 -11.572 -4.229 1.00 1.00 O ATOM 2446 OE2 GLU A 156 4.574 -12.713 -6.107 1.00 1.00 O ATOM 0 H GLU A 156 1.975 -8.954 -4.693 1.00 1.00 H new ATOM 0 HA GLU A 156 0.402 -11.271 -5.616 1.00 1.00 H new ATOM 0 HB2 GLU A 156 2.480 -11.147 -3.407 1.00 1.00 H new ATOM 0 HB3 GLU A 156 1.150 -12.283 -3.308 1.00 1.00 H new ATOM 0 HG2 GLU A 156 2.494 -13.684 -4.439 1.00 1.00 H new ATOM 0 HG3 GLU A 156 2.043 -12.756 -5.856 1.00 1.00 H new ATOM 2453 N VAL A 157 -1.367 -10.891 -3.877 1.00 1.00 N ATOM 2454 CA VAL A 157 -2.516 -10.521 -3.064 1.00 1.00 C ATOM 2455 C VAL A 157 -2.885 -11.666 -2.121 1.00 1.00 C ATOM 2456 O VAL A 157 -2.996 -12.805 -2.556 1.00 1.00 O ATOM 2457 CB VAL A 157 -3.734 -10.164 -3.940 1.00 1.00 C ATOM 2458 CG1 VAL A 157 -4.452 -8.939 -3.399 1.00 1.00 C ATOM 2459 CG2 VAL A 157 -3.298 -9.930 -5.376 1.00 1.00 C ATOM 0 H VAL A 157 -1.516 -11.727 -4.443 1.00 1.00 H new ATOM 0 HA VAL A 157 -2.240 -9.641 -2.483 1.00 1.00 H new ATOM 0 HB VAL A 157 -4.430 -11.003 -3.915 1.00 1.00 H new ATOM 0 HG11 VAL A 157 -5.307 -8.708 -4.035 1.00 1.00 H new ATOM 0 HG12 VAL A 157 -4.797 -9.138 -2.384 1.00 1.00 H new ATOM 0 HG13 VAL A 157 -3.768 -8.091 -3.389 1.00 1.00 H new ATOM 0 HG21 VAL A 157 -4.167 -9.679 -5.984 1.00 1.00 H new ATOM 0 HG22 VAL A 157 -2.582 -9.109 -5.410 1.00 1.00 H new ATOM 0 HG23 VAL A 157 -2.831 -10.834 -5.767 1.00 1.00 H new ATOM 2469 N TRP A 158 -3.058 -11.367 -0.844 1.00 1.00 N ATOM 2470 CA TRP A 158 -3.386 -12.398 0.145 1.00 1.00 C ATOM 2471 C TRP A 158 -4.489 -11.960 1.082 1.00 1.00 C ATOM 2472 O TRP A 158 -4.624 -10.772 1.375 1.00 1.00 O ATOM 2473 CB TRP A 158 -2.164 -12.755 1.007 1.00 1.00 C ATOM 2474 CG TRP A 158 -0.842 -12.718 0.295 1.00 1.00 C ATOM 2475 CD1 TRP A 158 -0.323 -11.691 -0.439 1.00 1.00 C ATOM 2476 CD2 TRP A 158 0.125 -13.774 0.248 1.00 1.00 C ATOM 2477 NE1 TRP A 158 0.906 -12.044 -0.941 1.00 1.00 N ATOM 2478 CE2 TRP A 158 1.204 -13.317 -0.533 1.00 1.00 C ATOM 2479 CE3 TRP A 158 0.184 -15.061 0.791 1.00 1.00 C ATOM 2480 CZ2 TRP A 158 2.327 -14.102 -0.783 1.00 1.00 C ATOM 2481 CZ3 TRP A 158 1.299 -15.839 0.541 1.00 1.00 C ATOM 2482 CH2 TRP A 158 2.357 -15.357 -0.240 1.00 1.00 C ATOM 0 H TRP A 158 -2.979 -10.424 -0.462 1.00 1.00 H new ATOM 0 HA TRP A 158 -3.715 -13.263 -0.430 1.00 1.00 H new ATOM 0 HB2 TRP A 158 -2.122 -12.067 1.851 1.00 1.00 H new ATOM 0 HB3 TRP A 158 -2.309 -13.754 1.417 1.00 1.00 H new ATOM 0 HD1 TRP A 158 -0.808 -10.740 -0.601 1.00 1.00 H new ATOM 0 HE1 TRP A 158 1.500 -11.454 -1.523 1.00 1.00 H new ATOM 0 HE3 TRP A 158 -0.627 -15.441 1.395 1.00 1.00 H new ATOM 0 HZ2 TRP A 158 3.145 -13.733 -1.384 1.00 1.00 H new ATOM 0 HZ3 TRP A 158 1.355 -16.835 0.955 1.00 1.00 H new ATOM 0 HH2 TRP A 158 3.214 -15.989 -0.417 1.00 1.00 H new ATOM 2493 N GLN A 159 -5.249 -12.928 1.581 1.00 1.00 N ATOM 2494 CA GLN A 159 -6.331 -12.663 2.534 1.00 1.00 C ATOM 2495 C GLN A 159 -6.350 -13.765 3.586 1.00 1.00 C ATOM 2496 O GLN A 159 -5.879 -14.872 3.349 1.00 1.00 O ATOM 2497 CB GLN A 159 -7.686 -12.604 1.815 1.00 1.00 C ATOM 2498 CG GLN A 159 -7.595 -12.579 0.295 1.00 1.00 C ATOM 2499 CD GLN A 159 -8.848 -12.028 -0.347 1.00 1.00 C ATOM 2500 OE1 GLN A 159 -8.801 -11.029 -1.064 1.00 1.00 O ATOM 2501 NE2 GLN A 159 -9.979 -12.682 -0.102 1.00 1.00 N ATOM 0 H GLN A 159 -5.138 -13.913 1.341 1.00 1.00 H new ATOM 0 HA GLN A 159 -6.156 -11.699 3.011 1.00 1.00 H new ATOM 0 HB2 GLN A 159 -8.281 -13.466 2.116 1.00 1.00 H new ATOM 0 HB3 GLN A 159 -8.222 -11.715 2.149 1.00 1.00 H new ATOM 0 HG2 GLN A 159 -6.740 -11.974 -0.005 1.00 1.00 H new ATOM 0 HG3 GLN A 159 -7.416 -13.589 -0.072 1.00 1.00 H new ATOM 0 HE21 GLN A 159 -9.972 -13.506 0.499 1.00 1.00 H new ATOM 0 HE22 GLN A 159 -10.854 -12.360 -0.515 1.00 1.00 H new ATOM 2510 N LYS A 160 -6.884 -13.460 4.757 1.00 1.00 N ATOM 2511 CA LYS A 160 -6.944 -14.438 5.842 1.00 1.00 C ATOM 2512 C LYS A 160 -7.895 -15.588 5.509 1.00 1.00 C ATOM 2513 O LYS A 160 -8.996 -15.370 5.009 1.00 1.00 O ATOM 2514 CB LYS A 160 -7.387 -13.743 7.120 1.00 1.00 C ATOM 2515 CG LYS A 160 -8.642 -14.342 7.725 1.00 1.00 C ATOM 2516 CD LYS A 160 -9.103 -13.577 8.955 1.00 1.00 C ATOM 2517 CE LYS A 160 -10.319 -14.245 9.582 1.00 1.00 C ATOM 2518 NZ LYS A 160 -10.536 -13.815 10.990 1.00 1.00 N ATOM 0 H LYS A 160 -7.282 -12.549 4.985 1.00 1.00 H new ATOM 0 HA LYS A 160 -5.950 -14.864 5.978 1.00 1.00 H new ATOM 0 HB2 LYS A 160 -6.580 -13.793 7.851 1.00 1.00 H new ATOM 0 HB3 LYS A 160 -7.561 -12.688 6.910 1.00 1.00 H new ATOM 0 HG2 LYS