USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1132 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 56 MET CE :methyl -119:sc= -2.29! (180deg=-3.27!) USER MOD Set 1.2: A 123 MET CE :methyl 155:sc= -2.99 (180deg=-3.78!) USER MOD Set 1.3: A 133 TYR OH : rot 15:sc= -0.356 USER MOD Set 2.1: A 33 SER OG : rot -105:sc= 1.28 USER MOD Set 2.2: A 75 HIS : no HE2:sc= -1.45 K(o=-0.16,f=-0.77!) USER MOD Set 3.1: A 20 ASN : amide:sc= 0.504 K(o=0.33,f=-7.8!) USER MOD Set 3.2: A 62 GLN : amide:sc= -0.0991 X(o=0.33,f=0.22) USER MOD Set 3.3: A 67 LYS NZ :NH3+ -179:sc= -0.0757 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ -165:sc= -0.0172 (180deg=-0.264) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.0335 K(o=-0.033,f=-1.9!) USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 12 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.0171 USER MOD Single : A 22 GLN : amide:sc= -0.368 X(o=-0.37,f=0) USER MOD Single : A 25 SER OG : rot 150:sc= -0.47 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HD1:sc= -0.0308 X(o=-0.031,f=-0.17) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 37 HIS : no HE2:sc= -3.37! C(o=-3.4!,f=-4.2!) USER MOD Single : A 38 LYS NZ :NH3+ -129:sc= -0.0278 (180deg=-1.19!) USER MOD Single : A 45 THR OG1 : rot -127:sc= 0.0811 USER MOD Single : A 47 SER OG : rot 137:sc=0.000796 USER MOD Single : A 51 MET CE :methyl 159:sc= -0.117 (180deg=-1.15) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -0.116 K(o=-0.12,f=-2.6!) USER MOD Single : A 59 GLN : amide:sc= -0.108 X(o=-0.11,f=-0.31) USER MOD Single : A 63 SER OG : rot 141:sc= 0.686 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 HIS : no HD1:sc= -0.0323 X(o=-0.032,f=-0.26) USER MOD Single : A 76 MET CE :methyl 162:sc= -0.0337 (180deg=-0.54) USER MOD Single : A 83 GLN : amide:sc= -0.0147 K(o=-0.015,f=-1.9!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -3.09! K(o=-3.1!,f=-1.4) USER MOD Single : A 86 HIS : no HE2:sc= -0.952 K(o=-0.95,f=-3.9!) USER MOD Single : A 87 GLN : amide:sc= -0.874 K(o=-0.87,f=-1.8) USER MOD Single : A 91 GLN : amide:sc= -0.0423 K(o=-0.042,f=-1.7!) USER MOD Single : A 93 GLN : amide:sc= -0.216 X(o=-0.22,f=-0.71) USER MOD Single : A 94 LYS NZ :NH3+ 162:sc=-0.000414 (180deg=-0.234) USER MOD Single : A 95 ASN : amide:sc= -3.28! K(o=-3.3!,f=-1.1) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 99 LYS NZ :NH3+ 137:sc= 0.729 (180deg=0.12) USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0.031) USER MOD Single : A 102 TYR OH : rot 15:sc= -1.93! USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.00031 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -0.256 K(o=-0.26,f=-2.3!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 LYS NZ :NH3+ -118:sc= 0.383 (180deg=-0.168) USER MOD Single : A 139 SER OG : rot -22:sc= 0.664 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 164.734 29.739 9.726 1.00 1.00 N ATOM 2 CA ALA A 1 164.405 29.899 11.136 1.00 1.00 C ATOM 3 C ALA A 1 163.093 29.192 11.454 1.00 1.00 C ATOM 4 O ALA A 1 162.914 28.652 12.545 1.00 1.00 O ATOM 5 CB ALA A 1 164.284 31.384 11.475 1.00 1.00 C ATOM 0 H1 ALA A 1 165.730 29.995 9.571 1.00 1.00 H new ATOM 0 H2 ALA A 1 164.583 28.749 9.444 1.00 1.00 H new ATOM 0 H3 ALA A 1 164.125 30.359 9.155 1.00 1.00 H new ATOM 0 HA ALA A 1 165.201 29.456 11.735 1.00 1.00 H new ATOM 0 HB1 ALA A 1 164.038 31.497 12.531 1.00 1.00 H new ATOM 0 HB2 ALA A 1 165.231 31.883 11.268 1.00 1.00 H new ATOM 0 HB3 ALA A 1 163.497 31.833 10.869 1.00 1.00 H new ATOM 11 N ARG A 2 162.178 29.203 10.490 1.00 1.00 N ATOM 12 CA ARG A 2 160.882 28.562 10.668 1.00 1.00 C ATOM 13 C ARG A 2 160.814 27.265 9.868 1.00 1.00 C ATOM 14 O ARG A 2 161.295 27.198 8.736 1.00 1.00 O ATOM 15 CB ARG A 2 159.765 29.495 10.206 1.00 1.00 C ATOM 16 CG ARG A 2 159.704 30.725 11.109 1.00 1.00 C ATOM 17 CD ARG A 2 158.649 31.683 10.559 1.00 1.00 C ATOM 18 NE ARG A 2 157.341 31.036 10.541 1.00 1.00 N ATOM 19 CZ ARG A 2 156.529 31.080 11.594 1.00 1.00 C ATOM 20 NH1 ARG A 2 156.905 31.689 12.687 1.00 1.00 N ATOM 21 NH2 ARG A 2 155.359 30.507 11.536 1.00 1.00 N ATOM 0 H ARG A 2 162.310 29.647 9.581 1.00 1.00 H new ATOM 0 HA ARG A 2 160.755 28.338 11.727 1.00 1.00 H new ATOM 0 HB2 ARG A 2 159.938 29.800 9.174 1.00 1.00 H new ATOM 0 HB3 ARG A 2 158.810 28.970 10.227 1.00 1.00 H new ATOM 0 HG2 ARG A 2 159.455 30.433 12.129 1.00 1.00 H new ATOM 0 HG3 ARG A 2 160.677 31.215 11.147 1.00 1.00 H new ATOM 0 HD2 ARG A 2 158.609 32.583 11.173 1.00 1.00 H new ATOM 0 HD3 ARG A 2 158.922 31.996 9.551 1.00 1.00 H new ATOM 0 HE ARG A 2 157.043 30.539 9.702 1.00 1.00 H new ATOM 0 HH11 ARG A 2 157.823 32.132 12.734 1.00 1.00 H new ATOM 0 HH12 ARG A 2 156.281 31.722 13.493 1.00 1.00 H new ATOM 0 HH21 ARG A 2 155.068 30.026 10.685 1.00 1.00 H new ATOM 0 HH22 ARG A 2 154.735 30.539 12.342 1.00 1.00 H new ATOM 35 N ARG A 3 160.211 26.244 10.461 1.00 1.00 N ATOM 36 CA ARG A 3 160.081 24.954 9.798 1.00 1.00 C ATOM 37 C ARG A 3 159.230 25.080 8.533 1.00 1.00 C ATOM 38 O ARG A 3 159.500 24.424 7.525 1.00 1.00 O ATOM 39 CB ARG A 3 159.458 23.936 10.758 1.00 1.00 C ATOM 40 CG ARG A 3 160.481 23.581 11.842 1.00 1.00 C ATOM 41 CD ARG A 3 159.860 22.617 12.858 1.00 1.00 C ATOM 42 NE ARG A 3 160.856 22.230 13.854 1.00 1.00 N ATOM 43 CZ ARG A 3 161.063 22.957 14.950 1.00 1.00 C ATOM 44 NH1 ARG A 3 160.372 24.044 15.161 1.00 1.00 N ATOM 45 NH2 ARG A 3 161.967 22.581 15.818 1.00 1.00 N ATOM 0 H ARG A 3 159.806 26.283 11.396 1.00 1.00 H new ATOM 0 HA ARG A 3 161.074 24.609 9.508 1.00 1.00 H new ATOM 0 HB2 ARG A 3 158.557 24.349 11.212 1.00 1.00 H new ATOM 0 HB3 ARG A 3 159.159 23.040 10.214 1.00 1.00 H new ATOM 0 HG2 ARG A 3 161.361 23.125 11.387 1.00 1.00 H new ATOM 0 HG3 ARG A 3 160.816 24.487 12.347 1.00 1.00 H new ATOM 0 HD2 ARG A 3 159.009 23.091 13.348 1.00 1.00 H new ATOM 0 HD3 ARG A 3 159.482 21.732 12.347 1.00 1.00 H new ATOM 0 HE ARG A 3 161.405 21.383 13.706 1.00 1.00 H new ATOM 0 HH11 ARG A 3 159.669 24.341 14.484 1.00 1.00 H new ATOM 0 HH12 ARG A 3 160.535 24.597 16.003 1.00 1.00 H new ATOM 0 HH21 ARG A 3 162.510 21.734 15.654 1.00 1.00 H new ATOM 0 HH22 ARG A 3 162.128 23.135 16.659 1.00 1.00 H new ATOM 59 N ARG A 4 158.203 25.924 8.587 1.00 1.00 N ATOM 60 CA ARG A 4 157.323 26.120 7.436 1.00 1.00 C ATOM 61 C ARG A 4 156.836 24.777 6.917 1.00 1.00 C ATOM 62 O ARG A 4 157.494 24.151 6.087 1.00 1.00 O ATOM 63 CB ARG A 4 158.075 26.835 6.312 1.00 1.00 C ATOM 64 CG ARG A 4 158.448 28.246 6.755 1.00 1.00 C ATOM 65 CD ARG A 4 159.265 28.922 5.654 1.00 1.00 C ATOM 66 NE ARG A 4 159.727 30.225 6.108 1.00 1.00 N ATOM 67 CZ ARG A 4 158.951 31.295 6.024 1.00 1.00 C ATOM 68 NH1 ARG A 4 157.759 31.197 5.501 1.00 1.00 N ATOM 69 NH2 ARG A 4 159.378 32.446 6.467 1.00 1.00 N ATOM 0 H ARG A 4 157.960 26.479 9.407 1.00 1.00 H new ATOM 0 HA ARG A 4 156.473 26.725 7.754 1.00 1.00 H new ATOM 0 HB2 ARG A 4 158.974 26.277 6.051 1.00 1.00 H new ATOM 0 HB3 ARG A 4 157.455 26.877 5.417 1.00 1.00 H new ATOM 0 HG2 ARG A 4 157.548 28.824 6.963 1.00 1.00 H new ATOM 0 HG3 ARG A 4 159.023 28.209 7.680 1.00 1.00 H new ATOM 0 HD2 ARG A 4 160.117 28.297 5.386 1.00 1.00 H new ATOM 0 HD3 ARG A 4 158.658 29.035 4.756 1.00 1.00 H new ATOM 0 HE ARG A 4 160.665 30.316 6.498 1.00 1.00 H new ATOM 0 HH11 ARG A 4 157.425 30.297 5.157 1.00 1.00 H new ATOM 0 HH12 ARG A 4 157.161 32.021 5.436 1.00 1.00 H new ATOM 0 HH21 ARG A 4 160.309 32.521 6.878 1.00 1.00 H new ATOM 0 HH22 ARG A 4 158.781 33.271 6.403 1.00 1.00 H new ATOM 83 N ALA A 5 155.684 24.335 7.402 1.00 1.00 N ATOM 84 CA ALA A 5 155.142 23.061 6.961 1.00 1.00 C ATOM 85 C ALA A 5 154.969 23.075 5.449 1.00 1.00 C ATOM 86 O ALA A 5 154.534 24.073 4.873 1.00 1.00 O ATOM 87 CB ALA A 5 153.795 22.796 7.637 1.00 1.00 C ATOM 0 H ALA A 5 155.116 24.831 8.089 1.00 1.00 H new ATOM 0 HA ALA A 5 155.834 22.266 7.238 1.00 1.00 H new ATOM 0 HB1 ALA A 5 153.400 21.838 7.298 1.00 1.00 H new ATOM 0 HB2 ALA A 5 153.929 22.771 8.718 1.00 1.00 H new ATOM 0 HB3 ALA A 5 153.095 23.590 7.377 1.00 1.00 H new ATOM 93 N SER A 6 155.318 21.967 4.809 1.00 1.00 N ATOM 94 CA SER A 6 155.202 21.877 3.363 1.00 1.00 C ATOM 95 C SER A 6 153.736 21.896 2.945 1.00 1.00 C ATOM 96 O SER A 6 152.842 21.707 3.769 1.00 1.00 O ATOM 97 CB SER A 6 155.867 20.596 2.857 1.00 1.00 C ATOM 98 OG SER A 6 155.120 19.469 3.295 1.00 1.00 O ATOM 0 H SER A 6 155.679 21.128 5.263 1.00 1.00 H new ATOM 0 HA SER A 6 155.706 22.738 2.923 1.00 1.00 H new ATOM 0 HB2 SER A 6 155.923 20.608 1.768 1.00 1.00 H new ATOM 0 HB3 SER A 6 156.890 20.534 3.228 1.00 1.00 H new ATOM 0 HG SER A 6 155.545 18.648 2.969 1.00 1.00 H new ATOM 104 N GLY A 7 153.501 22.131 1.661 1.00 1.00 N ATOM 105 CA GLY A 7 152.140 22.179 1.143 1.00 1.00 C ATOM 106 C GLY A 7 151.448 20.838 1.343 1.00 1.00 C ATOM 107 O GLY A 7 150.231 20.773 1.530 1.00 1.00 O ATOM 0 H GLY A 7 154.228 22.290 0.964 1.00 1.00 H new ATOM 0 HA2 GLY A 7 151.579 22.964 1.650 1.00 1.00 H new ATOM 0 HA3 GLY A 7 152.156 22.432 0.083 1.00 1.00 H new ATOM 111 N GLU A 8 152.237 19.770 1.296 1.00 1.00 N ATOM 112 CA GLU A 8 151.713 18.422 1.463 1.00 1.00 C ATOM 113 C GLU A 8 150.872 18.325 2.733 1.00 1.00 C ATOM 114 O GLU A 8 151.264 18.820 3.790 1.00 1.00 O ATOM 115 CB GLU A 8 152.883 17.437 1.541 1.00 1.00 C ATOM 116 CG GLU A 8 152.367 15.999 1.551 1.00 1.00 C ATOM 117 CD GLU A 8 153.549 15.034 1.604 1.00 1.00 C ATOM 118 OE1 GLU A 8 154.649 15.456 1.284 1.00 1.00 O ATOM 119 OE2 GLU A 8 153.336 13.885 1.952 1.00 1.00 O ATOM 0 H GLU A 8 153.245 19.814 1.143 1.00 1.00 H new ATOM 0 HA GLU A 8 151.078 18.179 0.611 1.00 1.00 H new ATOM 0 HB2 GLU A 8 153.549 17.585 0.691 1.00 1.00 H new ATOM 0 HB3 GLU A 8 153.468 17.627 2.441 1.00 1.00 H new ATOM 0 HG2 GLU A 8 151.716 15.841 2.411 1.00 1.00 H new ATOM 0 HG3 GLU A 8 151.769 15.810 0.660 1.00 1.00 H new ATOM 126 N ASN A 9 149.713 17.684 2.622 1.00 1.00 N ATOM 127 CA ASN A 9 148.827 17.527 3.769 1.00 1.00 C ATOM 128 C ASN A 9 149.331 16.413 4.674 1.00 1.00 C ATOM 129 O ASN A 9 149.609 15.304 4.215 1.00 1.00 O ATOM 130 CB ASN A 9 147.408 17.206 3.301 1.00 1.00 C ATOM 131 CG ASN A 9 146.784 18.441 2.661 1.00 1.00 C ATOM 132 OD1 ASN A 9 147.290 19.552 2.828 1.00 1.00 O ATOM 133 ND2 ASN A 9 145.705 18.315 1.940 1.00 1.00 N ATOM 0 H ASN A 9 149.368 17.268 1.757 1.00 1.00 H new ATOM 0 HA ASN A 9 148.815 18.463 4.328 1.00 1.00 H new ATOM 0 HB2 ASN A 9 147.428 16.385 2.585 1.00 1.00 H new ATOM 0 HB3 ASN A 9 146.802 16.877 4.145 1.00 1.00 H new ATOM 0 HD21 ASN A 9 145.278 19.137 1.513 1.00 1.00 H new ATOM 0 HD22 ASN A 9 145.288 17.394 1.803 1.00 1.00 H new ATOM 140 N LEU A 10 149.456 16.724 5.959 1.00 1.00 N ATOM 141 CA LEU A 10 149.941 15.755 6.932 1.00 1.00 C ATOM 142 C LEU A 10 148.946 15.583 8.072 1.00 1.00 C ATOM 143 O LEU A 10 148.378 16.556 8.568 1.00 1.00 O ATOM 144 CB LEU A 10 151.283 16.226 7.491 1.00 1.00 C ATOM 145 CG LEU A 10 152.315 16.315 6.359 1.00 1.00 C ATOM 146 CD1 LEU A 10 153.632 16.861 6.913 1.00 1.00 C ATOM 147 CD2 LEU A 10 152.563 14.924 5.762 1.00 1.00 C ATOM 0 H LEU A 10 149.228 17.638 6.350 1.00 1.00 H new ATOM 0 HA LEU A 10 150.062 14.793 6.433 1.00 1.00 H new ATOM 0 HB2 LEU A 10 151.167 17.200 7.967 1.00 1.00 H new ATOM 0 HB3 LEU A 10 151.630 15.535 8.259 1.00 1.00 H new ATOM 0 HG LEU A 10 151.933 16.978 5.583 1.00 1.00 H new ATOM 0 HD11 LEU A 10 154.366 16.925 6.110 1.00 1.00 H new ATOM 0 HD12 LEU A 10 153.467 17.853 7.333 1.00 1.00 H new ATOM 0 HD13 LEU A 10 154.003 16.195 7.692 1.00 1.00 H new ATOM 0 HD21 LEU A 10 153.297 14.998 4.959 1.00 1.00 H new ATOM 0 HD22 LEU A 10 152.939 14.257 6.538 1.00 1.00 H new ATOM 0 HD23 LEU A 10 151.629 14.527 5.364 1.00 1.00 H new ATOM 159 N GLN A 11 148.738 14.337 8.481 1.00 1.00 N ATOM 160 CA GLN A 11 147.807 14.043 9.560 1.00 1.00 C ATOM 161 C GLN A 11 146.446 14.668 9.266 1.00 1.00 C ATOM 162 O GLN A 11 146.185 15.096 8.143 1.00 1.00 O ATOM 163 CB GLN A 11 148.349 14.583 10.885 1.00 1.00 C