A 160 -9.438 -14.344 6.980 1.00 1.00 H new ATOM 0 HG3 LYS A 160 -8.454 -15.381 7.994 1.00 1.00 H new ATOM 0 HD2 LYS A 160 -8.293 -13.528 9.683 1.00 1.00 H new ATOM 0 HD3 LYS A 160 -9.347 -12.551 8.680 1.00 1.00 H new ATOM 0 HE2 LYS A 160 -11.205 -14.010 8.992 1.00 1.00 H new ATOM 0 HE3 LYS A 160 -10.193 -15.327 9.550 1.00 1.00 H new ATOM 0 HZ1 LYS A 160 -11.374 -14.296 11.375 1.00 1.00 H new ATOM 0 HZ2 LYS A 160 -9.703 -14.062 11.561 1.00 1.00 H new ATOM 0 HZ3 LYS A 160 -10.683 -12.786 11.020 1.00 1.00 H new ATOM 2532 N LYS A 161 -7.459 -16.810 5.792 1.00 1.00 N ATOM 2533 CA LYS A 161 -8.278 -17.994 5.523 1.00 1.00 C ATOM 2534 C LYS A 161 -8.546 -18.769 6.809 1.00 1.00 C ATOM 2535 O LYS A 161 -7.649 -18.950 7.632 1.00 1.00 O ATOM 2536 CB LYS A 161 -7.597 -18.902 4.509 1.00 1.00 C ATOM 2537 CG LYS A 161 -6.436 -19.710 5.088 1.00 1.00 C ATOM 2538 CD LYS A 161 -6.853 -21.137 5.399 1.00 1.00 C ATOM 2539 CE LYS A 161 -6.394 -22.081 4.305 1.00 1.00 C ATOM 2540 NZ LYS A 161 -6.971 -23.438 4.470 1.00 1.00 N ATOM 0 H LYS A 161 -6.548 -17.010 6.206 1.00 1.00 H new ATOM 0 HA LYS A 161 -9.228 -17.655 5.111 1.00 1.00 H new ATOM 0 HB2 LYS A 161 -8.336 -19.589 4.096 1.00 1.00 H new ATOM 0 HB3 LYS A 161 -7.229 -18.296 3.682 1.00 1.00 H new ATOM 0 HG2 LYS A 161 -5.608 -19.718 4.380 1.00 1.00 H new ATOM 0 HG3 LYS A 161 -6.074 -19.229 5.997 1.00 1.00 H new ATOM 0 HD2 LYS A 161 -6.428 -21.445 6.354 1.00 1.00 H new ATOM 0 HD3 LYS A 161 -7.937 -21.190 5.501 1.00 1.00 H new ATOM 0 HE2 LYS A 161 -6.682 -21.679 3.334 1.00 1.00 H new ATOM 0 HE3 LYS A 161 -5.306 -22.145 4.313 1.00 1.00 H new ATOM 0 HZ1 LYS A 161 -6.634 -24.054 3.703 1.00 1.00 H new ATOM 0 HZ2 LYS A 161 -6.675 -23.832 5.386 1.00 1.00 H new ATOM 0 HZ3 LYS A 161 -8.009 -23.380 4.437 1.00 1.00 H new ATOM 2554 N ALA A 162 -9.783 -19.240 6.968 1.00 1.00 N ATOM 2555 CA ALA A 162 -10.158 -20.006 8.144 1.00 1.00 C ATOM 2556 C ALA A 162 -9.929 -19.185 9.415 1.00 1.00 C ATOM 2557 O ALA A 162 -10.898 -18.533 9.879 1.00 1.00 O ATOM 2558 CB ALA A 162 -9.348 -21.311 8.213 1.00 1.00 C ATOM 2559 OXT ALA A 162 -8.797 -19.210 9.930 1.00 1.00 O ATOM 0 H ALA A 162 -10.537 -19.102 6.295 1.00 1.00 H new ATOM 0 HA ALA A 162 -11.218 -20.250 8.069 1.00 1.00 H new ATOM 0 HB1 ALA A 162 -9.640 -21.874 9.099 1.00 1.00 H new ATOM 0 HB2 ALA A 162 -9.544 -21.908 7.323 1.00 1.00 H new ATOM 0 HB3 ALA A 162 -8.285 -21.077 8.266 1.00 1.