ATOM 164 CG GLN A 11 149.599 13.797 11.290 1.00 1.00 C ATOM 165 CD GLN A 11 150.087 14.269 12.654 1.00 1.00 C ATOM 166 OE1 GLN A 11 149.444 15.105 13.287 1.00 1.00 O ATOM 167 NE2 GLN A 11 151.189 13.778 13.150 1.00 1.00 N ATOM 0 H GLN A 11 149.199 13.519 8.083 1.00 1.00 H new ATOM 0 HA GLN A 11 147.692 12.962 9.636 1.00 1.00 H new ATOM 0 HB2 GLN A 11 148.589 15.642 10.786 1.00 1.00 H new ATOM 0 HB3 GLN A 11 147.588 14.500 11.661 1.00 1.00 H new ATOM 0 HG2 GLN A 11 149.374 12.731 11.323 1.00 1.00 H new ATOM 0 HG3 GLN A 11 150.383 13.935 10.546 1.00 1.00 H new ATOM 0 HE21 GLN A 11 151.721 13.085 12.624 1.00 1.00 H new ATOM 0 HE22 GLN A 11 151.519 14.087 14.064 1.00 1.00 H new ATOM 176 N GLN A 12 145.582 14.719 10.275 1.00 1.00 N ATOM 177 CA GLN A 12 144.254 15.298 10.095 1.00 1.00 C ATOM 178 C GLN A 12 144.354 16.817 9.953 1.00 1.00 C ATOM 179 O GLN A 12 144.914 17.494 10.814 1.00 1.00 O ATOM 180 CB GLN A 12 143.367 14.948 11.292 1.00 1.00 C ATOM 181 CG GLN A 12 143.099 13.441 11.317 1.00 1.00 C ATOM 182 CD GLN A 12 142.320 13.078 12.578 1.00 1.00 C ATOM 183 OE1 GLN A 12 142.013 13.953 13.388 1.00 1.00 O ATOM 184 NE2 GLN A 12 141.970 11.839 12.790 1.00 1.00 N ATOM 0 H GLN A 12 145.773 14.371 11.215 1.00 1.00 H new ATOM 0 HA GLN A 12 143.812 14.887 9.187 1.00 1.00 H new ATOM 0 HB2 GLN A 12 143.853 15.255 12.218 1.00 1.00 H new ATOM 0 HB3 GLN A 12 142.425 15.493 11.230 1.00 1.00 H new ATOM 0 HG2 GLN A 12 142.534 13.148 10.432 1.00 1.00 H new ATOM 0 HG3 GLN A 12 144.041 12.894 11.290 1.00 1.00 H new ATOM 0 HE21 GLN A 12 142.225 11.115 12.118 1.00 1.00 H new ATOM 0 HE22 GLN A 12 141.441 11.594 13.627 1.00 1.00 H new ATOM 193 N THR A 13 143.817 17.341 8.855 1.00 1.00 N ATOM 194 CA THR A 13 143.864 18.778 8.597 1.00 1.00 C ATOM 195 C THR A 13 142.540 19.452 8.959 1.00 1.00 C ATOM 196 O THR A 13 142.383 20.659 8.773 1.00 1.00 O ATOM 197 CB THR A 13 144.163 19.014 7.114 1.00 1.00 C ATOM 198 OG1 THR A 13 143.296 18.210 6.328 1.00 1.00 O ATOM 199 CG2 THR A 13 145.614 18.633 6.817 1.00 1.00 C ATOM 0 H THR A 13 143.346 16.796 8.133 1.00 1.00 H new ATOM 0 HA THR A 13 144.649 19.212 9.217 1.00 1.00 H new ATOM 0 HB THR A 13 144.008 20.066 6.874 1.00 1.00 H new ATOM 0 HG1 THR A 13 143.483 18.360 5.378 1.00 1.00 H new ATOM 0 HG21 THR A 13 145.826 18.801 5.761 1.00 1.00 H new ATOM 0 HG22 THR A 13 146.282 19.245 7.423 1.00 1.00 H new ATOM 0 HG23 THR A 13 145.770 17.581 7.055 1.00 1.00 H new ATOM 207 N ARG A 14 141.587 18.668 9.461 1.00 1.00 N ATOM 208 CA ARG A 14 140.276 19.205 9.829 1.00 1.00 C ATOM 209 C ARG A 14 139.846 18.712 11.210 1.00 1.00 C ATOM 210 O ARG A 14 138.917 17.916 11.328 1.00 1.00 O ATOM 211 CB ARG A 14 139.228 18.763 8.805 1.00 1.00 C ATOM 212 CG ARG A 14 139.454 19.484 7.472 1.00 1.00 C ATOM 213 CD ARG A 14 138.671 20.803 7.452 1.00 1.00 C ATOM 214 NE ARG A 14 137.236 20.558 7.573 1.00 1.00 N ATOM 215 CZ ARG A 14 136.346 21.454 7.148 1.00 1.00 C ATOM 216 NH1 ARG A 14 136.749 22.556 6.580 1.00 1.00 N ATOM 217 NH2 ARG A 14 135.069 21.229 7.297 1.00 1.00 N ATOM 0 H ARG A 14 141.695 17.667 9.622 1.00 1.00 H new ATOM 0 HA ARG A 14 140.354 20.292 9.848 1.00 1.00 H new ATOM 0 HB2 ARG A 14 139.285 17.685 8.658 1.00 1.00 H new ATOM 0 HB3 ARG A 14 138.228 18.981 9.180 1.00 1.00 H new ATOM 0 HG2 ARG A 14 140.517 19.680 7.330 1.00 1.00 H new ATOM 0 HG3 ARG A 14 139.134 18.849 6.646 1.00 1.00 H new ATOM 0 HD2 ARG A 14 139.005 21.442 8.270 1.00 1.00 H new ATOM 0 HD3 ARG A 14 138.876 21.338 6.525 1.00 1.00 H new ATOM 0 HE ARG A 14 136.910 19.686 7.990 1.00 1.00 H new ATOM 0 HH11 ARG A 14 137.746 22.733 6.461 1.00 1.00 H new ATOM 0 HH12 ARG A 14 136.067 23.241 6.255 1.00 1.00 H new ATOM 0 HH21 ARG A 14 134.751 20.366 7.739 1.00 1.00 H new ATOM 0 HH22 ARG A 14 134.389 21.916 6.971 1.00 1.00 H new ATOM 231 N PRO A 15 140.494 19.171 12.247 1.00 1.00 N ATOM 232 CA PRO A 15 140.161 18.770 13.644 1.00 1.00 C ATOM 233 C PRO A 15 138.670 18.905 13.950 1.00 1.00 C ATOM 234 O PRO A 15 138.100 18.078 14.661 1.00 1.00 O ATOM 235 CB PRO A 15 140.970 19.739 14.511 1.00 1.00 C ATOM 236 CG PRO A 15 142.093 20.213 13.654 1.00 1.00 C ATOM 237 CD PRO A 15 141.624 20.113 12.199 1.00 1.00 C ATOM 0 HA PRO A 15 140.398 17.722 13.825 1.00 1.00 H new ATOM 0 HB2 PRO A 15 140.353 20.574 14.844 1.00 1.00 H new ATOM 0 HB3 PRO A 15 141.344 19.243 15.406 1.00 1.00 H new ATOM 0 HG2 PRO A 15 142.360 21.240 13.903 1.00 1.00 H new ATOM 0 HG3 PRO A 15 142.983 19.604 13.814 1.00 1.00 H new ATOM 0 HD2 PRO A 15 141.316 21.085 11.812 1.00 1.00 H new ATOM 0 HD3 PRO A 15 142.419 19.748 11.549 1.00 1.00 H new ATOM 245 N ILE A 16 138.047 19.951 13.413 1.00 1.00 N ATOM 246 CA ILE A 16 136.624 20.186 13.639 1.00 1.00 C ATOM 247 C ILE A 16 135.823 19.848 12.391 1.00 1.00 C ATOM 248 O ILE A 16 136.154 20.283 11.289 1.00 1.00 O ATOM 249 CB ILE A 16 136.388 21.649 14.013 1.00 1.00 C ATOM 250 CG1 ILE A 16 137.162 21.975 15.296 1.00 1.00 C ATOM 251 CG2 ILE A 16 134.891 21.875 14.248 1.00 1.00 C ATOM 252 CD1 ILE A 16 137.297 23.493 15.461 1.00 1.00 C ATOM 0 H ILE A 16 138.502 20.646 12.821 1.00 1.00 H new ATOM 0 HA ILE A 16 136.295 19.544 14.456 1.00 1.00 H new ATOM 0 HB ILE A 16 136.732 22.296 13.206 1.00 1.00 H new ATOM 0 HG12 ILE A 16 136.646 21.553 16.158 1.00 1.00 H new ATOM 0 HG13 ILE A 16 138.150 21.516 15.260 1.00 1.00 H new ATOM 0 HG21 ILE A 16 134.718 22.917 14.515 1.00 1.00 H new ATOM 0 HG22 ILE A 16 134.340 21.637 13.338 1.00 1.00 H new ATOM 0 HG23 ILE A 16 134.549 21.231 15.058 1.00 1.00 H new ATOM 0 HD11 ILE A 16 137.848 23.712 16.375 1.00 1.00 H new ATOM 0 HD12 ILE A 16 137.833 23.906 14.606 1.00 1.00 H new ATOM 0 HD13 ILE A 16 136.306 23.942 15.519 1.00 1.00 H new ATOM 264 N ALA A 17 134.767 19.062 12.572 1.00 1.00 N ATOM 265 CA ALA A 17 133.925 18.663 11.454 1.00 1.00 C ATOM 266 C ALA A 17 134.668 17.677 10.560 1.00 1.00 C ATOM 267 O ALA A 17 135.820 17.907 10.193 1.00 1.00 O ATOM 268 CB ALA A 17 133.523 19.891 10.633 1.00 1.00 C ATOM 0 H ALA A 17 134.476 18.691 13.477 1.00 1.00 H new ATOM 0 HA ALA A 17 133.029 18.184 11.849 1.00 1.00 H new ATOM 0 HB1 ALA A 17 132.893 19.581 9.799 1.00 1.00 H new ATOM 0 HB2 ALA A 17 132.971 20.587 11.265 1.00 1.00 H new ATOM 0 HB3 ALA A 17 134.418 20.381 10.249 1.00 1.00 H new ATOM 274 N ALA A 18 134.004 16.583 10.209 1.00 1.00 N ATOM 275 CA ALA A 18 134.618 15.577 9.353 1.00 1.00 C ATOM 276 C ALA A 18 134.746 16.107 7.929 1.00 1.00 C ATOM 277 O ALA A 18 133.913 16.887 7.470 1.00 1.00 O ATOM 278 CB ALA A 18 133.781 14.296 9.355 1.00 1.00 C ATOM 0 H ALA A 18 133.050 16.371 10.500 1.00 1.00 H new ATOM 0 HA ALA A 18 135.611 15.351 9.740 1.00 1.00 H new ATOM 0 HB1 ALA A 18 134.252 13.553 8.711 1.00 1.00 H new ATOM 0 HB2 ALA A 18 133.715 13.906 10.371 1.00 1.00 H new ATOM 0 HB3 ALA A 18 132.780 14.515 8.984 1.00 1.00 H new ATOM 284 N ALA A 19 135.797 15.684 7.241 1.00 1.00 N ATOM 285 CA ALA A 19 136.038 16.131 5.873 1.00 1.00 C ATOM 286 C ALA A 19 135.060 15.483 4.897 1.00 1.00 C ATOM 287 O ALA A 19 134.311 14.572 5.257 1.00 1.00 O ATOM 288 CB ALA A 19 137.466 15.782 5.458 1.00 1.00 C ATOM 0 H ALA A 19 136.495 15.035 7.604 1.00 1.00 H new ATOM 0 HA ALA A 19 135.893 17.211 5.843 1.00 1.00 H new ATOM 0 HB1 ALA A 19 137.640 16.118 4.436 1.00 1.00 H new ATOM 0 HB2 ALA A 19 138.170 16.276 6.127 1.00 1.00 H new ATOM 0 HB3 ALA A 19 137.608 14.703 5.514 1.00 1.00 H new ATOM 294 N ASN A 20 135.084 15.960 3.653 1.00 1.00 N ATOM 295 CA ASN A 20 134.212 15.425 2.610 1.00 1.00 C ATOM 296 C ASN A 20 132.748 15.580 2.990 1.00 1.00 C ATOM 297 O ASN A 20 132.422 16.116 4.051 1.00 1.00 O ATOM 298 CB ASN A 20 134.508 13.945 2.400 1.00 1.00 C ATOM 299 CG ASN A 20 134.296 13.570 0.940 1.00 1.00 C ATOM 300 OD1 ASN A 20 133.165 13.581 0.453 1.00 1.00 O ATOM 301 ND2 ASN A 20 135.323 13.238 0.209 1.00 1.00 N ATOM 0 H ASN A 20 135.697 16.715 3.344 1.00 1.00 H new ATOM 0 HA ASN A 20 134.403 15.983 1.693 1.00 1.00 H new ATOM 0 HB2 ASN A 20 135.535 13.726 2.694 1.00 1.00 H new ATOM 0 HB3 ASN A 20 133.859 13.343 3.036 1.00 1.00 H new ATOM 0 HD21 ASN A 20 135.192 12.986 -0.771 1.00 1.00 H new ATOM 0 HD22 ASN A 20 136.258 13.230 0.617 1.00 1.00 H new ATOM 308 N LEU A 21 131.867 15.093 2.120 1.00 1.00 N ATOM 309 CA LEU A 21 130.435 15.162 2.360 1.00 1.00 C ATOM 310 C LEU A 21 130.052 14.158 3.438 1.00 1.00 C ATOM 311 O LEU A 21 130.583 13.050 3.501 1.00 1.00 O ATOM 312 CB LEU A 21 129.657 14.876 1.069 1.00 1.00 C ATOM 313 CG LEU A 21 128.204 15.335 1.234 1.00 1.00 C ATOM 314 CD1 LEU A 21 128.082 16.819 0.872 1.00 1.00 C ATOM 315 CD2 LEU A 21 127.297 14.522 0.309 1.00 1.00 C ATOM 0 H LEU A 21 132.125 14.645 1.240 1.00 1.00 H new ATOM 0 HA LEU A 21 130.180 16.167 2.696 1.00 1.00 H new ATOM 0 HB2 LEU A 21 130.120 15.395 0.230 1.00 1.00 H new ATOM 0 HB3 LEU A 21 129.689 13.811 0.841 1.00 1.00 H new ATOM 0 HG LEU A 21 127.903 15.185 2.271 1.00 1.00 H new ATOM 0 HD11 LEU A 21 127.047 17.139 0.991 1.00 1.00 H new ATOM 0 HD12 LEU A 21 128.722 17.408 1.529 1.00 1.00 H new ATOM 0 HD13 LEU A 21 128.391 16.968 -0.163 1.00 1.00 H new ATOM 0 HD21 LEU A 21 126.265 14.852 0.430 1.00 1.00 H new ATOM 0 HD22 LEU A 21 127.606 14.669 -0.726 1.00 1.00 H new ATOM 0 HD23 LEU A 21 127.372 13.465 0.563 1.00 1.00 H new ATOM 327 N GLN A 22 129.121 14.578 4.279 1.00 1.00 N ATOM 328 CA GLN A 22 128.643 13.737 5.364 1.00 1.00 C ATOM 329 C GLN A 22 127.282 13.151 4.995 1.00 1.00 C ATOM 330 O GLN A 22 126.278 13.861 4.976 1.00 1.00 O ATOM 331 CB GLN A 22 128.526 14.578 6.634 1.00 1.00 C ATOM 332 CG GLN A 22 129.918 15.069 7.032 1.00 1.00 C ATOM 333 CD GLN A 22 129.834 15.957 8.270 1.00 1.00 C ATOM 334 OE1 GLN A 22 129.248 17.039 8.220 1.00 1.00 O ATOM 335 NE2 GLN A 22 130.389 15.563 9.386 1.00 1.00 N ATOM 0 H GLN A 22 128.681 15.497 4.231 1.00 1.00 H new ATOM 0 HA GLN A 22 129.344 12.920 5.536 1.00 1.00 H new ATOM 0 HB2 GLN A 22 127.861 15.425 6.465 1.00 1.00 H new ATOM 0 HB3 GLN A 22 128.090 13.986 7.439 1.00 1.00 H new ATOM 0 HG2 GLN A 22 130.568 14.217 7.231 1.00 1.00 H new ATOM 0 HG3 GLN A 22 130.364 15.625 6.207 1.00 1.00 H new ATOM 0 HE21 GLN A 22 130.874 14.667 9.426 1.00 1.00 H new ATOM 0 HE22 GLN A 22 130.337 16.152 10.217 1.00 1.00 H new ATOM 344 N TRP A 23 127.252 11.851 4.706 1.00 1.00 N ATOM 345 CA TRP A 23 125.996 11.197 4.350 1.00 1.00 C ATOM 346 C TRP A 23 125.193 10.900 5.613 1.00 1.00 C ATOM 347 O TRP A 23 125.736 10.477 6.634 1.00 1.00 O ATOM 348 CB TRP A 23 126.266 9.888 3.604 1.00 1.00 C ATOM 349 CG TRP A 23 127.320 10.092 2.560 1.00 1.00 C ATOM 350 CD1 TRP A 23 127.182 10.859 1.450 1.00 1.00 C ATOM 351 CD2 TRP A 23 128.666 9.536 2.504 1.00 1.00 C ATOM 352 NE1 TRP A 23 128.355 10.797 0.717 1.00 1.00 N ATOM 353 CE2 TRP A 23 129.297 9.999 1.325 1.00 1.00 C ATOM 354 CE3 TRP A 23 129.394 8.681 3.350 1.00 1.00 C ATOM 355 CZ2 TRP A 23 130.598 9.631 0.997 1.00 1.00 C ATOM 356 CZ3 TRP A 23 130.709 8.308 3.023 1.00 1.00 C ATOM 357 CH2 TRP A 23 131.309 8.782 1.849 1.00 1.00 C ATOM 0 H TRP A 23 128.068 11.239 4.711 1.00 1.00 H new ATOM 0 HA TRP A 23 125.429 11.865 3.701 1.00 1.00 H new ATOM 0 HB2 TRP A 23 126.586 9.120 4.308 1.00 1.00 H new ATOM 0 HB3 TRP A 23 125.348 9.531 3.138 1.00 1.00 H new ATOM 0 HD1 TRP A 23 126.302 11.425 1.182 1.00 1.00 H new ATOM 0 HE1 TRP A 23 128.503 11.284 -0.167 1.00 1.00 H new ATOM 0 HE3 TRP A 23 128.940 8.309 4.256 1.00 1.00 H new ATOM 0 HZ2 TRP A 23 131.055 9.999 0.090 1.00 1.00 H new ATOM 0 HZ3 TRP A 23 131.260 7.652 3.681 1.00 1.00 H new ATOM 0 HH2 TRP A 23 132.320 8.492 1.603 1.00 1.00 H new ATOM 368 N GLU A 24 123.882 11.103 5.506 1.00 1.00 N ATOM 369 CA GLU A 24 122.960 10.840 6.605 1.00 1.00 C ATOM 370 C GLU A 24 121.927 9.811 6.155 1.00 1.00 C ATOM 371 O GLU A 24 121.802 9.527 4.963 1.00 1.00 O ATOM 372 CB GLU A 24 122.239 12.127 7.002 1.00 1.00 C ATOM 373 CG GLU A 24 123.241 13.114 7.597 1.00 1.00 C ATOM 374 CD GLU A 24 122.546 14.429 7.928 1.00 1.00 C ATOM 375 OE1 GLU A 24 121.362 14.533 7.659 1.00 1.00 O ATOM 376 OE2 