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 3.956 5.862 11.369 1.00 1.00 P HETATM 2567 O1A NDP A 170 4.911 6.499 12.294 1.00 1.00 O HETATM 2568 O2A NDP A 170 2.868 5.057 11.955 1.00 1.00 O HETATM 2569 O5B NDP A 170 3.403 6.897 10.298 1.00 1.00 O HETATM 2570 C5B NDP A 170 2.031 7.327 10.324 1.00 1.00 C HETATM 2571 C4B NDP A 170 1.855 8.448 11.326 1.00 1.00 C HETATM 2572 O4B NDP A 170 0.537 9.043 11.171 1.00 1.00 O HETATM 2573 C3B NDP A 170 1.934 8.019 12.782 1.00 1.00 C HETATM 2574 O3B NDP A 170 3.286 8.087 13.254 1.00 1.00 O HETATM 2575 C2B NDP A 170 1.062 9.061 13.472 1.00 1.00 C HETATM 2576 O2B NDP A 170 1.739 10.283 13.722 1.00 1.00 O HETATM 2577 C1B NDP A 170 -0.050 9.246 12.441 1.00 1.00 C HETATM 2578 N9A NDP A 170 -1.137 8.284 12.599 1.00 1.00 N HETATM 2579 C8A NDP A 170 -1.277 7.058 11.995 1.00 1.00 C HETATM 2580 N7A NDP A 170 -2.373 6.423 12.341 1.00 1.00 N HETATM 2581 C5A NDP A 170 -3.002 7.286 13.220 1.00 1.00 C HETATM 2582 C6A NDP A 170 -4.219 7.219 13.909 1.00 1.00 C HETATM 2583 N6A NDP A 170 -5.053 6.178 13.821 1.00 1.00 N HETATM 2584 N1A NDP A 170 -4.567 8.271 14.684 1.00 1.00 N HETATM 2585 C2A NDP A 170 -3.733 9.311 14.765 1.00 1.00 C HETATM 2586 N3A NDP A 170 -2.556 9.494 14.170 1.00 1.00 N HETATM 2587 C4A NDP A 170 -2.244 8.438 13.399 1.00 1.00 C HETATM 2588 O3 NDP A 170 4.804 4.893 10.336 1.00 1.00 O HETATM 2589 PN NDP A 170 6.400 4.577 10.077 1.00 1.00 P HETATM 2590 O1N NDP A 170 7.192 5.685 10.646 1.00 1.00 O HETATM 2591 O2N NDP A 170 6.679 3.211 10.576 1.00 1.00 O HETATM 2592 O5D NDP A 170 6.373 4.626 8.484 1.00 1.00 O HETATM 2593 C5D NDP A 170 6.453 5.877 7.786 1.00 1.00 C HETATM 2594 C4D NDP A 170 7.166 5.696 6.472 1.00 1.00 C HETATM 2595 O4D NDP A 170 7.438 4.284 6.277 1.00 1.00 O HETATM 2596 C3D NDP A 170 6.373 6.103 5.234 1.00 1.00 C HETATM 2597 O3D NDP A 170 6.576 7.491 4.948 1.00 1.00 O HETATM 2598 C2D NDP A 170 6.995 5.241 4.140 1.00 1.00 C HETATM 2599 O2D NDP A 170 8.185 5.789 3.580 1.00 1.00 O HETATM 2600 C1D NDP A 170 7.295 3.947 4.906 1.00 1.00 C HETATM 2601 N1N NDP A 170 6.243 