GLU A 24 123.209 15.315 8.443 1.00 1.00 O ATOM 0 H GLU A 24 123.432 11.452 4.660 1.00 1.00 H new ATOM 0 HA GLU A 24 123.520 10.462 7.460 1.00 1.00 H new ATOM 0 HB2 GLU A 24 121.753 12.567 6.131 1.00 1.00 H new ATOM 0 HB3 GLU A 24 121.455 11.908 7.727 1.00 1.00 H new ATOM 0 HG2 GLU A 24 123.687 12.693 8.498 1.00 1.00 H new ATOM 0 HG3 GLU A 24 124.053 13.290 6.891 1.00 1.00 H new ATOM 383 N SER A 25 121.181 9.257 7.106 1.00 1.00 N ATOM 384 CA SER A 25 120.165 8.284 6.768 1.00 1.00 C ATOM 385 C SER A 25 118.895 9.021 6.396 1.00 1.00 C ATOM 386 O SER A 25 118.722 10.189 6.741 1.00 1.00 O ATOM 387 CB SER A 25 119.884 7.355 7.947 1.00 1.00 C ATOM 388 OG SER A 25 118.842 7.910 8.734 1.00 1.00 O ATOM 0 H SER A 25 121.264 9.465 8.101 1.00 1.00 H new ATOM 0 HA SER A 25 120.517 7.679 5.933 1.00 1.00 H new ATOM 0 HB2 SER A 25 119.599 6.366 7.588 1.00 1.00 H new ATOM 0 HB3 SER A 25 120.784 7.228 8.549 1.00 1.00 H new ATOM 0 HG SER A 25 118.335 7.188 9.161 1.00 1.00 H new ATOM 394 N TYR A 26 118.005 8.337 5.716 1.00 1.00 N ATOM 395 CA TYR A 26 116.753 8.934 5.326 1.00 1.00 C ATOM 396 C TYR A 26 115.971 9.345 6.559 1.00 1.00 C ATOM 397 O TYR A 26 115.416 10.442 6.636 1.00 1.00 O ATOM 398 CB TYR A 26 115.966 7.920 4.510 1.00 1.00 C ATOM 399 CG TYR A 26 114.562 8.405 4.297 1.00 1.00 C ATOM 400 CD1 TYR A 26 114.269 9.279 3.246 1.00 1.00 C ATOM 401 CD2 TYR A 26 113.549 7.963 5.148 1.00 1.00 C ATOM 402 CE1 TYR A 26 112.953 9.706 3.043 1.00 1.00 C ATOM 403 CE2 TYR A 26 112.234 8.393 4.950 1.00 1.00 C ATOM 404 CZ TYR A 26 111.935 9.262 3.895 1.00 1.00 C ATOM 405 OH TYR A 26 110.637 9.680 3.694 1.00 1.00 O ATOM 0 H TYR A 26 118.126 7.368 5.422 1.00 1.00 H new ATOM 0 HA TYR A 26 116.933 9.825 4.724 1.00 1.00 H new ATOM 0 HB2 TYR A 26 116.453 7.759 3.548 1.00 1.00 H new ATOM 0 HB3 TYR A 26 115.953 6.959 5.025 1.00 1.00 H new ATOM 0 HD1 TYR A 26 115.057 9.623 2.593 1.00 1.00 H new ATOM 0 HD2 TYR A 26 113.781 7.289 5.959 1.00 1.00 H new ATOM 0 HE1 TYR A 26 112.722 10.378 2.229 1.00 1.00 H new ATOM 0 HE2 TYR A 26 111.449 8.055 5.611 1.00 1.00 H new ATOM 0 HH TYR A 26 110.055 9.278 4.373 1.00 1.00 H new ATOM 415 N ALA A 27 115.954 8.441 7.526 1.00 1.00 N ATOM 416 CA ALA A 27 115.254 8.691 8.768 1.00 1.00 C ATOM 417 C ALA A 27 115.951 9.780 9.549 1.00 1.00 C ATOM 418 O ALA A 27 115.305 10.612 10.187 1.00 1.00 O ATOM 419 CB ALA A 27 115.159 7.410 9.601 1.00 1.00 C ATOM 0 H ALA A 27 116.416 7.533 7.472 1.00 1.00 H new ATOM 0 HA ALA A 27 114.242 9.022 8.535 1.00 1.00 H new ATOM 0 HB1 ALA A 27 114.629 7.619 10.531 1.00 1.00 H new ATOM 0 HB2 ALA A 27 114.618 6.649 9.038 1.00 1.00 H new ATOM 0 HB3 ALA A 27 116.162 7.048 9.828 1.00 1.00 H new ATOM 425 N GLU A 28 117.265 9.781 9.493 1.00 1.00 N ATOM 426 CA GLU A 28 118.038 10.776 10.199 1.00 1.00 C ATOM 427 C GLU A 28 117.876 12.153 9.566 1.00 1.00 C ATOM 428 O GLU A 28 117.805 13.159 10.270 1.00 1.00 O ATOM 429 CB GLU A 28 119.507 10.368 10.203 1.00 1.00 C ATOM 430 CG GLU A 28 119.712 9.199 11.172 1.00 1.00 C ATOM 431 CD GLU A 28 119.532 9.667 12.612 1.00 1.00 C ATOM 432 OE1 GLU A 28 119.663 10.857 12.850 1.00 1.00 O ATOM 433 OE2 GLU A 28 119.263 8.828 13.455 1.00 1.00 O ATOM 0 H GLU A 28 117.818 9.105 8.967 1.00 1.00 H new ATOM 0 HA GLU A 28 117.672 10.836 11.224 1.00 1.00 H new ATOM 0 HB2 GLU A 28 119.818 10.080 9.199 1.00 1.00 H new ATOM 0 HB3 GLU A 28 120.129 11.213 10.499 1.00 1.00 H new ATOM 0 HG2 GLU A 28 119.000 8.404 10.949 1.00 1.00 H new ATOM 0 HG3 GLU A 28 120.710 8.780 11.041 1.00 1.00 H new ATOM 440 N ALA A 29 117.826 12.203 8.237 1.00 1.00 N ATOM 441 CA ALA A 29 117.681 13.471 7.531 1.00 1.00 C ATOM 442 C ALA A 29 116.411 14.194 7.914 1.00 1.00 C ATOM 443 O ALA A 29 116.417 15.401 8.155 1.00 1.00 O ATOM 444 CB ALA A 29 117.601 13.215 6.036 1.00 1.00 C ATOM 0 H ALA A 29 117.883 11.384 7.631 1.00 1.00 H new ATOM 0 HA ALA A 29 118.545 14.079 7.799 1.00 1.00 H new ATOM 0 HB1 ALA A 29 117.493 14.163 5.510 1.00 1.00 H new ATOM 0 HB2 ALA A 29 118.512 12.717 5.703 1.00 1.00 H new ATOM 0 HB3 ALA A 29 116.741 12.580 5.821 1.00 1.00 H new ATOM 450 N LEU A 30 115.317 13.465 7.935 1.00 1.00 N ATOM 451 CA LEU A 30 114.052 14.072 8.255 1.00 1.00 C ATOM 452 C LEU A 30 114.056 14.568 9.681 1.00 1.00 C ATOM 453 O LEU A 30 113.551 15.641 9.972 1.00 1.00 O ATOM 454 CB LEU A 30 112.920 13.076 8.042 1.00 1.00 C ATOM 455 CG LEU A 30 112.794 12.764 6.556 1.00 1.00 C ATOM 456 CD1 LEU A 30 112.199 11.375 6.410 1.00 1.00 C ATOM 457 CD2 LEU A 30 111.860 13.780 5.880 1.00 1.00 C ATOM 0 H LEU A 30 115.280 12.465 7.737 1.00 1.00 H new ATOM 0 HA LEU A 30 113.895 14.923 7.592 1.00 1.00 H new ATOM 0 HB2 LEU A 30 113.115 12.161 8.602 1.00 1.00 H new ATOM 0 HB3 LEU A 30 111.984 13.487 8.419 1.00 1.00 H new ATOM 0 HG LEU A 30 113.776 12.817 6.086 1.00 1.00 H new ATOM 0 HD11 LEU A 30 112.100 11.131 5.352 1.00 1.00 H new ATOM 0 HD12 LEU A 30 112.852 10.647 6.891 1.00 1.00 H new ATOM 0 HD13 LEU A 30 111.217 11.348 6.882 1.00 1.00 H new ATOM 0 HD21 LEU A 30 111.777 13.548 4.818 1.00 1.00 H new ATOM 0 HD22 LEU A 30 110.873 13.730 6.341 1.00 1.00 H new ATOM 0 HD23 LEU A 30 112.266 14.784 6.001 1.00 1.00 H new ATOM 469 N GLU A 31 114.643 13.788 10.575 1.00 1.00 N ATOM 470 CA GLU A 31 114.694 14.163 11.959 1.00 1.00 C ATOM 471 C GLU A 31 115.376 15.483 12.114 1.00 1.00 C ATOM 472 O GLU A 31 114.924 16.356 12.843 1.00 1.00 O ATOM 473 CB GLU A 31 115.470 13.125 12.762 1.00 1.00 C ATOM 474 CG GLU A 31 114.485 12.263 13.520 1.00 1.00 C ATOM 475 CD GLU A 31 115.210 11.124 14.228 1.00 1.00 C ATOM 476 OE1 GLU A 31 116.427 11.087 14.157 1.00 1.00 O ATOM 477 OE2 GLU A 31 114.537 10.299 14.822 1.00 1.00 O ATOM 0 H GLU A 31 115.087 12.896 10.357 1.00 1.00 H new ATOM 0 HA GLU A 31 113.670 14.227 12.327 1.00 1.00 H new ATOM 0 HB2 GLU A 31 116.077 12.510 12.098 1.00 1.00 H new ATOM 0 HB3 GLU A 31 116.153 13.617 13.455 1.00 1.00 H new ATOM 0 HG2 GLU A 31 113.948 12.869 14.249 1.00 1.00 H new ATOM 0 HG3 GLU A 31 113.742 11.858 12.833 1.00 1.00 H new ATOM 484 N HIS A 32 116.481 15.613 11.425 1.00 1.00 N ATOM 485 CA HIS A 32 117.227 16.829 11.508 1.00 1.00 C ATOM 486 C HIS A 32 116.455 17.987 10.867 1.00 1.00 C ATOM 487 O HIS A 32 116.424 19.093 11.406 1.00 1.00 O ATOM 488 CB HIS A 32 118.587 16.655 10.829 1.00 1.00 C ATOM 489 CG HIS A 32 119.593 16.165 11.837 1.00 1.00 C ATOM 490 ND1 HIS A 32 119.981 16.930 12.925 1.00 1.00 N ATOM 491 CD2 HIS A 32 120.294 14.989 11.937 1.00 1.00 C ATOM 492 CE1 HIS A 32 120.876 16.213 13.628 1.00 1.00 C ATOM 493 NE2 HIS A 32 121.102 15.021 13.069 1.00 1.00 N ATOM 0 H HIS A 32 116.874 14.900 10.811 1.00 1.00 H new ATOM 0 HA HIS A 32 117.384 17.068 12.560 1.00 1.00 H new ATOM 0 HB2 HIS A 32 118.506 15.945 10.006 1.00 1.00 H new ATOM 0 HB3 HIS A 32 118.916 17.602 10.402 1.00 1.00 H new ATOM 0 HD2 HIS A 32 120.228 14.164 11.243 1.00 1.00 H new ATOM 0 HE1 HIS A 32 121.353 16.559 14.533 1.00 1.00 H new ATOM 0 HE2 HIS A 32 121.732 14.291 13.401 1.00 1.00 H new ATOM 501 N SER A 33 115.854 17.735 9.701 1.00 1.00 N ATOM 502 CA SER A 33 115.109 18.765 8.982 1.00 1.00 C ATOM 503 C SER A 33 113.870 19.212 9.734 1.00 1.00 C ATOM 504 O SER A 33 113.502 20.383 9.684 1.00 1.00 O ATOM 505 CB SER A 33 114.735 18.261 7.596 1.00 1.00 C ATOM 506 OG SER A 33 115.938 17.966 6.922 1.00 1.00 O ATOM 0 H SER A 33 115.870 16.827 9.237 1.00 1.00 H new ATOM 0 HA SER A 33 115.758 19.636 8.891 1.00 1.00 H new ATOM 0 HB2 SER A 33 114.105 17.374 7.666 1.00 1.00 H new ATOM 0 HB3 SER A 33 114.165 19.015 7.053 1.00 1.00 H new ATOM 0 HG SER A 33 116.124 18.667 6.263 1.00 1.00 H new ATOM 512 N LYS A 34 113.241 18.295 10.458 1.00 1.00 N ATOM 513 CA LYS A 34 112.074 18.651 11.230 1.00 1.00 C ATOM 514 C LYS A 34 112.473 19.743 12.203 1.00 1.00 C ATOM 515 O LYS A 34 111.656 20.571 12.608 1.00 1.00 O ATOM 516 CB LYS A 34 111.565 17.444 12.016 1.00 1.00 C ATOM 517 CG LYS A 34 110.891 16.434 11.074 1.00 1.00 C ATOM 518 CD LYS A 34 110.725 15.087 11.794 1.00 1.00 C ATOM 519 CE LYS A 34 110.803 13.941 10.786 1.00 1.00 C ATOM 520 NZ LYS A 34 110.054 12.766 11.321 1.00 1.00 N ATOM 0 H LYS A 34 113.519 17.316 10.522 1.00 1.00 H new ATOM 0 HA LYS A 34 111.282 18.991 10.563 1.00 1.00 H new ATOM 0 HB2 LYS A 34 112.394 16.966 12.538 1.00 1.00 H new ATOM 0 HB3 LYS A 34 110.856 17.771 12.776 1.00 1.00 H new ATOM 0 HG2 LYS A 34 109.918 16.810 10.757 1.00 1.00 H new ATOM 0 HG3 LYS A 34 111.492 16.305 10.174 1.00 1.00 H new ATOM 0 HD2 LYS A 34 111.502 14.971 12.549 1.00 1.00 H new ATOM 0 HD3 LYS A 34 109.768 15.059 12.315 1.00 1.00 H new ATOM 0 HE2 LYS A 34 110.381 14.252 9.830 1.00 1.00 H new ATOM 0 HE3 LYS A 34 111.843 13.672 10.603 1.00 1.00 H new ATOM 0 HZ1 LYS A 34 110.104 11.983 10.639 1.00 1.00 H new ATOM 0 HZ2 LYS A 34 110.476 12.467 12.223 1.00 1.00 H new ATOM 0 HZ3 LYS A 34 109.060 13.029 11.474 1.00 1.00 H new ATOM 534 N GLN A 35 113.740 19.691 12.620 1.00 1.00 N ATOM 535 CA GLN A 35 114.243 20.646 13.614 1.00 1.00 C ATOM 536 C GLN A 35 114.981 21.810 12.987 1.00 1.00 C ATOM 537 O GLN A 35 114.856 22.947 13.436 1.00 1.00 O ATOM 538 CB GLN A 35 115.210 19.946 14.564 1.00 1.00 C ATOM 539 CG GLN A 35 114.558 18.678 15.080 1.00 1.00 C ATOM 540 CD GLN A 35 115.500 17.946 16.029 1.00 1.00 C ATOM 541 OE1 GLN A 35 116.501 18.509 16.471 1.00 1.00 O ATOM 542 NE2 GLN A 35 115.241 16.712 16.364 1.00 1.00 N ATOM 0 H GLN A 35 114.427 19.012 12.293 1.00 1.00 H new ATOM 0 HA GLN A 35 113.369 21.029 14.141 1.00 1.00 H new ATOM 0 HB2 GLN A 35 116.140 19.709 14.048 1.00 1.00 H new ATOM 0 HB3 GLN A 35 115.465 20.604 15.395 1.00 1.00 H new ATOM 0 HG2 GLN A 35 113.629 18.923 15.596 1.00 1.00 H new ATOM 0 HG3 GLN A 35 114.297 18.029 14.244 1.00 1.00 H new ATOM 0 HE21 GLN A 35 114.411 16.247 15.996 1.00 1.00 H new ATOM 0 HE22 GLN A 35 115.869 16.212 16.993 1.00 1.00 H new ATOM 551 N ASP A 36 115.785 21.519 11.987 1.00 1.00 N ATOM 552 CA ASP A 36 116.586 22.558 11.347 1.00 1.00 C ATOM 553 C ASP A 36 115.904 23.177 10.132 1.00 1.00 C ATOM 554 O ASP A 36 116.281 24.267 9.702 1.00 1.00 O ATOM 555 CB ASP A 36 117.933 21.976 10.913 1.00 1.00 C ATOM 556 CG ASP A 36 118.808 21.693 12.133 1.00 1.00 C ATOM 557 OD1 ASP A 36 118.498 22.206 13.193 1.00 1.00 O ATOM 558 OD2 ASP A 36 119.776 20.965 11.984 1.00 1.00 O ATOM 0 H ASP A 36 115.906 20.584 11.598 1.00 1.00 H new ATOM 0 HA ASP A 36 116.719 23.348 12.086 1.00 1.00 H new ATOM 0 HB2 ASP A 36 117.775 21.056 10.350 1.00 1.00 H new ATOM 0 HB3 ASP A 36 118.441 22.674 10.247 1.00 1.00 H new ATOM 563 N HIS A 37 114.889 22.509 9.598 1.00 1.00 N ATOM 564 CA HIS A 37 114.144 23.030 8.456 1.00 1.00 C ATOM 565 C HIS A 37 114.963 22.993 7.171 1.00 1.00 C ATOM 566 O HIS A 37 114.587 23.610 6.176 1.00 1.00 O ATOM 567 CB HIS A 37 113.698 24.468 8.741 1.00 1.00 C ATOM 568 CG HIS A 37 113.379 24.603 10.205 1.00 1.00 C ATOM 569 ND1 HIS A 37 114.209 25.280 11.085 1.00 1.00 N ATOM 570 CD2 HIS A 37 112.336 24.133 10.962 1.00 1.00 C ATOM 571 CE1 HIS A 37 113.658 25.197 12.310 1.00 1.00 C ATOM 572 NE2 HIS A 37 112.515 24.506 12.291 1.00 1.00 N ATOM 0 H HIS A 37 114.562 21.604 9.937 1.00 1.00 H new ATOM 0 HA HIS A 37 113.274 22.389 8.312 1.00 1.00 H new ATOM 0 HB2 HIS A 37 114.485 25.168 8.461 1.00 1.00 H new ATOM 0 HB3 HIS A 37 112.823 24.716 8.141 1.00 1.00 H new ATOM 0 HD1 HIS A 37 115.080 25.755 10.847 1.00 1.00 H new ATOM 0 HD2 HIS A 37 111.502 23.560 10.584 1.00 1.00 H new ATOM 0 HE1 HIS A 37 114.087 25.635 13.199 1.00 1.00 H new ATOM 580 N LYS A 38 116.089 22.281 7.189 1.00 1.00 N ATOM 581 CA LYS A 38 116.928 22.211 5.999 1.00 1.00 C ATOM 582 C LYS A 38 116.385 21.166 5.011 1.00 1.00 C ATOM 583 O LYS A 38 115.880 20.123 5.430 1.00 1.00 O ATOM 584 CB LYS A 38 118.364 21.854 6.384 1.00 1.00 C ATOM 585 CG LYS A 38 119.040 23.066 7.028 1.00 1.00 C ATOM 586 CD LYS A 38 119.892 23.790 5.982 1.00 1.00 C ATOM 587 CE LYS A 38 120.562 25.013 6.617 1.00 1.00 C ATOM 588 NZ LYS A 38 121.935 24.647 7.061 1.00 1.00 N ATOM 0 H LYS A 38 116.433 21.757 7.994 1.00 1.00 H new ATOM 0 HA LYS A 38 116.916 23.189 5.518 1.00 1.00 H new ATOM 0 HB2 LYS A 38 118.367 21.013 7.077 1.00 1.00 H new ATOM 0 HB3 LYS A 38 118.921 21.541 5.501 1.00 1.00 H new ATOM 0 HG2 LYS A 38 118.288 23.743 7.432 1.00 1.00 H new ATOM 0 HG3 LYS A 38 119.664 22.747 7.863 1.00 1.00 H new ATOM 0 HD2 LYS A 38 120.649 23.114 5.585 1.00 1.00 H new ATOM 0 HD3 LYS A 38 119.269 24.100 5.143 1.00 1.00 H new ATOM 0 HE2 LYS A 38 120.606 25.832 5.899 1.00 1.00 H new ATOM 0 HE3 LYS A 38 119.975 25.364 7.465 1.00 1.00 H new ATOM 0 HZ1 LYS A 38 122.067 24.933 8.052 1.00 1.00 H new ATOM 0 HZ2 LYS A 38 122.064 23.618 6.977 1.00 1.00 H new ATOM 0 HZ3 LYS A 38 122.634 25.133 6.464 1.00 1.00 H new ATOM 602 N PRO A 39 116.478 21.413 3.718 1.00 1.00 N ATOM 603 CA PRO A 39 115.982 20.462 2.677 1.00 1.00 C ATOM 604 C PRO A 39 116.865 19.221 2.544 1.00 1.00 C ATOM 605 O PRO A 39 118.049 19.256 2.884 1.00 1.00 O ATOM 606 CB PRO A 39 115.991 21.290 1.397 1.00 1.00 C ATOM 607 CG PRO A 39 117.062 22.295 1.606 1.00 1.00 C ATOM 608 CD PRO A 39 117.064 22.614 3.099 1.00 1.00 C ATOM 0 HA PRO A 39 114.997 20.066 2.925 1.00 1.00 H new ATOM 0 HB2 PRO A 39 116.196 20.669 0.525 1.00 1.00 H new ATOM 0 HB3 PRO A 39 115.026 21.769 1.228 1.00 1.00 H new ATOM 0 HG2 PRO A 39 118.029 21.904 1.291 1.00 1.00 H new ATOM 0 HG3 PRO A 39 116.874 23.192 1.017 1.00 1.00 H new ATOM 0 HD2 PRO A 39 118.073 22.801 3.466 1.00 1.00 H new ATOM 0 HD3 PRO A 39 116.475 23.504 3.318 1.00 1.00 H new ATOM 616 N ILE A 40 116.275 18.128 2.065 1.00 1.00 N ATOM 617 CA ILE A 40 117.009 16.876 1.910 1.00 1.00 C ATOM 618 C ILE A 40 117.211 16.533 0.438 1.00 1.00 C ATOM 619 O ILE A 40 116.267 16.579 -0.347 1.00 1.00 O ATOM 620 CB ILE A 40 116.238 15.709 2.519 1.00 1.00 C ATOM 621 CG1 ILE A 40 115.371 16.174 3.697 1.00 1.00 C ATOM 622 CG2 ILE A 40 117.251 14.679 3.010 1.00 1.00 C ATOM 623 CD1 ILE A 40 114.527 14.996 4.204 1.00 1.00 C ATOM 0 H ILE A 40 115.297 18.084 1.779 1.00 1.00 H new ATOM 0 HA ILE A 40 117.966 17.020 2.412 1.00 1.00 H new ATOM 0 HB ILE A 40 115.578 15.280 1.765 1.00 1.00 H new ATOM 0 HG12 ILE A 40 116.002 16.555 4.499 1.00 1.00 H new ATOM 0 HG13 ILE A 40 114.723 16.993 3.385 1.00 1.00 H new ATOM 0 HG21 ILE A 40 116.725 13.832 3.451 1.00 1.00 H new ATOM 0 HG22 ILE A 40 117.855 14.334 2.171 1.00 1.00 H new ATOM 0 HG23 ILE A 40 117.898 15.134 3.760 1.00 1.00 H new ATOM 0 HD11 ILE A 40 113.910 15.324 5.041 1.00 1.00 H new ATOM 0 HD12 ILE A 40 113.886 14.635 3.400 1.00 1.00 H new ATOM 0 HD13 ILE A 40 115.185 14.191 4.532 1.00 1.00 H new ATOM 635 N GLY A 41 118.431 16.137 0.084 1.00 1.00 N ATOM 636 CA GLY A 41 118.726 15.729 -1.281 1.00 1.00 C ATOM 637 C GLY A 41 118.903 14.212 -1.321 1.00 1.00 C ATOM 638 O GLY A 41 119.845 13.679 -0.730 1.00 1.00 O ATOM 0 H GLY A 41 119.226 16.091 0.722 1.00 1.00 H new ATOM 0 HA2 GLY A 41 117.918 16.031 -1.947 1.00 1.00 H new ATOM 0 HA3 GLY A 41 119.631 16.223 -1.634 1.00 1.00 H new ATOM 642 N LEU A 42 118.020 13.522 -2.047 1.00 1.00 N ATOM 643 CA LEU A 42 118.134 12.077 -2.177 1.00 1.00 C ATOM 644 C LEU A 42 118.854 11.763 -3.469 1.00 1.00 C ATOM 645 O LEU A 42 118.411 12.156 -4.550 1.00 1.00 O ATOM 646 CB LEU A 42 116.777 11.369 -2.277 1.00 1.00 C ATOM 647 CG LEU A 42 115.849 11.675 -1.103 1.00 1.00 C ATOM 648 CD1 LEU A 42 115.618 13.166 -0.958 1.00 1.00 C ATOM 649 CD2 LEU A 42 114.498 11.016 -1.372 1.00 1.00 C ATOM 0 H LEU A 42 117.232 13.937 -2.545 1.00 1.00 H new ATOM 0 HA LEU A 42 118.657 11.730 -1.286 1.00 1.00 H new ATOM 0 HB2 LEU A 42 116.288 11.665 -3.205 1.00 1.00 H new ATOM 0 HB3 LEU A 42 116.940 10.293 -2.332 1.00 1.00 H new ATOM 0 HG LEU A 42 116.311 11.297 -0.191 1.00 1.00 H new ATOM 0 HD11 LEU A 42 114.954 13.351 -0.114 1.00 1.00 H new ATOM 0 HD12 LEU A 42 116.571 13.667 -0.786 1.00 1.00 H new ATOM 0 HD13 LEU A 42 115.163 13.554 -1.869 1.00 1.00 H new ATOM 0 HD21 LEU A 42 113.821 11.223 -0.544 1.00 1.00 H new ATOM 0 HD22 LEU A 42 114.076 11.415 -2.294 1.00 1.00 H new ATOM 0 HD23 LEU A 42 114.632 9.939 -1.470 1.00 1.00 H new ATOM 661 N PHE A 43 119.959 11.058 -3.353 1.00 1.00 N ATOM 662 CA PHE A 43 120.729 10.692 -4.525 1.00 1.00 C ATOM 663 C PHE A 43 120.275 9.317 -5.004 1.00 1.00 C ATOM 664 O PHE A 43 120.632 8.303 -4.408 1.00 1.00 O ATOM 665 CB PHE A 43 122.218 10.679 -4.148 1.00 1.00 C ATOM 666 CG PHE A 43 123.114 10.694 -5.371 1.00 1.00 C ATOM 667 CD1 PHE A 43 123.046 11.753 -6.288 1.00 1.00 C ATOM 668 CD2 PHE A 43 124.042 9.662 -5.568 1.00 1.00 C ATOM 669 CE1 PHE A 43 123.894 11.773 -7.400 1.00 1.00 C ATOM 670 CE2 PHE A 43 124.891 9.687 -6.678 1.00 1.00 C ATOM 671 CZ PHE A 43 124.816 10.741 -7.595 1.00 1.00 C ATOM 0 H PHE A 43 120.343 10.729 -2.467 1.00 1.00 H new ATOM 0 HA PHE A 43 120.576 11.409 -5.332 1.00 1.00 H new ATOM 0 HB2 PHE A 43 122.442 11.544 -3.524 1.00 1.00 H new ATOM 0 HB3 PHE A 43 122.433 9.792 -3.552 1.00 1.00 H new ATOM 0 HD1 PHE A 43 122.338 12.554 -6.135 1.00 1.00 H new ATOM 0 HD2 PHE A 43 124.101 8.847 -4.862 1.00 1.00 H new ATOM 0 HE1 PHE A 43 123.836 12.586 -8.108 1.00 1.00 H new ATOM 0 HE2 PHE A 43 125.606 8.892 -6.828 1.00 1.00 H new ATOM 0 HZ PHE A 43 125.471 10.757 -8.454 1.00 1.00 H new ATOM 681 N PHE A 44 119.506 9.276 -6.093 1.00 1.00 N ATOM 682 CA PHE A 44 119.034 8.014 -6.659 1.00 1.00 C ATOM 683 C PHE A 44 120.010 7.607 -7.753 1.00 1.00 C ATOM 684 O PHE A 44 120.222 8.373 -8.690 1.00 1.00 O ATOM 685 CB PHE A 44 117.629 8.184 -7.252 1.00 1.00 C ATOM 686 CG PHE A 44 116.584 8.223 -6.156 1.00 1.00 C ATOM 687 CD1 PHE A 44 116.066 7.026 -5.642 1.00 1.00 C ATOM 688 CD2 PHE A 44 116.112 9.449 -5.671 1.00 1.00 C ATOM 689 CE1 PHE A 44 115.090 7.055 -4.645 1.00 1.00 C ATOM 690 CE2 PHE A 44 115.129 9.475 -4.672 1.00 1.00 C ATOM 691 CZ PHE A 44 114.621 8.280 -4.159 1.00 1.00 C ATOM 0 H PHE A 44 119.197 10.105 -6.601 1.00 1.00 H new ATOM 0 HA PHE A 44 118.981 7.250 -5.883 1.00 1.00 H new ATOM 0 HB2 PHE A 44 117.585 9.103 -7.836 1.00 1.00 H new ATOM 0 HB3 PHE A 44 117.416 7.362 -7.935 1.00 1.00 H new ATOM 0 HD1 PHE A 44 116.423 6.079 -6.019 1.00 1.00 H new ATOM 0 HD2 PHE A 44 116.505 10.374 -6.066 1.00 1.00 H new ATOM 0 HE1 PHE A 44 114.696 6.131 -4.248 1.00 1.00 H new ATOM 0 HE2 PHE A 44 114.764 10.421 -4.299 1.00 1.00 H new ATOM 0 HZ PHE A 44 113.866 8.301 -3.387 1.00 1.00 H new ATOM 701 N THR A 45 120.622 6.421 -7.633 1.00 1.00 N ATOM 702 CA THR A 45 121.597 6.007 -8.650 1.00 1.00 C ATOM 703 C THR A 45 121.819 4.491 -8.759 1.00 1.00 C ATOM 704 O THR A 45 121.202 3.696 -8.052 1.00 1.00 O ATOM 705 CB THR A 45 122.943 6.675 -8.349 1.00 1.00 C ATOM 706 OG1 THR A 45 123.267 6.467 -6.982 1.00 1.00 O ATOM 707 CG2 THR A 45 122.866 8.179 -8.626 1.00 1.00 C ATOM 0 H THR A 45 120.469 5.756 -6.875 1.00 1.00 H new ATOM 0 HA THR A 45 121.178 6.321 -9.606 1.00 1.00 H new ATOM 0 HB THR A 45 123.709 6.238 -8.989 1.00 1.00 H new ATOM 0 HG1 THR A 45 123.471 7.327 -6.560 1.00 1.00 H new ATOM 0 HG21 THR A 45 123.830 8.639 -8.407 1.00 1.00 H new ATOM 0 HG22 THR A 45 122.615 8.344 -9.674 1.00 1.00 H new ATOM 0 HG23 THR A 45 122.099 8.627 -7.994 1.00 1.00 H new ATOM 715 N GLY A 46 122.791 4.136 -9.607 1.00 1.00 N ATOM 716 CA GLY A 46 123.240 2.759 -9.806 1.00 1.00 C ATOM 717 C GLY A 46 124.764 2.781 -9.724 1.00 1.00 C ATOM 718 O GLY A 46 125.452 3.024 -10.716 1.00 1.00 O ATOM 0 H GLY A 46 123.294 4.811 -10.183 1.00 1.00 H new ATOM 0 HA2 GLY A 46 122.821 2.101 -9.045 1.00 1.00 H new ATOM 0 HA3 GLY A 46 122.909 2.380 -10.773 1.00 1.00 H new ATOM 722 N SER A 47 125.270 2.612 -8.508 1.00 1.00 N ATOM 723 CA SER A 47 126.701 2.698 -8.228 1.00 1.00 C ATOM 724 C SER A 47 127.604 1.814 -9.083 1.00 1.00 C ATOM 725 O SER A 47 128.733 2.212 -9.370 1.00 1.00 O ATOM 726 CB SER A 47 126.944 2.347 -6.759 1.00 1.00 C ATOM 727 OG SER A 47 126.456 3.396 -5.932 1.00 1.00 O ATOM 0 H SER A 47 124.700 2.411 -7.686 1.00 1.00 H new ATOM 0 HA SER A 47 126.972 3.725 -8.474 1.00 1.00 H new ATOM 0 HB2 SER A 47 126.443 1.411 -6.510 1.00 1.00 H new ATOM 0 HB3 SER A 47 128.009 2.196 -6.582 1.00 1.00 H new ATOM 0 HG SER A 47 125.981 3.014 -5.164 1.00 1.00 H new ATOM 733 N ASP A 48 127.173 0.601 -9.429 1.00 1.00 N ATOM 734 CA ASP A 48 128.045 -0.305 -10.177 1.00 1.00 C ATOM 735 C ASP A 48 127.728 -0.427 -11.668 1.00 1.00 C ATOM 736 O ASP A 48 128.455 -1.137 -12.365 1.00 1.00 O ATOM 737 CB ASP A 48 127.976 -1.691 -9.541 1.00 1.00 C ATOM 738 CG ASP A 48 128.611 -1.660 -8.156 1.00 1.00 C ATOM 739 OD1 ASP A 48 129.352 -0.731 -7.885 1.00 1.00 O ATOM 740 OD2 ASP A 48 128.346 -2.570 -7.387 1.00 1.00 O ATOM 0 H ASP A 48 126.249 0.229 -9.210 1.00 1.00 H new ATOM 0 HA ASP A 48 129.043 0.129 -10.122 1.00 1.00 H new ATOM 0 HB2 ASP A 48 126.938 -2.015 -9.467 1.00 1.00 H new ATOM 0 HB3 ASP A 48 128.492 -2.416 -10.171 1.00 1.00 H new ATOM 745 N TRP A 49 126.666 0.212 -12.180 1.00 1.00 N ATOM 746 CA TRP A 49 126.377 0.051 -13.614 1.00 1.00 C ATOM 747 C TRP A 49 126.002 1.335 -14.345 1.00 1.00 C ATOM 748 O TRP A 49 126.038 1.364 -15.573 1.00 1.00 O ATOM 749 CB TRP A 49 125.289 -0.995 -13.833 1.00 1.00 C ATOM 750 CG TRP A 49 124.060 -0.650 -13.065 1.00 1.00 C ATOM 751 CD1 TRP A 49 123.977 -0.589 -11.718 1.00 1.00 C ATOM 752 CD2 TRP A 49 122.734 -0.346 -13.575 1.00 1.00 C ATOM 753 NE1 TRP A 49 122.682 -0.264 -11.368 1.00 1.00 N ATOM 754 CE2 TRP A 49 121.875 -0.106 -12.479 1.00 1.00 C ATOM 755 CE3 TRP A 49 122.198 -0.255 -14.871 1.00 1.00 C ATOM 756 CZ2 TRP A 49 120.528 0.208 -12.663 1.00 1.00 C ATOM 757 CZ3 TRP A 49 120.844 0.063 -15.061 1.00 1.00 C ATOM 758 CH2 TRP A 49 120.011 0.293 -13.958 1.00 1.00 C ATOM 0 H TRP A 49 126.026 0.812 -11.660 1.00 1.00 H new ATOM 0 HA TRP A 49 127.321 -0.278 -14.049 1.00 1.00 H new ATOM 0 HB2 TRP A 49 125.052 -1.063 -14.895 1.00 1.00 H new ATOM 0 HB3 TRP A 49 125.653 -1.975 -13.524 1.00 1.00 H new ATOM 0 HD1 TRP A 49 124.790 -0.765 -11.029 1.00 1.00 H new ATOM 0 HE1 TRP A 49 122.360 -0.154 -10.407 1.00 1.00 H new ATOM 0 HE3 TRP A 49 122.833 -0.431 -15.727 1.00 1.00 H new ATOM 0 HZ2 TRP A 49 119.889 0.384 -11.810 1.00 1.00 H new ATOM 0 HZ3 TRP A 49 120.443 0.131 -16.061 1.00 1.00 H new ATOM 0 HH2 TRP A 49 118.970 0.536 -14.109 1.00 1.00 H new ATOM 769 N CYS A 50 125.650 2.394 -13.632 1.00 1.00 N ATOM 770 CA CYS A 50 125.291 3.642 -14.289 1.00 1.00 C ATOM 771 C CYS A 50 126.507 4.560 -14.384 1.00 1.00 C ATOM 772 O CYS A 50 127.050 4.983 -13.369 1.00 1.00 O ATOM 773 CB CYS A 50 124.180 4.331 -13.506 1.00 1.00 C ATOM 774 SG CYS A 50 123.942 6.002 -14.144 1.00 1.00 S ATOM 0 H CYS A 50 125.605 2.416 -12.613 1.00 1.00 H new ATOM 0 HA CYS A 50 124.940 3.423 -15.298 1.00 1.00 H new ATOM 0 HB2 CYS A 50 123.254 3.762 -13.591 1.00 1.00 H new ATOM 0 HB3 CYS A 50 124.435 4.367 -12.447 1.00 1.00 H new ATOM 779 N MET A 51 126.937 4.851 -15.607 1.00 1.00 N ATOM 780 CA MET A 51 128.102 5.704 -15.807 1.00 1.00 C ATOM 781 C MET A 51 127.768 7.177 -15.611 1.00 1.00 C ATOM 782 O MET A 51 128.552 7.916 -15.024 1.00 1.00 O ATOM 783 CB MET A 51 128.688 5.493 -17.202 1.00 1.00 C ATOM 784 CG MET A 51 129.956 6.340 -17.351 1.00 1.00 C ATOM 785 SD MET A 51 130.763 5.953 -18.924 1.00 1.00 S ATOM 786 CE MET A 51 129.455 6.565 -20.015 1.00 1.00 C ATOM 0 H MET A 51 126.502 4.513 -16.466 1.00 1.00 H new ATOM 0 HA MET A 51 128.839 5.421 -15.056 1.00 1.00 H new ATOM 0 HB2 MET A 51 128.920 4.439 -17.356 1.00 1.00 H new ATOM 0 HB3 MET A 51 127.958 5.773 -17.962 1.00 1.00 H new ATOM 0 HG2 MET A 51 129.704 7.400 -17.311 1.00 1.00 H new ATOM 0 HG3 MET A 51 130.637 6.142 -16.523 1.00 1.00 H new ATOM 0 HE1 MET A 51 129.871 6.772 -21.001 1.00 1.00 H new ATOM 0 HE2 MET A 51 128.672 5.812 -20.102 1.00 1.00 H new ATOM 0 HE3 MET A 51 129.033 7.480 -19.600 1.00 1.00 H new ATOM 796 N TRP A 52 126.609 7.611 -16.094 1.00 1.00 N ATOM 797 CA TRP A 52 126.217 9.005 -15.950 1.00 1.00 C ATOM 798 C TRP A 52 126.112 9.345 -14.478 1.00 1.00 C ATOM 799 O TRP A 52 126.357 10.479 -14.065 1.00 1.00 O ATOM 800 CB TRP A 52 124.871 9.261 -16.636 1.00 1.00 