2.937 4.775 1.00 1.00 N HETATM 2602 C2N NDP A 170 6.331 1.646 4.480 1.00 1.00 C HETATM 2603 C3N NDP A 170 5.361 0.799 4.397 1.00 1.00 C HETATM 2604 C7N NDP A 170 5.878 -0.506 4.038 1.00 1.00 C HETATM 2605 O7N NDP A 170 5.693 -1.230 5.122 1.00 1.00 O HETATM 2606 N7N NDP A 170 6.454 -0.947 2.892 1.00 1.00 N HETATM 2607 C4N NDP A 170 3.977 1.298 4.662 1.00 1.00 C HETATM 2608 C5N NDP A 170 3.811 2.669 4.982 1.00 1.00 C HETATM 2609 C6N NDP A 170 4.857 3.559 5.058 1.00 1.00 C HETATM 2610 P2B NDP A 170 2.423 11.348 12.629 1.00 1.00 P HETATM 2611 O1X NDP A 170 2.756 12.510 13.648 1.00 1.00 O HETATM 2612 O2X NDP A 170 3.710 10.602 12.271 1.00 1.00 O HETATM 2613 O3X NDP A 170 1.193 11.731 11.810 1.00 1.00 O HETATM 0 HO3N NDP A 170 7.289 7.587 4.283 1.00 1.00 H new HETATM 0 HO3A NDP A 170 3.681 8.945 12.992 1.00 1.00 H new HETATM 0 HO2N NDP A 170 8.529 5.186 2.889 1.00 1.00 H new HETATM 0 H72N NDP A 170 6.763 -1.916 2.817 1.00 1.00 H new HETATM 0 H71N NDP A 170 6.578 -0.310 2.106 1.00 1.00 H new HETATM 0 H62A NDP A 170 -5.928 6.180 14.345 1.00 1.00 H new HETATM 0 H61A NDP A 170 -4.814 5.382 13.230 1.00 1.00 H new HETATM 0 H52N NDP A 170 5.451 6.270 7.613 1.00 1.00 H new HETATM 0 H52A NDP A 170 1.729 7.664 9.333 1.00 1.00 H new HETATM 0 H51N NDP A 170 6.981 6.609 8.397 1.00 1.00 H new HETATM 0 H51A NDP A 170 1.384 6.490 10.586 1.00 1.00 H new HETATM 0 H42N NDP A 170 3.372 1.086 3.781 1.00 1.00 H new HETATM 0 H41N NDP A 170 3.563 0.712 5.482 1.00 1.00 H new HETATM 0 H8A NDP A 170 -0.547 6.651 11.295 1.00 1.00 H new HETATM 0 H6N NDP A 170 4.720 4.613 5.298 1.00 1.00 H new HETATM 0 H5N NDP A 170 2.804 3.036 5.178 1.00 1.00 H new HETATM 0 H4D NDP A 170 8.045 6.335 6.552 1.00 1.00 H new HETATM 0 H4B NDP A 170 2.677 9.132 11.115 1.00 1.00 H new HETATM 0 H3D NDP A 170 5.297 5.965 5.340 1.00 1.00 H new HETATM 0 H3B NDP A 170 1.611 6.993 12.960 1.00 1.00 H new HETATM 0 H2N NDP A 170 7.332 1.259 4.287 1.00 1.00 H new HETATM 0 H2D NDP A 170 6.341 5.130 3.275 1.00 1.00 H new HETATM 0 H2B NDP A 170 0.728 8.751 14.462 1.00 1.00 H new HETATM 0 H2A NDP A 170 -4.063 10.126 15.410 1.00 1.00 H new HETATM 0 H1D NDP A 170 8.201 3.511 4.486 1.00 1.00 H new HETATM 0 H1B NDP A 170 -0.479 10.240 12.565 1.00 1.00 H new