C ATOM 801 CG TRP A 52 124.886 8.692 -18.022 1.00 1.00 C ATOM 802 CD1 TRP A 52 125.994 8.305 -18.703 1.00 1.00 C ATOM 803 CD2 TRP A 52 123.755 8.442 -18.909 1.00 1.00 C ATOM 804 NE1 TRP A 52 125.610 7.827 -19.944 1.00 1.00 N ATOM 805 CE2 TRP A 52 124.243 7.893 -20.119 1.00 1.00 C ATOM 806 CE3 TRP A 52 122.366 8.633 -18.780 1.00 1.00 C ATOM 807 CZ2 TRP A 52 123.385 7.548 -21.163 1.00 1.00 C ATOM 808 CZ3 TRP A 52 121.500 8.287 -19.832 1.00 1.00 C ATOM 809 CH2 TRP A 52 122.009 7.745 -21.021 1.00 1.00 C ATOM 0 H TRP A 52 125.933 7.024 -16.583 1.00 1.00 H new ATOM 0 HA TRP A 52 126.971 9.634 -16.423 1.00 1.00 H new ATOM 0 HB2 TRP A 52 124.066 8.808 -16.057 1.00 1.00 H new ATOM 0 HB3 TRP A 52 124.672 10.332 -16.676 1.00 1.00 H new ATOM 0 HD1 TRP A 52 127.009 8.361 -18.337 1.00 1.00 H new ATOM 0 HE1 TRP A 52 126.259 7.469 -20.645 1.00 1.00 H new ATOM 0 HE3 TRP A 52 121.964 9.048 -17.868 1.00 1.00 H new ATOM 0 HZ2 TRP A 52 123.782 7.131 -22.077 1.00 1.00 H new ATOM 0 HZ3 TRP A 52 120.436 8.440 -19.724 1.00 1.00 H new ATOM 0 HH2 TRP A 52 121.339 7.480 -21.825 1.00 1.00 H new ATOM 820 N CYS A 53 125.756 8.348 -13.692 1.00 1.00 N ATOM 821 CA CYS A 53 125.631 8.538 -12.263 1.00 1.00 C ATOM 822 C CYS A 53 127.002 8.747 -11.655 1.00 1.00 C ATOM 823 O CYS A 53 127.187 9.611 -10.797 1.00 1.00 O ATOM 824 CB CYS A 53 124.941 7.335 -11.639 1.00 1.00 C ATOM 825 SG CYS A 53 123.386 7.039 -12.508 1.00 1.00 S ATOM 0 H CYS A 53 125.550 7.404 -14.018 1.00 1.00 H new ATOM 0 HA CYS A 53 125.025 9.422 -12.065 1.00 1.00 H new ATOM 0 HB2 CYS A 53 125.583 6.456 -11.704 1.00 1.00 H new ATOM 0 HB3 CYS A 53 124.753 7.515 -10.580 1.00 1.00 H new ATOM 830 N ILE A 54 127.970 7.982 -12.131 1.00 1.00 N ATOM 831 CA ILE A 54 129.321 8.127 -11.649 1.00 1.00 C ATOM 832 C ILE A 54 129.778 9.536 -11.966 1.00 1.00 C ATOM 833 O ILE A 54 130.398 10.195 -11.135 1.00 1.00 O ATOM 834 CB ILE A 54 130.243 7.127 -12.342 1.00 1.00 C ATOM 835 CG1 ILE A 54 129.892 5.701 -11.905 1.00 1.00 C ATOM 836 CG2 ILE A 54 131.690 7.430 -11.968 1.00 1.00 C ATOM 837 CD1 ILE A 54 130.618 4.693 -12.804 1.00 1.00 C ATOM 0 H ILE A 54 127.842 7.263 -12.843 1.00 1.00 H new ATOM 0 HA ILE A 54 129.355 7.939 -10.576 1.00 1.00 H new ATOM 0 HB ILE A 54 130.116 7.211 -13.421 1.00 1.00 H new ATOM 0 HG12 ILE A 54 130.179 5.548 -10.865 1.00 1.00 H new ATOM 0 HG13 ILE A 54 128.815 5.547 -11.965 1.00 1.00 H new ATOM 0 HG21 ILE A 54 132.350 6.717 -12.462 1.00 1.00 H new ATOM 0 HG22 ILE A 54 131.944 8.441 -12.287 1.00 1.00 H new ATOM 0 HG23 ILE A 54 131.811 7.349 -10.888 1.00 1.00 H new ATOM 0 HD11 ILE A 54 130.367 3.680 -12.491 1.00 1.00 H new ATOM 0 HD12 ILE A 54 130.309 4.840 -13.839 1.00 1.00 H new ATOM 0 HD13 ILE A 54 131.695 4.842 -12.722 1.00 1.00 H new ATOM 849 N LYS A 55 129.488 9.998 -13.185 1.00 1.00 N ATOM 850 CA LYS A 55 129.904 11.328 -13.592 1.00 1.00 C ATOM 851 C LYS A 55 129.256 12.395 -12.727 1.00 1.00 C ATOM 852 O LYS A 55 129.936 13.315 -12.276 1.00 1.00 O ATOM 853 CB LYS A 55 129.561 11.578 -15.063 1.00 1.00 C ATOM 854 CG LYS A 55 130.253 10.544 -15.963 1.00 1.00 C ATOM 855 CD LYS A 55 131.760 10.807 -16.057 1.00 1.00 C ATOM 856 CE LYS A 55 132.378 9.783 -17.003 1.00 1.00 C ATOM 857 NZ LYS A 55 133.826 10.080 -17.173 1.00 1.00 N ATOM 0 H LYS A 55 128.974 9.474 -13.893 1.00 1.00 H new ATOM 0 HA LYS A 55 130.985 11.386 -13.464 1.00 1.00 H new ATOM 0 HB2 LYS A 55 128.481 11.526 -15.204 1.00 1.00 H new ATOM 0 HB3 LYS A 55 129.872 12.583 -15.349 1.00 1.00 H new ATOM 0 HG2 LYS A 55 130.080 9.542 -15.569 1.00 1.00 H new ATOM 0 HG3 LYS A 55 129.814 10.574 -16.960 1.00 1.00 H new ATOM 0 HD2 LYS A 55 131.945 11.818 -16.421 1.00 1.00 H new ATOM 0 HD3 LYS A 55 132.218 10.735 -15.071 1.00 1.00 H new ATOM 0 HE2 LYS A 55 132.246 8.777 -16.605 1.00 1.00 H new ATOM 0 HE3 LYS A 55 131.873 9.812 -17.969 1.00 1.00 H new ATOM 0 HZ1 LYS A 55 134.250 9.383 -17.818 1.00 1.00 H new ATOM 0 HZ2 LYS A 55 133.940 11.034 -17.571 1.00 1.00 H new ATOM 0 HZ3 LYS A 55 134.301 10.031 -16.249 1.00 1.00 H new ATOM 871 N MET A 56 127.950 12.284 -12.468 1.00 1.00 N ATOM 872 CA MET A 56 127.294 13.269 -11.638 1.00 1.00 C ATOM 873 C MET A 56 127.910 13.235 -10.260 1.00 1.00 C ATOM 874 O MET A 56 128.213 14.268 -9.665 1.00 1.00 O ATOM 875 CB MET A 56 125.790 13.010 -11.545 1.00 1.00 C ATOM 876 CG MET A 56 125.178 14.002 -10.554 1.00 1.00 C ATOM 877 SD MET A 56 123.375 13.936 -10.652 1.00 1.00 S ATOM 878 CE MET A 56 123.057 15.151 -9.351 1.00 1.00 C ATOM 0 H MET A 56 127.348 11.538 -12.816 1.00 1.00 H new ATOM 0 HA MET A 56 127.431 14.252 -12.088 1.00 1.00 H new ATOM 0 HB2 MET A 56 125.327 13.122 -12.525 1.00 1.00 H new ATOM 0 HB3 MET A 56 125.603 11.987 -11.219 1.00 1.00 H new ATOM 0 HG2 MET A 56 125.505 13.766 -9.541 1.00 1.00 H new ATOM 0 HG3 MET A 56 125.526 15.011 -10.774 1.00 1.00 H new ATOM 0 HE1 MET A 56 122.494 14.682 -8.545 1.00 1.00 H new ATOM 0 HE2 MET A 56 124.004 15.524 -8.962 1.00 1.00 H new ATOM 0 HE3 MET A 56 122.481 15.981 -9.761 1.00 1.00 H new ATOM 888 N GLN A 57 128.095 12.017 -9.764 1.00 1.00 N ATOM 889 CA GLN A 57 128.672 11.809 -8.456 1.00 1.00 C ATOM 890 C GLN A 57 130.131 12.251 -8.427 1.00 1.00 C ATOM 891 O GLN A 57 130.540 12.964 -7.513 1.00 1.00 O ATOM 892 CB GLN A 57 128.560 10.325 -8.084 1.00 1.00 C ATOM 893 CG GLN A 57 129.614 9.984 -7.040 1.00 1.00 C ATOM 894 CD GLN A 57 129.252 8.685 -6.324 1.00 1.00 C ATOM 895 OE1 GLN A 57 128.086 8.292 -6.301 1.00 1.00 O ATOM 896 NE2 GLN A 57 130.189 7.991 -5.734 1.00 1.00 N ATOM 0 H GLN A 57 127.850 11.159 -10.257 1.00 1.00 H new ATOM 0 HA GLN A 57 128.126 12.411 -7.730 1.00 1.00 H new ATOM 0 HB2 GLN A 57 127.565 10.110 -7.695 1.00 1.00 H new ATOM 0 HB3 GLN A 57 128.696 9.705 -8.970 1.00 1.00 H new ATOM 0 HG2 GLN A 57 130.589 9.884 -7.517 1.00 1.00 H new ATOM 0 HG3 GLN A 57 129.695 10.795 -6.317 1.00 1.00 H new ATOM 0 HE21 GLN A 57 131.155 8.318 -5.754 1.00 1.00 H new ATOM 0 HE22 GLN A 57 129.954 7.122 -5.254 1.00 1.00 H new ATOM 905 N ASP A 58 130.919 11.828 -9.398 1.00 1.00 N ATOM 906 CA ASP A 58 132.329 12.192 -9.404 1.00 1.00 C ATOM 907 C ASP A 58 132.550 13.671 -9.730 1.00 1.00 C ATOM 908 O ASP A 58 133.495 14.278 -9.225 1.00 1.00 O ATOM 909 CB ASP A 58 133.084 11.310 -10.404 1.00 1.00 C ATOM 910 CG ASP A 58 134.584 11.395 -10.148 1.00 1.00 C ATOM 911 OD1 ASP A 58 135.001 12.340 -9.500 1.00 1.00 O ATOM 912 OD2 ASP A 58 135.291 10.510 -10.600 1.00 1.00 O ATOM 0 H ASP A 58 130.618 11.244 -10.179 1.00 1.00 H new ATOM 0 HA ASP A 58 132.716 12.028 -8.398 1.00 1.00 H new ATOM 0 HB2 ASP A 58 132.750 10.276 -10.314 1.00 1.00 H new ATOM 0 HB3 ASP A 58 132.862 11.629 -11.422 1.00 1.00 H new ATOM 917 N GLN A 59 131.734 14.242 -10.606 1.00 1.00 N ATOM 918 CA GLN A 59 131.945 15.636 -10.997 1.00 1.00 C ATOM 919 C GLN A 59 131.183 16.666 -10.146 1.00 1.00 C ATOM 920 O GLN A 59 131.606 17.819 -10.093 1.00 1.00 O ATOM 921 CB GLN A 59 131.553 15.816 -12.466 1.00 1.00 C ATOM 922 CG GLN A 59 132.410 14.903 -13.348 1.00 1.00 C ATOM 923 CD GLN A 59 133.874 15.329 -13.290 1.00 1.00 C ATOM 924 OE1 GLN A 59 134.186 16.506 -13.458 1.00 1.00 O ATOM 925 NE2 GLN A 59 134.796 14.432 -13.066 1.00 1.00 N ATOM 0 H GLN A 59 130.940 13.781 -11.051 1.00 1.00 H new ATOM 0 HA GLN A 59 133.005 15.832 -10.833 1.00 1.00 H new ATOM 0 HB2 GLN A 59 130.497 15.581 -12.601 1.00 1.00 H new ATOM 0 HB3 GLN A 59 131.689 16.856 -12.763 1.00 1.00 H new ATOM 0 HG2 GLN A 59 132.312 13.869 -13.016 1.00 1.00 H new ATOM 0 HG3 GLN A 59 132.054 14.942 -14.377 1.00 1.00 H new ATOM 0 HE21 GLN A 59 134.535 13.456 -12.927 1.00 1.00 H new ATOM 0 HE22 GLN A 59 135.777 14.707 -13.030 1.00 1.00 H new ATOM 934 N ILE A 60 130.049 16.299 -9.534 1.00 1.00 N ATOM 935 CA ILE A 60 129.281 17.293 -8.760 1.00 1.00 C ATOM 936 C ILE A 60 129.217 16.976 -7.267 1.00 1.00 C ATOM 937 O ILE A 60 129.548 17.834 -6.453 1.00 1.00 O ATOM 938 CB ILE A 60 127.851 17.391 -9.309 1.00 1.00 C ATOM 939 CG1 ILE A 60 127.894 17.873 -10.762 1.00 1.00 C ATOM 940 CG2 ILE A 60 127.050 18.401 -8.476 1.00 1.00 C ATOM 941 CD1 ILE A 60 126.544 17.607 -11.434 1.00 1.00 C ATOM 0 H ILE A 60 129.652 15.360 -9.554 1.00 1.00 H new ATOM 0 HA ILE A 60 129.807 18.241 -8.870 1.00 1.00 H new ATOM 0 HB ILE A 60 127.379 16.410 -9.257 1.00 1.00 H new ATOM 0 HG12 ILE A 60 128.124 18.938 -10.795 1.00 1.00 H new ATOM 0 HG13 ILE A 60 128.688 17.358 -11.303 1.00 1.00 H new ATOM 0 HG21 ILE A 60 126.035 18.470 -8.866 1.00 1.00 H new ATOM 0 HG22 ILE A 60 127.018 18.072 -7.437 1.00 1.00 H new ATOM 0 HG23 ILE A 60 127.528 19.379 -8.532 1.00 1.00 H new ATOM 0 HD11 ILE A 60 126.578 17.951 -12.468 1.00 1.00 H new ATOM 0 HD12 ILE A 60 126.332 16.538 -11.414 1.00 1.00 H new ATOM 0 HD13 ILE A 60 125.760 18.142 -10.899 1.00 1.00 H new ATOM 953 N LEU A 61 128.775 15.790 -6.886 1.00 1.00 N ATOM 954 CA LEU A 61 128.663 15.468 -5.466 1.00 1.00 C ATOM 955 C LEU A 61 130.028 15.527 -4.775 1.00 1.00 C ATOM 956 O LEU A 61 130.135 15.988 -3.638 1.00 1.00 O ATOM 957 CB LEU A 61 128.062 14.071 -5.248 1.00 1.00 C ATOM 958 CG LEU A 61 126.559 14.026 -5.618 1.00 1.00 C ATOM 959 CD1 LEU A 61 125.709 14.716 -4.551 1.00 1.00 C ATOM 960 CD2 LEU A 61 126.299 14.724 -6.942 1.00 1.00 C ATOM 0 H LEU A 61 128.492 15.045 -7.522 1.00 1.00 H new ATOM 0 HA LEU A 61 128.000 16.215 -5.030 1.00 1.00 H new ATOM 0 HB2 LEU A 61 128.606 13.343 -5.850 1.00 1.00 H new ATOM 0 HB3 LEU A 61 128.188 13.780 -4.205 1.00 1.00 H new ATOM 0 HG LEU A 61 126.286 12.973 -5.691 1.00 1.00 H new ATOM 0 HD11 LEU A 61 124.658 14.669 -4.837 1.00 1.00 H new ATOM 0 HD12 LEU A 61 125.848 14.213 -3.594 1.00 1.00 H new ATOM 0 HD13 LEU A 61 126.014 15.758 -4.460 1.00 1.00 H new ATOM 0 HD21 LEU A 61 125.235 14.676 -7.176 1.00 1.00 H new ATOM 0 HD22 LEU A 61 126.609 15.767 -6.871 1.00 1.00 H new ATOM 0 HD23 LEU A 61 126.866 14.230 -7.731 1.00 1.00 H new ATOM 972 N GLN A 62 131.070 15.036 -5.453 1.00 1.00 N ATOM 973 CA GLN A 62 132.420 15.009 -4.894 1.00 1.00 C ATOM 974 C GLN A 62 133.199 16.301 -5.178 1.00 1.00 C ATOM 975 O GLN A 62 134.356 16.428 -4.779 1.00 1.00 O ATOM 976 CB GLN A 62 133.191 13.821 -5.477 1.00 1.00 C ATOM 977 CG GLN A 62 132.546 12.506 -5.025 1.00 1.00 C ATOM 978 CD GLN A 62 132.697 12.325 -3.517 1.00 1.00 C ATOM 979 OE1 GLN A 62 133.812 12.343 -2.996 1.00 1.00 O ATOM 980 NE2 GLN A 62 131.633 12.155 -2.779 1.00 1.00 N ATOM 0 H GLN A 62 131.001 14.650 -6.395 1.00 1.00 H new ATOM 0 HA GLN A 62 132.321 14.913 -3.813 1.00 1.00 H new ATOM 0 HB2 GLN A 62 133.195 13.878 -6.565 1.00 1.00 H new ATOM 0 HB3 GLN A 62 134.231 13.857 -5.152 1.00 1.00 H new ATOM 0 HG2 GLN A 62 131.490 12.502 -5.293 1.00 1.00 H new ATOM 0 HG3 GLN A 62 133.011 11.669 -5.546 1.00 1.00 H new ATOM 0 HE21 GLN A 62 130.709 12.140 -3.212 1.00 1.00 H new ATOM 0 HE22 GLN A 62 131.726 12.037 -1.770 1.00 1.00 H new ATOM 989 N SER A 63 132.574 17.261 -5.857 1.00 1.00 N ATOM 990 CA SER A 63 133.244 18.527 -6.161 1.00 1.00 C ATOM 991 C SER A 63 133.253 19.439 -4.935 1.00 1.00 C ATOM 992 O SER A 63 132.386 19.335 -4.072 1.00 1.00 O ATOM 993 CB SER A 63 132.555 19.234 -7.328 1.00 1.00 C ATOM 994 OG SER A 63 133.063 18.716 -8.552 1.00 1.00 O ATOM 0 H SER A 63 131.617 17.190 -6.204 1.00 1.00 H new ATOM 0 HA SER A 63 134.273 18.305 -6.442 1.00 1.00 H new ATOM 0 HB2 SER A 63 131.477 19.084 -7.275 1.00 1.00 H new ATOM 0 HB3 SER A 63 132.730 20.308 -7.273 1.00 1.00 H new ATOM 0 HG SER A 63 132.331 18.625 -9.197 1.00 1.00 H new ATOM 1000 N SER A 64 134.269 20.291 -4.840 1.00 1.00 N ATOM 1001 CA SER A 64 134.425 21.166 -3.677 1.00 1.00 C ATOM 1002 C SER A 64 133.238 22.106 -3.440 1.00 1.00 C ATOM 1003 O SER A 64 132.821 22.286 -2.295 1.00 1.00 O ATOM 1004 CB SER A 64 135.696 21.996 -3.835 1.00 1.00 C ATOM 1005 OG SER A 64 136.793 21.131 -4.088 1.00 1.00 O ATOM 0 H SER A 64 134.995 20.396 -5.549 1.00 1.00 H new ATOM 0 HA SER A 64 134.482 20.512 -2.807 1.00 1.00 H new ATOM 0 HB2 SER A 64 135.581 22.706 -4.654 1.00 1.00 H new ATOM 0 HB3 SER A 64 135.878 22.579 -2.932 1.00 1.00 H new ATOM 0 HG SER A 64 137.611 21.661 -4.192 1.00 1.00 H new ATOM 1011 N GLU A 65 132.715 22.734 -4.491 1.00 1.00 N ATOM 1012 CA GLU A 65 131.612 23.676 -4.316 1.00 1.00 C ATOM 1013 C GLU A 65 130.365 22.990 -3.782 1.00 1.00 C ATOM 1014 O GLU A 65 129.683 23.525 -2.908 1.00 1.00 O ATOM 1015 CB GLU A 65 131.279 24.338 -5.656 1.00 1.00 C ATOM 1016 CG GLU A 65 132.460 25.190 -6.132 1.00 1.00 C ATOM 1017 CD GLU A 65 132.702 26.352 -5.174 1.00 1.00 C ATOM 1018 OE1 GLU A 65 131.795 26.676 -4.424 1.00 1.00 O ATOM 1019 OE2 GLU A 65 133.792 26.898 -5.205 1.00 1.00 O ATOM 0 H GLU A 65 133.029 22.612 -5.454 1.00 1.00 H new ATOM 0 HA GLU A 65 131.931 24.424 -3.590 1.00 1.00 H new ATOM 0 HB2 GLU A 65 131.048 23.575 -6.400 1.00 1.00 H new ATOM 0 HB3 GLU A 65 130.390 24.961 -5.552 1.00 1.00 H new ATOM 0 HG2 GLU A 65 133.357 24.574 -6.199 1.00 1.00 H new ATOM 0 HG3 GLU A 65 132.260 25.572 -7.133 1.00 1.00 H new ATOM 1026 N PHE A 66 130.078 21.803 -4.291 1.00 1.00 N ATOM 1027 CA PHE A 66 128.920 21.051 -3.840 1.00 1.00 C ATOM 1028 C PHE A 66 129.061 20.676 -2.365 1.00 1.00 C ATOM 1029 O PHE A 66 128.104 20.765 -1.597 1.00 1.00 O ATOM 1030 CB PHE A 66 128.759 19.785 -4.687 1.00 1.00 C ATOM 1031 CG PHE A 66 127.467 19.091 -4.329 1.00 1.00 C ATOM 1032 CD1 PHE A 66 127.423 18.228 -3.228 1.00 1.00 C ATOM 1033 CD2 PHE A 66 126.312 19.307 -5.094 1.00 1.00 C ATOM 1034 CE1 PHE A 66 126.229 17.582 -2.888 1.00 1.00 C ATOM 1035 CE2 PHE A 66 125.115 18.659 -4.753 1.00 1.00 C ATOM 1036 CZ PHE A 66 125.074 17.797 -3.650 1.00 1.00 C ATOM 0 H PHE A 66 130.629 21.341 -5.014 1.00 1.00 H new ATOM 0 HA PHE A 66 128.035 21.676 -3.955 1.00 1.00 H new ATOM 0 HB2 PHE A 66 128.763 20.042 -5.746 1.00 1.00 H new ATOM 0 HB3 PHE A 66 129.602 19.114 -4.519 1.00 1.00 H new ATOM 0 HD1 PHE A 66 128.313 18.060 -2.639 1.00 1.00 H new ATOM 0 HD2 PHE A 66 126.344 19.971 -5.945 1.00 1.00 H new ATOM 0 HE1 PHE A 66 126.198 16.917 -2.037 1.00 1.00 H new ATOM 0 HE2 PHE A 66 124.225 18.825 -5.341 1.00 1.00 H new ATOM 0 HZ PHE A 66 124.153 17.299 -3.387 1.00 1.00 H new ATOM 1046 N LYS A 67 130.268 20.255 -1.984 1.00 1.00 N ATOM 1047 CA LYS A 67 130.531 19.864 -0.607 1.00 1.00 C ATOM 1048 C LYS A 67 130.299 21.015 0.345 1.00 1.00 C ATOM 1049 O LYS A 67 129.673 20.846 1.389 1.00 1.00 O ATOM 1050 CB LYS A 67 131.985 19.420 -0.446 1.00 1.00 C ATOM 1051 CG LYS A 67 132.203 18.058 -1.095 1.00 1.00 C ATOM 1052 CD LYS A 67 133.669 17.664 -0.926 1.00 1.00 C ATOM 1053 CE LYS A 67 133.882 16.269 -1.500 1.00 1.00 C ATOM 1054 NZ LYS A 67 135.298 15.859 -1.289 1.00 1.00 N ATOM 0 H LYS A 67 131.071 20.178 -2.608 1.00 1.00 H new ATOM 0 HA LYS A 67 129.849 19.046 -0.374 1.00 1.00 H new ATOM 0 HB2 LYS A 67 132.648 20.156 -0.900 1.00 1.00 H new ATOM 0 HB3 LYS A 67 132.241 19.370 0.612 1.00 1.00 H new ATOM 0 HG2 LYS A 67 131.556 17.312 -0.634 1.00 1.00 H new ATOM 0 HG3 LYS A 67 131.942 18.097 -2.152 1.00 1.00 H new ATOM 0 HD2 LYS A 67 134.312 18.382 -1.435 1.00 1.00 H new ATOM 0 HD3 LYS A 67 133.944 17.682 0.129 1.00 1.00 H new ATOM 0 HE2 LYS A 67 133.210 15.559 -1.018 1.00 1.00 H new ATOM 0 HE3 LYS A 67 133.644 16.261 -2.564 1.00 1.00 H new ATOM 0 HZ1 LYS A 67 135.450 14.914 -1.695 1.00 1.00 H new ATOM 0 HZ2 LYS A 67 135.930 16.541 -1.754 1.00 1.00 H new ATOM 0 HZ3 LYS A 67 135.504 15.835 -0.270 1.00 1.00 H new ATOM 1068 N HIS A 68 130.822 22.187 -0.002 1.00 1.00 N ATOM 1069 CA HIS A 68 130.681 23.340 0.852 1.00 1.00 C ATOM 1070 C HIS A 68 129.234 23.773 0.940 1.00 1.00 C ATOM 1071 O HIS A 68 128.719 24.032 2.026 1.00 1.00 O ATOM 1072 CB HIS A 68 131.525 24.503 0.318 1.00 1.00 C ATOM 1073 CG HIS A 68 131.449 25.666 1.273 1.00 1.00 C ATOM 1074 ND1 HIS A 68 132.229 25.734 2.416 1.00 1.00 N ATOM 1075 CD2 HIS A 68 130.695 26.815 1.266 1.00 1.00 C ATOM 1076 CE1 HIS A 68 131.932 26.886 3.045 1.00 1.00 C ATOM 1077 NE2 HIS A 68 131.002 27.584 2.386 1.00 1.00 N ATOM 0 H HIS A 68 131.342 22.353 -0.864 1.00 1.00 H new ATOM 0 HA HIS A 68 131.028 23.064 1.847 1.00 1.00 H new ATOM 0 HB2 HIS A 68 132.561 24.187 0.196 1.00 1.00 H new ATOM 0 HB3 HIS A 68 131.166 24.804 -0.666 1.00 1.00 H new ATOM 0 HD2 HIS A 68 129.974 27.081 0.507 1.00 1.00 H new ATOM 0 HE1 HIS A 68 132.389 27.207 3.969 1.00 1.00 H new ATOM 0 HE2 HIS A 68 130.603 28.486 2.647 1.00 1.00 H new ATOM 1085 N PHE A 69 128.574 23.859 -0.210 1.00 1.00 N ATOM 1086 CA PHE A 69 127.195 24.272 -0.248 1.00 1.00 C ATOM 1087 C PHE A 69 126.324 23.296 0.525 1.00 1.00 C ATOM 1088 O PHE A 69 125.499 23.701 1.345 1.00 1.00 O ATOM 1089 CB PHE A 69 126.742 24.362 -1.705 1.00 1.00 C ATOM 1090 CG PHE A 69 125.246 24.552 -1.772 1.00 1.00 C ATOM 1091 CD1 PHE A 69 124.672 25.756 -1.351 1.00 1.00 C ATOM 1092 CD2 PHE A 69 124.437 23.524 -2.269 1.00 1.00 C ATOM 1093 CE1 PHE A 69 123.284 25.933 -1.428 1.00 1.00 C ATOM 1094 CE2 PHE A 69 123.051 23.701 -2.343 1.00 1.00 C ATOM 1095 CZ PHE A 69 122.475 24.905 -1.922 1.00 1.00 C ATOM 0 H PHE A 69 128.980 23.646 -1.121 1.00 1.00 H new ATOM 0 HA PHE A 69 127.096 25.250 0.222 1.00 1.00 H new ATOM 0 HB2 PHE A 69 127.245 25.193 -2.200 1.00 1.00 H new ATOM 0 HB3 PHE A 69 127.026 23.455 -2.239 1.00 1.00 H new ATOM 0 HD1 PHE A 69 125.298 26.548 -0.967 1.00 1.00 H new ATOM 0 HD2 PHE A 69 124.882 22.595 -2.595 1.00 1.00 H new ATOM 0 HE1 PHE A 69 122.839 26.863 -1.106 1.00 1.00 H new ATOM 0 HE2 PHE A 69 122.425 22.908 -2.725 1.00 1.00 H new ATOM 0 HZ PHE A 69 121.405 25.040 -1.979 1.00 1.00 H new ATOM 1105 N ALA A 70 126.483 22.010 0.227 1.00 1.00 N ATOM 1106 CA ALA A 70 125.686 20.972 0.851 1.00 1.00 C ATOM 1107 C ALA A 70 125.975 20.813 2.341 1.00 1.00 C ATOM 1108 O ALA A 70 125.069 20.530 3.125 1.00 1.00 O ATOM 1109 CB ALA A 70 125.924 19.636 0.143 1.00 1.00 C ATOM 0 H ALA A 70 127.164 21.665 -0.449 1.00 1.00 H new ATOM 0 HA ALA A 70 124.644 21.276 0.754 1.00 1.00 H new ATOM 0 HB1 ALA A 70 125.322 18.861 0.617 1.00 1.00 H new ATOM 0 HB2 ALA A 70 125.641 19.725 -0.906 1.00 1.00 H new ATOM 0 HB3 ALA A 70 126.979 19.370 0.213 1.00 1.00 H new ATOM 1115 N GLY A 71 127.230 20.986 2.731 1.00 1.00 N ATOM 1116 CA GLY A 71 127.593 20.841 4.129 1.00 1.00 C ATOM 1117 C GLY A 71 126.931 21.921 4.960 1.00 1.00 C ATOM 1118 O GLY A 71 126.540 21.691 6.105 1.00 1.00 O ATOM 0 H GLY A 71 128.002 21.223 2.108 1.00 1.00 H new ATOM 0 HA2 GLY A 71 127.290 19.858 4.490 1.00 1.00 H new ATOM 0 HA3 GLY A 71 128.676 20.901 4.239 1.00 1.00 H new ATOM 1122 N VAL A 72 126.840 23.110 4.387 1.00 1.00 N ATOM 1123 CA VAL A 72 126.266 24.242 5.071 1.00 1.00 C ATOM 1124 C VAL A 72 124.739 24.299 4.953 1.00 1.00 C ATOM 1125 O VAL A 72 124.067 24.647 5.925 1.00 1.00 O ATOM 1126 CB VAL A 72 126.870 25.518 4.489 1.00 1.00 C ATOM 1127 CG1 VAL A 72 126.022 26.714 4.895 1.00 1.00 C ATOM 1128 CG2 VAL A 72 128.300 25.702 5.007 1.00 1.00 C ATOM 0 H VAL A 72 127.162 23.310 3.440 1.00 1.00 H new ATOM 0 HA VAL A 72 126.497 24.142 6.132 1.00 1.00 H new ATOM 0 HB VAL A 72 126.892 25.440 3.402 1.00 1.00 H new ATOM 0 HG11 VAL A 72 126.454 27.624 4.479 1.00 1.00 H new ATOM 0 HG12 VAL A 72 125.008 26.587 4.515 1.00 1.00 H new ATOM 0 HG13 VAL A 72 125.995 26.789 5.982 1.00 1.00 H new ATOM 0 HG21 VAL A 72 128.724 26.614 4.588 1.00 1.00 H new ATOM 0 HG22 VAL A 72 128.287 25.775 6.094 1.00 1.00 H new ATOM 0 HG23 VAL A 72 128.908 24.848 4.708 1.00 1.00 H new ATOM 1138 N HIS A 73 124.194 24.075 3.751 1.00 1.00 N ATOM 1139 CA HIS A 73 122.751 24.234 3.531 1.00 1.00 C ATOM 1140 C HIS A 73 121.924 22.953 3.334 1.00 1.00 C ATOM 1141 O HIS A 73 120.706 23.079 3.188 1.00 1.00 O ATOM 1142 CB HIS A 73 122.537 25.133 2.309 1.00 1.00 C ATOM 1143 CG HIS A 73 122.879 26.555 2.657 1.00 1.00 C ATOM 1144 ND1 HIS A 73 122.279 27.223 3.713 1.00 1.00 N ATOM 1145 CD2 HIS A 73 123.750 27.456 2.092 1.00 1.00 C ATOM 1146 CE1 HIS A 73 122.792 28.467 3.753 1.00 1.00 C ATOM 1147 NE2 HIS A 73 123.693 28.661 2.787 1.00 1.00 N ATOM 0 H HIS A 73 124.721 23.787 2.927 1.00 1.00 H new ATOM 0 HA HIS A 73 122.384 24.661 4.464 1.00 1.00 H new ATOM 0 HB2 HIS A 73 123.159 24.792 1.482 1.00 1.00 H new ATOM 0 HB3 HIS A 73 121.501 25.069 1.976 1.00 1.00 H new ATOM 0 HD2 HIS A 73 124.382 27.259 1.239 1.00 1.00 H new ATOM 0 HE1 HIS A 73 122.509 29.216 4.478 1.00 1.00 H new ATOM 0 HE2 HIS A 73 124.226 29.510 2.599 1.00 1.00 H new ATOM 1155 N LEU A 74 122.513 21.747 3.257 1.00 1.00 N ATOM 1156 CA LEU A 74 121.656 20.572 2.988 1.00 1.00 C ATOM 1157 C LEU A 74 121.968 19.304 3.778 1.00 1.00 C ATOM 1158 O LEU A 74 123.050 19.149 4.343 1.00 1.00 O ATOM 1159 CB LEU A 74 121.727 20.206 1.506 1.00 1.00 C ATOM 1160 CG LEU A 74 121.068 21.284 0.643 1.00 1.00 C ATOM 1161 CD1 LEU A 74 122.121 22.261 0.139 1.00 1.00 C ATOM 1162 CD2 LEU A 74 120.399 20.605 -0.548 1.00 1.00 C ATOM 0 H LEU A 74 123.510 21.561 3.368 1.00 1.00 H new ATOM 0 HA LEU A 74 120.668 20.900 3.310 1.00 1.00 H new ATOM 0 HB2 LEU A 74 122.768 20.082 1.208 1.00 1.00 H new ATOM 0 HB3 LEU A 74 121.232 19.249 1.340 1.00 1.00 H new ATOM 0 HG LEU A 74 120.332 21.831 1.233 1.00 1.00 H new ATOM 0 HD11 LEU A 74 121.644 23.025 -0.475 1.00 1.00 H new ATOM 0 HD12 LEU A 74 122.615 22.733 0.988 1.00 1.00 H new ATOM 0 HD13 LEU A 74 122.859 21.725 -0.458 1.00 1.00 H new ATOM 0 HD21 LEU A 74 119.923 21.358 -1.176 1.00 1.00 H new ATOM 0 HD22 LEU A 74 121.149 20.069 -1.130 1.00 1.00 H new ATOM 0 HD23 LEU A 74 119.646 19.902 -0.191 1.00 1.00 H new ATOM 1174 N HIS A 75 121.021 18.365 3.711 1.00 1.00 N ATOM 1175 CA HIS A 75 121.166 17.041 4.303 1.00 1.00 C ATOM 1176 C HIS A 75 121.191 16.058 3.130 1.00 1.00 C ATOM 1177 O HIS A 75 120.254 16.041 2.330 1.00 1.00 O ATOM 1178 CB HIS A 75 119.985 16.715 5.224 1.00 1.00 C ATOM 1179 CG HIS A 75 119.995 17.627 6.420 1.00 1.00 C ATOM 1180 ND1 HIS A 75 121.029 17.628 7.345 1.00 1.00 N ATOM 1181 CD2 HIS A 75 119.096 18.561 6.863 1.00 1.00 C ATOM 1182 CE1 HIS A 75 120.727 18.538 8.290 1.00 1.00 C ATOM 1183 NE2 HIS A 75 119.560 19.137 8.043 1.00 1.00 N ATOM 0 H HIS A 75 120.127 18.507 3.240 1.00 1.00 H new ATOM 0 HA HIS A 75 122.070 16.984 4.909 1.00 1.00 H new ATOM 0 HB2 HIS A 75 119.047 16.827 4.679 1.00 1.00 H new ATOM 0 HB3 HIS A 75 120.043 15.676 5.549 1.00 1.00 H new ATOM 0 HD1 HIS A 75 121.866 17.045 7.315 1.00 1.00 H new ATOM 0 HD2 HIS A 75 118.168 18.813 6.371 1.00 1.00 H new ATOM 0 HE1 HIS A 75 121.352 18.757 9.143 1.00 1.00 H new ATOM 1191 N MET A 76 122.247 15.256 3.009 1.00 1.00 N ATOM 1192 CA MET A 76 122.335 14.313 1.893 1.00 1.00 C ATOM 1193 C MET A 76 121.997 12.896 2.325 1.00 1.00 C ATOM 1194 O MET A 76 122.438 12.420 3.370 1.00 1.00 O ATOM 1195 CB MET A 76 123.740 14.352 1.274 1.00 1.00 C ATOM 1196 CG MET A 76 123.891 13.264 0.196 1.00 1.00 C ATOM 1197 SD MET A 76 122.576 13.419 -1.048 1.00 1.00 S ATOM 1198 CE MET A 76 123.131 14.964 -1.816 1.00 1.00 C ATOM 0 H MET A 76 123.038 15.238 3.653 1.00 1.00 H new ATOM 0 HA MET A 76 121.602 14.618 1.146 1.00 1.00 H new ATOM 0 HB2 MET A 76 123.922 15.333 0.835 1.00 1.00 H new ATOM 0 HB3 MET A 76 124.490 14.206 2.052 1.00 1.00 H new ATOM 0 HG2 MET A 76 124.866 13.351 -0.283 1.00 1.00 H new ATOM 0 HG3 MET A 76 123.849 12.277 0.658 1.00 1.00 H new ATOM 0 HE1 MET A 76 122.661 15.074 -2.793 1.00 1.00 H new ATOM 0 HE2 MET A 76 122.852 15.806 -1.182 1.00 1.00 H new ATOM 0 HE3 MET A 76 124.214 14.943 -1.935 1.00 1.00 H new ATOM 1208 N VAL A 77 121.225 12.227 1.481 1.00 1.00 N ATOM 1209 CA VAL A 77 120.833 10.855 1.719 1.00 1.00 C ATOM 1210 C VAL A 77 121.204 10.040 0.482 1.00 1.00 C ATOM 1211 O VAL A 77 120.894 10.436 -0.642 1.00 1.00 O ATOM 1212 CB VAL A 77 119.328 10.798 1.986 1.00 1.00 C ATOM 1213 CG1 VAL A 77 118.840 9.356 1.890 1.00 1.00 C ATOM 1214 CG2 VAL A 77 119.037 11.334 3.391 1.00 1.00 C ATOM 0 H VAL A 77 120.856 12.623 0.616 1.00 1.00 H new ATOM 0 HA VAL A 77 121.344 10.444 2.590 1.00 1.00 H new ATOM 0 HB VAL A 77 118.811 11.407 1.244 1.00 1.00 H new ATOM 0 HG11 VAL A 77 117.767 9.321 2.081 1.00 1.00 H new ATOM 0 HG12 VAL A 77 119.043 8.969 0.892 1.00 1.00 H new ATOM 0 HG13 VAL A 77 119.360 8.746 2.629 1.00 1.00 H new ATOM 0 HG21 VAL A 77 117.964 11.293 3.581 1.00 1.00 H new ATOM 0 HG22 VAL A 77 119.560 10.725 4.128 1.00 1.00 H new ATOM 0 HG23 VAL A 77 119.380 12.366 3.465 1.00 1.00 H new ATOM 1224 N GLU A 78 121.883 8.919 0.692 1.00 1.00 N ATOM 1225 CA GLU A 78 122.310 8.077 -0.423 1.00 1.00 C ATOM 1226 C GLU A 78 121.313 6.954 -0.644 1.00 1.00 C ATOM 1227 O GLU A 78 121.013 6.181 0.268 1.00 1.00 O ATOM 1228 CB GLU A 78 123.696 7.493 -0.125 1.00 1.00 C ATOM 1229 CG GLU A 78 124.206 6.722 -1.344 1.00 1.00 C ATOM 1230 CD GLU A 78 125.623 6.217 -1.083 1.00 1.00 C ATOM 1231 OE1 GLU A 78 126.022 6.197 0.069 1.00 1.00 O ATOM 1232 OE2 GLU A 78 126.293 5.868 -2.041 1.00 1.00 O ATOM 0 H GLU A 78 122.149 8.573 1.614 1.00 1.00 H new ATOM 0 HA GLU A 78 122.360 8.683 -1.327 1.00 1.00 H new ATOM 0 HB2 GLU A 78 124.391 8.293 0.128 1.00 1.00 H new ATOM 0 HB3 GLU A 78 123.644 6.831 0.740 1.00 1.00 H new ATOM 0 HG2 GLU A 78 123.545 5.882 -1.557 1.00 1.00 H new ATOM 0 HG3 GLU A 78 124.196 7.366 -2.223 1.00 1.00 H new ATOM 1239 N VAL A 79 120.802 6.867 -1.870 1.00 1.00 N ATOM 1240 CA VAL A 79 119.836 5.841 -2.228 1.00 1.00 C ATOM 1241 C VAL A 79 120.301 5.134 -3.495 1.00 1.00 C ATOM 1242 O VAL A 79 120.153 5.648 -4.603 1.00 1.00 O ATOM 1243 CB VAL A 79 118.474 6.488 -2.483 1.00 1.00 C ATOM 1244 CG1 VAL A 79 117.374 5.449 -2.283 1.00 1.00 C ATOM 1245 CG2 VAL A 79 118.269 7.653 -1.509 1.00 1.00 C ATOM 0 H VAL A 79 121.045 7.499 -2.633 1.00 1.00 H new ATOM 0 HA VAL A 79 119.751 5.121 -1.414 1.00 1.00 H new ATOM 0 HB VAL A 79 118.434 6.864 -3.505 1.00 1.00 H new ATOM 0 HG11 VAL A 79 116.402 5.908 -2.464 1.00 1.00 H new ATOM 0 HG12 VAL A 79 117.521 4.624 -2.980 1.00 1.00 H new ATOM 0 HG13 VAL A 79 117.412 5.071 -1.261 1.00 1.00 H new ATOM 0 HG21 VAL A 79 117.298 8.113 -1.692 1.00 1.00 H new ATOM 0 HG22 VAL A 79 118.308 7.282 -0.485 1.00 1.00 H new ATOM 0 HG23 VAL A 79 119.055 8.393 -1.657 1.00 1.00 H new ATOM 1255 N ASP A 80 120.980 4.009 -3.292 1.00 1.00 N ATOM 1256 CA ASP A 80 121.603 3.301 -4.406 1.00 1.00 C ATOM 1257 C ASP A 80 120.941 1.989 -4.826 1.00 1.00 C ATOM 1258 O ASP A 80 120.506 1.207 -3.979 1.00 1.00 O ATOM 1259 CB ASP A 80 123.059 3.011 -4.041 1.00 1.00 C ATOM 1260 CG ASP A 80 123.843 4.316 -3.953 1.00 1.00 C ATOM 1261 OD1 ASP A 80 123.334 5.325 -4.414 1.00 1.00 O ATOM 1262 OD2 ASP A 80 124.943 4.287 -3.424 1.00 1.00 O ATOM 0 H ASP A 80 121.112 3.572 -2.380 1.00 1.00 H new ATOM 0 HA ASP A 80 121.494 3.965 -5.264 1.00 1.00 H new ATOM 0 HB2 ASP A 80 123.106 2.484 -3.088 1.00 1.00 H new ATOM 0 HB3 ASP A 80 123.507 2.357 -4.789 1.00 1.00 H new ATOM 1267 N PHE A 81 120.929 1.731 -6.131 1.00 1.00 N ATOM 1268 CA PHE A 81 120.389 0.478 -6.651 1.00 1.00 C ATOM 1269 C PHE A 81 121.428 -0.145 -7.592 1.00 1.00 C ATOM 1270 O PHE A 81 121.317 -0.023 -8.809 1.00 1.00 O ATOM 1271 CB PHE A 81 119.072 0.713 -7.398 1.00 1.00 C ATOM 1272 CG PHE A 81 119.008 2.135 -7.903 1.00 1.00 C ATOM 1273 CD1 PHE A 81 118.717 3.174 -7.020 1.00 1.00 C ATOM 1274 CD2 PHE A 81 119.230 2.407 -9.256 1.00 1.00 C ATOM 1275 CE1 PHE A 81 118.651 4.488 -7.491 1.00 1.00 C ATOM 1276 CE2 PHE A 81 119.163 3.723 -9.728 1.00 1.00 C ATOM 1277 CZ PHE A 81 118.872 4.765 -8.843 1.00 1.00 C ATOM 0 H PHE A 81 121.285 2.368 -6.844 1.00 1.00 H new ATOM 0 HA PHE A 81 120.180 -0.197 -5.821 1.00 1.00 H new ATOM 0 HB2 PHE A 81 118.990 0.018 -8.234 1.00 1.00 H new ATOM 0 HB3 PHE A 81 118.229 0.516 -6.736 1.00 1.00 H new ATOM 0 HD1 PHE A 81 118.543 2.964 -5.975 1.00 1.00 H new ATOM 0 HD2 PHE A 81 119.454 1.600 -9.938 1.00 1.00 H new ATOM 0 HE1 PHE A 81 118.428 5.293 -6.807 1.00 1.00 H new ATOM 0 HE2 PHE A 81 119.336 3.933 -10.773 1.00 1.00 H new ATOM 0 HZ PHE A 81 118.818 5.782 -9.203 1.00 1.00 H new ATOM 1287 N PRO A 82 122.454 -0.763 -7.053 1.00 1.00 N ATOM 1288 CA PRO A 82 123.556 -1.363 -7.859 1.00 1.00 C ATOM 1289 C PRO A 82 123.208 -2.725 -8.456 1.00 1.00 C ATOM 1290 O PRO A 82 122.198 -3.330 -8.097 1.00 1.00 O ATOM 1291 CB PRO A 82 124.711 -1.478 -6.867 1.00 1.00 C ATOM 1292 CG PRO A 82 124.074 -1.607 -5.523 1.00 1.00 C ATOM 1293 CD PRO A 82 122.676 -0.973 -5.612 1.00 1.00 C ATOM 0 HA PRO A 82 123.785 -0.748 -8.729 1.00 1.00 H new ATOM 0 HB2 PRO A 82 125.335 -2.344 -7.090 1.00 1.00 H new ATOM 0 HB3 PRO A 82 125.356 -0.600 -6.913 1.00 1.00 H new ATOM 0 HG2 PRO A 82 124.002 -2.655 -5.232 1.00 1.00 H new ATOM 0 HG3 PRO A 82 124.675 -1.106 -4.764 1.00 1.00 H new ATOM 0 HD2 PRO A 82 121.916 -1.628 -5.185 1.00 1.00 H new ATOM 0 HD3 PRO A 82 122.632 -0.032 -5.063 1.00 1.00 H new ATOM 1301 N GLN A 83 124.066 -3.217 -9.347 1.00 1.00 N ATOM 1302 CA GLN A 83 123.826 -4.529 -9.936 1.00 1.00 C ATOM 1303 C GLN A 83 124.162 -5.612 -8.916 1.00 1.00 C ATOM 1304 O GLN A 83 123.423 -6.584 -8.762 1.00 1.00 O ATOM 1305 CB GLN A 83 124.646 -4.739 -11.216 1.00 1.00 C ATOM 1306 CG GLN A 83 125.970 -3.986 -11.130 1.00 1.00 C ATOM 1307 CD GLN A 83 126.876 -4.394 -12.286 1.00 1.00 C ATOM 1308 OE1 GLN A 83 126.866 -5.552 -12.710 1.00 1.00 O ATOM 1309 NE2 GLN A 83 127.661 -3.506 -12.831 1.00 1.00 N ATOM 0 H GLN A 83 124.910 -2.742 -9.669 1.00 1.00 H new ATOM 0 HA GLN A 83 122.773 -4.590 -10.209 1.00 1.00 H new ATOM 0 HB2 GLN A 83 124.834 -5.802 -11.364 1.00 1.00 H new ATOM 0 HB3 GLN A 83 124.079 -4.392 -12.080 1.00 1.00 H new ATOM 0 HG2 GLN A 83 125.790 -2.911 -11.160 1.00 1.00 H new ATOM 0 HG3 GLN A 83 126.459 -4.201 -10.180 1.00 1.00 H new ATOM 0 HE21 GLN A 83 127.669 -2.548 -12.480 1.00 1.00 H new ATOM 0 HE22 GLN A 83 128.267 -3.769 -13.608 1.00 1.00 H new ATOM 1318 N LYS A 84 125.244 -5.400 -8.175 1.00 1.00 N ATOM 1319 CA LYS A 84 125.635 -6.311 -7.120 1.00 1.00 C ATOM 1320 C LYS A 84 125.164 -5.702 -5.806 1.00 1.00 C ATOM 1321 O LYS A 84 125.784 -4.799 -5.246 1.00 1.00 O ATOM 1322 CB LYS A 84 127.148 -6.500 -7.107 1.00 1.00 C ATOM 1323 CG LYS A 84 127.482 -7.853 -6.478 1.00 1.00 C ATOM 1324 CD LYS A 84 128.985 -8.086 -6.543 1.00 1.00 C ATOM 1325 CE LYS A 84 129.305 -9.460 -5.953 1.00 1.00 C ATOM 1326 NZ LYS A 84 130.780 -9.665 -5.917 1.00 1.00 N ATOM 0 H LYS A 84 125.865 -4.599 -8.291 1.00 1.00 H new ATOM 0 HA LYS A 84 125.187 -7.293 -7.275 1.00 1.00 H new ATOM 0 HB2 LYS A 84 127.541 -6.451 -8.122 1.00 1.00 H new ATOM 0 HB3 LYS A 84 127.622 -5.697 -6.543 1.00 1.00 H new ATOM 0 HG2 LYS A 84 127.144 -7.878 -5.442 1.00 1.00 H new ATOM 0 HG3 LYS A 84 126.957 -8.650 -7.004 1.00 1.00 H new ATOM 0 HD2 LYS A 84 129.330 -8.031 -7.576 1.00 1.00 H new ATOM 0 HD3 LYS A 84 129.510 -7.308 -5.990 1.00 1.00 H new ATOM 0 HE2 LYS A 84 128.894 -9.538 -4.947 1.00 1.00 H new ATOM 0 HE3 LYS A 84 128.835 -10.241 -6.551 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 130.991 -10.601 -5.515 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 131.162 -9.609 -6.883 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 131.219 -8.928 -5.328 1.00 1.00 H new ATOM 1340 N ASN A 85 124.022 -6.197 -5.370 1.00 1.00 N ATOM 1341 CA ASN A 85 123.368 -5.708 -4.148 1.00 1.00 C ATOM 1342 C ASN A 85 123.881 -6.388 -2.872 1.00 1.00 C ATOM 1343 O ASN A 85 123.847 -7.609 -2.722 1.00 1.00 O ATOM 1344 CB ASN A 85 121.857 -5.959 -4.247 1.00 1.00 C ATOM 1345 CG ASN A 85 121.250 -5.171 -5.404 1.00 1.00 C ATOM 1346 OD1 ASN A 85 120.209 -5.555 -5.938 1.00 1.00 O ATOM 1347 ND2 ASN A 85 121.836 -4.087 -5.822 1.00 1.00 N ATOM 0 H ASN A 85 123.515 -6.946 -5.842 1.00 1.00 H new ATOM 0 HA ASN A 85 123.600 -4.645 -4.075 1.00 1.00 H new ATOM 0 HB2 ASN A 85 121.669 -7.023 -4.388 1.00 1.00 H new ATOM 0 HB3 ASN A 85 121.374 -5.672 -3.313 1.00 1.00 H new ATOM 0 HD21 ASN A 85 121.433 -3.554 -6.593 1.00 1.00 H new ATOM 0 HD22 ASN A 85 122.698 -3.770 -5.379 1.00 1.00 H new ATOM 1354 N HIS A 86 124.338 -5.527 -1.952 1.00 1.00 N ATOM 1355 CA HIS A 86 124.848 -5.993 -0.659 1.00 1.00 C ATOM 1356 C HIS A 86 124.235 -5.187 0.485 1.00 1.00 C ATOM 1357 O HIS A 86 124.681 -5.292 1.629 1.00 1.00 O ATOM 1358 CB HIS A 86 126.372 -5.849 -0.596 1.00 1.00 C ATOM 1359 CG HIS A 86 127.021 -6.797 -1.564 1.00 1.00 C ATOM 1360 ND1 HIS A 86 126.929 -8.172 -1.425 1.00 1.00 N ATOM 1361 CD2 HIS A 86 127.792 -6.582 -2.678 1.00 1.00 C ATOM 1362 CE1 HIS A 86 127.625 -8.728 -2.431 1.00 1.00 C ATOM 1363 NE2 HIS A 86 128.172 -7.803 -3.224 1.00 1.00 N ATOM 0 H HIS A 86 124.364 -4.515 -2.079 1.00 1.00 H new ATOM 0 HA HIS A 86 124.574 -7.043 -0.556 1.00 1.00 H new ATOM 0 HB2 HIS A 86 126.658 -4.824 -0.832 1.00 1.00 H new ATOM 0 HB3 HIS A 86 126.723 -6.053 0.416 1.00 1.00 H new ATOM 0 HD1 HIS A 86 126.425 -8.672 -0.692 1.00 1.00 H new ATOM 0 HD2 HIS A 86 128.062 -5.613 -3.071 1.00 1.00 H new ATOM 0 HE1 HIS A 86 127.729 -9.793 -2.580 1.00 1.00 H new ATOM 1371 N GLN A 87 123.211 -4.396 0.187 1.00 1.00 N ATOM 1372 CA GLN A 87 122.560 -3.596 1.221 1.00 1.00 C ATOM 1373 C GLN A 87 121.577 -4.466 2.009 1.00 1.00 C ATOM 1374 O GLN A 87 121.052 -5.442 1.478 1.00 1.00 O ATOM 1375 CB GLN A 87 121.801 -2.430 0.582 1.00 1.00 C ATOM 1376 CG GLN A 87 122.727 -1.220 0.424 1.00 1.00 C ATOM 1377 CD GLN A 87 124.052 -1.643 -0.204 1.00 1.00 C ATOM 1378 OE1 GLN A 87 124.066 -2.273 -1.262 1.00 1.00 O ATOM 1379 NE2 GLN A 87 125.173 -1.325 0.385 1.00 1.00 N ATOM 0 H GLN A 87 122.817 -4.291 -0.748 1.00 1.00 H new ATOM 0 HA GLN A 87 123.323 -3.205 1.894 1.00 1.00 H new ATOM 0 HB2 GLN A 87 121.412 -2.729 -0.391 1.00 1.00 H new ATOM 0 HB3 GLN A 87 120.943 -2.163 1.199 1.00 1.00 H new ATOM 0 HG2 GLN A 87 122.247 -0.465 -0.199 1.00 1.00 H new ATOM 0 HG3 GLN A 87 122.908 -0.763 1.397 1.00 1.00 H new ATOM 0 HE21 GLN A 87 125.159 -0.803 1.261 1.00 1.00 H new ATOM 0 HE22 GLN A 87 126.063 -1.598 -0.031 1.00 1.00 H new ATOM 1388 N PRO A 88 121.308 -4.138 3.249 1.00 1.00 N ATOM 1389 CA PRO A 88 120.357 -4.924 4.087 1.00 1.00 C ATOM 1390 C PRO A 88 118.922 -4.782 3.578 1.00 1.00 C ATOM 1391 O PRO A 88 118.581 -3.795 2.926 1.00 1.00 O ATOM 1392 CB PRO A 88 120.533 -4.328 5.487 1.00 1.00 C ATOM 1393 CG PRO A 88 121.020 -2.938 5.258 1.00 1.00 C ATOM 1394 CD PRO A 88 121.869 -2.992 3.988 1.00 1.00 C ATOM 0 HA PRO A 88 120.554 -5.996 4.067 1.00 1.00 H new ATOM 0 HB2 PRO A 88 119.592 -4.331 6.038 1.00 1.00 H new ATOM 0 HB3 PRO A 88 121.248 -4.905 6.074 1.00 1.00 H new ATOM 0 HG2 PRO A 88 120.185 -2.247 5.140 1.00 1.00 H new ATOM 0 HG3 PRO A 88 121.608 -2.586 6.106 1.00 1.00 H new ATOM 0 HD2 PRO A 88 121.793 -2.068 3.414 1.00 1.00 H new ATOM 0 HD3 PRO A 88 122.925 -3.139 4.216 1.00 1.00 H new ATOM 1402 N GLU A 89 118.096 -5.792 3.841 1.00 1.00 N ATOM 1403 CA GLU A 89 116.713 -5.790 3.374 1.00 1.00 C ATOM 1404 C GLU A 89 115.995 -4.482 3.688 1.00 1.00 C ATOM 1405 O GLU A 89 115.323 -3.925 2.820 1.00 1.00 O ATOM 1406 CB GLU A 89 115.951 -6.955 4.007 1.00 1.00 C ATOM 1407 CG GLU A 89 116.445 -8.274 3.407 1.00 1.00 C ATOM 1408 CD GLU A 89 115.755 -9.449 4.092 1.00 1.00 C ATOM 1409 OE1 GLU A 89 114.972 -9.207 4.998 1.00 1.00 O ATOM 1410 OE2 GLU A 89 116.019 -10.575 3.704 1.00 1.00 O ATOM 0 H GLU A 89 118.360 -6.621 4.374 1.00 1.00 H new ATOM 0 HA GLU A 89 116.738 -5.899 2.290 1.00 1.00 H new ATOM 0 HB2 GLU A 89 116.099 -6.956 5.087 1.00 1.00 H new ATOM 0 HB3 GLU A 89 114.881 -6.842 3.832 1.00 1.00 H new ATOM 0 HG2 GLU A 89 116.241 -8.295 2.337 1.00 1.00 H new ATOM 0 HG3 GLU A 89 117.525 -8.356 3.527 1.00 1.00 H new ATOM 1417 N GLU A 90 116.099 -4.002 4.923 1.00 1.00 N ATOM 1418 CA GLU A 90 115.414 -2.771 5.306 1.00 1.00 C ATOM 1419 C GLU A 90 115.815 -1.600 4.424 1.00 1.00 C ATOM 1420 O GLU A 90 114.978 -0.783 4.048 1.00 1.00 O ATOM 1421 CB GLU A 90 115.751 -2.399 6.748 1.00 1.00 C ATOM 1422 CG GLU A 90 115.134 -3.401 7.718 1.00 1.00 C ATOM 1423 CD GLU A 90 115.483 -3.001 9.149 1.00 1.00 C ATOM 1424 OE1 GLU A 90 116.150 -1.993 9.312 1.00 1.00 O ATOM 1425 OE2 GLU A 90 115.076 -3.706 10.058 1.00 1.00 O ATOM 0 H GLU A 90 116.643 -4.439 5.667 1.00 1.00 H new ATOM 0 HA GLU A 90 114.347 -2.962 5.192 1.00 1.00 H new ATOM 0 HB2 GLU A 90 116.833 -2.375 6.880 1.00 1.00 H new ATOM 0 HB3 GLU A 90 115.381 -1.397 6.967 1.00 1.00 H new ATOM 0 HG2 GLU A 90 114.052 -3.429 7.590 1.00 1.00 H new ATOM 0 HG3 GLU A 90 115.506 -4.404 7.508 1.00 1.00 H new ATOM 1432 N GLN A 91 117.095 -1.515 4.102 1.00 1.00 N ATOM 1433 CA GLN A 91 117.573 -0.420 3.270 1.00 1.00 C ATOM 1434 C GLN A 91 117.084 -0.579 1.842 1.00 1.00 C ATOM 1435 O GLN A 91 116.709 0.403 1.204 1.00 1.00 O ATOM 1436 CB GLN A 91 119.099 -0.348 3.286 1.00 1.00 C ATOM 1437 CG GLN A 91 119.549 0.849 2.448 1.00 1.00 C ATOM 1438 CD GLN A 91 121.045 1.078 2.622 1.00 1.00 C ATOM 1439 OE1 GLN A 91 121.624 0.665 3.627 1.00 1.00 O ATOM 1440 NE2 GLN A 91 121.709 1.704 1.692 1.00 1.00 N ATOM 0 H GLN A 91 117.812 -2.178 4.397 1.00 1.00 H new ATOM 0 HA GLN A 91 117.174 0.507 3.681 1.00 1.00 H new ATOM 0 HB2 GLN A 91 119.461 -0.248 4.309 1.00 1.00 H new ATOM 0 HB3 GLN A 91 119.524 -1.269 2.886 1.00 1.00 H new ATOM 0 HG2 GLN A 91 119.320 0.673 1.397 1.00 1.00 H new ATOM 0 HG3 GLN A 91 118.999 1.741 2.749 1.00 1.00 H new ATOM 0 HE21 GLN A 91 121.225 2.044 0.861 1.00 1.00 H new ATOM 0 HE22 GLN A 91 122.713 1.854 1.795 1.00 1.00 H new ATOM 1449 N ARG A 92 117.085 -1.805 1.333 1.00 1.00 N ATOM 1450 CA ARG A 92 116.629 -2.043 -0.025 1.00 1.00 C ATOM 1451 C ARG A 92 115.146 -1.725 -0.149 1.00 1.00 C ATOM 1452 O ARG A 92 114.725 -1.101 -1.120 1.00 1.00 O ATOM 1453 CB ARG A 92 116.880 -3.497 -0.427 1.00 1.00 C ATOM 1454 CG ARG A 92 118.382 -3.724 -0.620 1.00 1.00 C ATOM 1455 CD ARG A 92 118.625 -5.164 -1.079 1.00 1.00 C ATOM 1456 NE ARG A 92 118.319 -6.106 -0.007 1.00 1.00 N ATOM 1457 CZ ARG A 92 118.364 -7.421 -0.218 1.00 1.00 C ATOM 1458 NH1 ARG A 92 118.635 -7.879 -1.409 1.00 1.00 N ATOM 1459 NH2 ARG A 92 118.125 -8.251 0.761 1.00 1.00 N ATOM 0 H ARG A 92 117.393 -2.638 1.835 1.00 1.00 H new ATOM 0 HA ARG A 92 117.190 -1.390 -0.693 1.00 1.00 H new ATOM 0 HB2 ARG A 92 116.496 -4.169 0.341 1.00 1.00 H new ATOM 0 HB3 ARG A 92 116.346 -3.728 -1.349 1.00 1.00 H new ATOM 0 HG2 ARG A 92 118.775 -3.024 -1.358 1.00 1.00 H new ATOM 0 HG3 ARG A 92 118.912 -3.534 0.313 1.00 1.00 H new ATOM 0 HD2 ARG A 92 118.007 -5.383 -1.949 1.00 1.00 H new ATOM 0 HD3 ARG A 92 119.664 -5.282 -1.388 1.00 1.00 H new ATOM 0 HE ARG A 92 118.067 -5.753 0.916 1.00 1.00 H new ATOM 0 HH11 ARG A 92 118.812 -7.231 -2.177 1.00 1.00 H new ATOM 0 HH12 ARG A 92 118.670 -8.885 -1.573 1.00 1.00 H new ATOM 0 HH21 ARG A 92 117.903 -7.893 1.690 1.00 1.00 H new ATOM 0 HH22 ARG A 92 118.160 -9.257 0.597 1.00 1.00 H new ATOM 1473 N GLN A 93 114.351 -2.142 0.832 1.00 1.00 N ATOM 1474 CA GLN A 93 112.922 -1.867 0.790 1.00 1.00 C ATOM 1475 C GLN A 93 112.672 -0.368 0.822 1.00 1.00 C ATOM 1476 O GLN A 93 111.874 0.150 0.045 1.00 1.00 O ATOM 1477 CB GLN A 93 112.225 -2.525 1.981 1.00 1.00 C ATOM 1478 CG GLN A 93 112.267 -4.042 1.822 1.00 1.00 C ATOM 1479 CD GLN A 93 111.377 -4.459 0.650 1.00 1.00 C ATOM 1480 OE1 GLN A 93 110.246 -3.986 0.531 1.00 1.00 O ATOM 1481 NE2 GLN A 93 111.822 -5.314 -0.229 1.00 1.00 N ATOM 0 H GLN A 93 114.666 -2.662 1.651 1.00 1.00 H new ATOM 0 HA GLN A 93 112.519 -2.277 -0.136 1.00 1.00 H new ATOM 0 HB2 GLN A 93 112.715 -2.233 2.910 1.00 1.00 H new ATOM 0 HB3 GLN A 93 111.192 -2.184 2.045 1.00 1.00 H new ATOM 0 HG2 GLN A 93 113.292 -4.372 1.649 1.00 1.00 H new ATOM 0 HG3 GLN A 93 111.928 -4.524 2.739 1.00 1.00 H new ATOM 0 HE21 GLN A 93 112.759 -5.706 -0.131 1.00 1.00 H new ATOM 0 HE22 GLN A 93 111.233 -5.591 -1.015 1.00 1.00 H new ATOM 1490 N LYS A 94 113.360 0.329 1.721 1.00 1.00 N ATOM 1491 CA LYS A 94 113.192 1.770 1.829 1.00 1.00 C ATOM 1492 C LYS A 94 113.583 2.439 0.518 1.00 1.00 C ATOM 1493 O LYS A 94 112.883 3.323 0.033 1.00 1.00 O ATOM 1494 CB LYS A 94 114.076 2.319 2.960 1.00 1.00 C ATOM 1495 CG LYS A 94 113.805 3.824 3.167 1.00 1.00 C ATOM 1496 CD LYS A 94 115.110 4.577 3.474 1.00 1.00 C ATOM 1497 CE LYS A 94 115.569 4.262 4.900 1.00 1.00 C ATOM 1498 NZ LYS A 94 117.039 4.479 5.006 1.00 1.00 N ATOM 0 H LYS A 94 114.029 -0.075 2.376 1.00 1.00 H new ATOM 0 HA LYS A 94 112.146 1.984 2.049 1.00 1.00 H new ATOM 0 HB2 LYS A 94 113.876 1.776 3.884 1.00 1.00 H new ATOM 0 HB3 LYS A 94 115.127 2.161 2.719 1.00 1.00 H new ATOM 0 HG2 LYS A 94 113.341 4.241 2.273 1.00 1.00 H new ATOM 0 HG3 LYS A 94 113.099 3.962 3.986 1.00 1.00 H new ATOM 0 HD2 LYS A 94 115.883 4.289 2.762 1.00 1.00 H new ATOM 0 HD3 LYS A 94 114.956 5.650 3.361 1.00 1.00 H new ATOM 0 HE2 LYS A 94 115.044 4.899 5.612 1.00 1.00 H new ATOM 0 HE3 LYS A 94 115.323 3.231 5.153 1.00 1.00 H new ATOM 0 HZ1 LYS A 94 117.306 4.567 6.007 1.00 1.00 H new ATOM 0 HZ2 LYS A 94 117.540 3.672 4.584 1.00 1.00 H new ATOM 0 HZ3 LYS A 94 117.299 5.350 4.501 1.00 1.00 H new ATOM 1512 N ASN A 95 114.711 2.018 -0.043 1.00 1.00 N ATOM 1513 CA ASN A 95 115.191 2.603 -1.286 1.00 1.00 C ATOM 1514 C ASN A 95 114.175 2.422 -2.407 1.00 1.00 C ATOM 1515 O ASN A 95 113.932 3.350 -3.177 1.00 1.00 O ATOM 1516 CB ASN A 95 116.513 1.947 -1.687 1.00 1.00 C ATOM 1517 CG ASN A 95 117.616 2.360 -0.719 1.00 1.00 C ATOM 1518 OD1 ASN A 95 118.742 1.871 -0.817 1.00 1.00 O ATOM 1519 ND2 ASN A 95 117.359 3.230 0.220 1.00 1.00 N ATOM 0 H ASN A 95 115.304 1.281 0.340 1.00 1.00 H new ATOM 0 HA ASN A 95 115.340 3.671 -1.124 1.00 1.00 H new ATOM 0 HB2 ASN A 95 116.405 0.862 -1.686 1.00 1.00 H new ATOM 0 HB3 ASN A 95 116.780 2.240 -2.702 1.00 1.00 H new ATOM 0 HD21 ASN A 95 118.091 3.506 0.874 1.00 1.00 H new ATOM 0 HD22 ASN A 95 116.426 3.634 0.299 1.00 1.00 H new ATOM 1526 N GLN A 96 113.568 1.241 -2.502 1.00 1.00 N ATOM 1527 CA GLN A 96 112.581 0.985 -3.537 1.00 1.00 C ATOM 1528 C GLN A 96 111.346 1.842 -3.313 1.00 1.00 C ATOM 1529 O GLN A 96 110.767 2.368 -4.263 1.00 1.00 O ATOM 1530 CB GLN A 96 112.181 -0.489 -3.530 1.00 1.00 C ATOM 1531 CG GLN A 96 113.343 -1.347 -4.035 1.00 1.00 C ATOM 1532 CD GLN A 96 112.950 -2.818 -3.978 1.00 1.00 C ATOM 1533 OE1 GLN A 96 112.727 -3.360 -2.896 1.00 1.00 O ATOM 1534 NE2 GLN A 96 112.843 -3.499 -5.087 1.00 1.00 N ATOM 0 H GLN A 96 113.744 0.454 -1.877 1.00 1.00 H new ATOM 0 HA GLN A 96 113.022 1.236 -4.502 1.00 1.00 H new ATOM 0 HB2 GLN A 96 111.904 -0.795 -2.521 1.00 1.00 H new ATOM 0 HB3 GLN A 96 111.305 -0.640 -4.161 1.00 1.00 H new ATOM 0 HG2 GLN A 96 113.598 -1.067 -5.057 1.00 1.00 H new ATOM 0 HG3 GLN A 96 114.230 -1.172 -3.426 1.00 1.00 H new ATOM 0 HE21 GLN A 96 113.028 -3.047 -5.983 1.00 1.00 H new ATOM 0 HE22 GLN A 96 112.574 -4.482 -5.058 1.00 1.00 H new ATOM 1543 N GLU A 97 110.940 1.980 -2.052 1.00 1.00 N ATOM 1544 CA GLU A 97 109.765 2.780 -1.743 1.00 1.00 C ATOM 1545 C GLU A 97 110.016 4.240 -2.087 1.00 1.00 C ATOM 1546 O GLU A 97 109.151 4.923 -2.633 1.00 1.00 O ATOM 1547 CB GLU A 97 109.386 2.650 -0.266 1.00 1.00 C ATOM 1548 CG GLU A 97 108.841 1.243 0.003 1.00 1.00 C ATOM 1549 CD GLU A 97 108.529 1.075 1.486 1.00 1.00 C ATOM 1550 OE1 GLU A 97 108.784 2.004 2.237 1.00 1.00 O ATOM 1551 OE2 GLU A 97 108.032 0.022 1.850 1.00 1.00 O ATOM 0 H GLU A 97 111.399 1.556 -1.245 1.00 1.00 H new ATOM 0 HA GLU A 97 108.936 2.408 -2.345 1.00 1.00 H new ATOM 0 HB2 GLU A 97 110.257 2.840 0.361 1.00 1.00 H new ATOM 0 HB3 GLU A 97 108.637 3.397 -0.005 1.00 1.00 H new ATOM 0 HG2 GLU A 97 107.940 1.075 -0.587 1.00 1.00 H new ATOM 0 HG3 GLU A 97 109.571 0.496 -0.310 1.00 1.00 H new ATOM 1558 N LEU A 98 111.215 4.709 -1.762 1.00 1.00 N ATOM 1559 CA LEU A 98 111.608 6.083 -2.025 1.00 1.00 C ATOM 1560 C LEU A 98 111.654 6.346 -3.529 1.00 1.00 C ATOM 1561 O LEU A 98 111.242 7.406 -3.998 1.00 1.00 O ATOM 1562 CB LEU A 98 112.986 6.308 -1.397 1.00 1.00 C ATOM 1563 CG LEU A 98 113.017 7.615 -0.607 1.00 1.00 C ATOM 1564 CD1 LEU A 98 112.093 7.514 0.610 1.00 1.00 C ATOM 1565 CD2 LEU A 98 114.444 7.854 -0.125 1.00 1.00 C ATOM 0 H LEU A 98 111.938 4.148 -1.311 1.00 1.00 H new ATOM 0 HA LEU A 98 110.882 6.772 -1.592 1.00 1.00 H new ATOM 0 HB2 LEU A 98 113.231 5.474 -0.739 1.00 1.00 H new ATOM 0 HB3 LEU A 98 113.747 6.332 -2.177 1.00 1.00 H new ATOM 0 HG LEU A 98 112.683 8.435 -1.243 1.00 1.00 H new ATOM 0 HD11 LEU A 98 112.122 8.450 1.167 1.00 1.00 H new ATOM 0 HD12 LEU A 98 111.073 7.321 0.277 1.00 1.00 H new ATOM 0 HD13 LEU A 98 112.426 6.699 1.253 1.00 1.00 H new ATOM 0 HD21 LEU A 98 114.486 8.784 0.442 1.00 1.00 H new ATOM 0 HD22 LEU A 98 114.756 7.027 0.512 1.00 1.00 H new ATOM 0 HD23 LEU A 98 115.112 7.922 -0.984 1.00 1.00 H new ATOM 1577 N LYS A 99 112.175 5.373 -4.270 1.00 1.00 N ATOM 1578 CA LYS A 99 112.291 5.505 -5.714 1.00 1.00 C ATOM 1579 C LYS A 99 110.907 5.652 -6.315 1.00 1.00 C ATOM 1580 O LYS A 99 110.699 6.431 -7.246 1.00 1.00 O ATOM 1581 CB LYS A 99 112.989 4.267 -6.294 1.00 1.00 C ATOM 1582 CG LYS A 99 113.646 4.612 -7.635 1.00 1.00 C ATOM 1583 CD LYS A 99 114.450 3.409 -8.140 1.00 1.00 C ATOM 1584 CE LYS A 99 115.108 3.766 -9.475 1.00 1.00 C ATOM 1585 NZ LYS A 99 115.918 2.613 -9.959 1.00 1.00 N ATOM 0 H LYS A 99 112.521 4.490 -3.895 1.00 1.00 H new ATOM 0 HA LYS A 99 112.884 6.387 -5.955 1.00 1.00 H new ATOM 0 HB2 LYS A 99 113.742 3.903 -5.594 1.00 1.00 H new ATOM 0 HB3 LYS A 99 112.266 3.463 -6.431 1.00 1.00 H new ATOM 0 HG2 LYS A 99 112.884 4.885 -8.365 1.00 1.00 H new ATOM 0 HG3 LYS A 99 114.300 5.476 -7.519 1.00 1.00 H new ATOM 0 HD2 LYS A 99 115.210 3.132 -7.409 1.00 1.00 H new ATOM 0 HD3 LYS A 99 113.796 2.546 -8.263 1.00 1.00 H new ATOM 0 HE2 LYS A 99 114.345 4.022 -10.211 1.00 1.00 H new ATOM 0 HE3 LYS A 99 115.743 4.644 -9.356 1.00 1.00 H new ATOM 0 HZ1 LYS A 99 115.762 2.483 -10.979 1.00 1.00 H new ATOM 0 HZ2 LYS A 99 116.926 2.799 -9.784 1.00 1.00 H new ATOM 0 HZ3 LYS A 99 115.632 1.751 -9.452 1.00 1.00 H new ATOM 1599 N ALA A 100 109.957 4.910 -5.765 1.00 1.00 N ATOM 1600 CA ALA A 100 108.591 4.976 -6.238 1.00 1.00 C ATOM 1601 C ALA A 100 107.898 6.225 -5.711 1.00 1.00 C ATOM 1602 O ALA A 100 107.079 6.834 -6.399 1.00 1.00 O ATOM 1603 CB ALA A 100 107.830 3.752 -5.768 1.00 1.00 C ATOM 0 H ALA A 100 110.110 4.259 -4.994 1.00 1.00 H new ATOM 0 HA ALA A 100 108.606 5.012 -7.327 1.00 1.00 H new ATOM 0 HB1 ALA A 100 106.801 3.804 -6.125 1.00 1.00 H new ATOM 0 HB2 ALA A 100 108.306 2.854 -6.162 1.00 1.00 H new ATOM 0 HB3 ALA A 100 107.834 3.717 -4.679 1.00 1.00 H new ATOM 1609 N GLN A 101 108.199 6.577 -4.462 1.00 1.00 N ATOM 1610 CA GLN A 101 107.571 7.714 -3.823 1.00 1.00 C ATOM 1611 C GLN A 101 107.792 8.998 -4.588 1.00 1.00 C ATOM 1612 O GLN A 101 106.855 9.761 -4.808 1.00 1.00 O ATOM 1613 CB GLN A 101 108.117 7.867 -2.402 1.00 1.00 C ATOM 1614 CG GLN A 101 107.341 8.968 -1.688 1.00 1.00 C ATOM 1615 CD GLN A 101 107.872 9.173 -0.277 1.00 1.00 C ATOM 1616 OE1 GLN A 101 109.017 9.586 -0.096 1.00 1.00 O ATOM 1617 NE2 GLN A 101 107.104 8.904 0.741 1.00 1.00 N ATOM 0 H GLN A 101 108.876 6.085 -3.878 1.00 1.00 H new ATOM 0 HA GLN A 101 106.498 7.526 -3.801 1.00 1.00 H new ATOM 0 HB2 GLN A 101 108.022 6.927 -1.859 1.00 1.00 H new ATOM 0 HB3 GLN A 101 109.179 8.113 -2.431 1.00 1.00 H new ATOM 0 HG2 GLN A 101 107.420 9.898 -2.250 1.00 1.00 H new ATOM 0 HG3 GLN A 101 106.283 8.708 -1.649 1.00 1.00 H new ATOM 0 HE21 GLN A 101 106.155 8.562 0.588 1.00 1.00 H new ATOM 0 HE22 GLN A 101 107.452 9.036 1.691 1.00 1.00 H new ATOM 1626 N TYR A 102 109.035 9.260 -4.956 1.00 1.00 N ATOM 1627 CA TYR A 102 109.337 10.492 -5.649 1.00 1.00 C ATOM 1628 C TYR A 102 109.259 10.312 -7.151 1.00 1.00 C ATOM 1629 O TYR A 102 109.671 11.176 -7.922 1.00 1.00 O ATOM 1630 CB TYR A 102 110.719 11.037 -5.227 1.00 1.00 C ATOM 1631 CG TYR A 102 110.603 11.720 -3.866 1.00 1.00 C ATOM 1632 CD1 TYR A 102 109.743 12.821 -3.702 1.00 1.00 C ATOM 1633 CD2 TYR A 102 111.326 11.237 -2.757 1.00 1.00 C ATOM 1634 CE1 TYR A 102 109.601 13.422 -2.448 1.00 1.00 C ATOM 1635 CE2 TYR A 102 111.184 11.852 -1.506 1.00 1.00 C ATOM 1636 CZ TYR A 102 110.318 12.938 -1.352 1.00 1.00 C ATOM 1637 OH TYR A 102 110.167 13.533 -0.119 1.00 1.00 O ATOM 0 H TYR A 102 109.834 8.648 -4.789 1.00 1.00 H new ATOM 0 HA TYR A 102 108.583 11.226 -5.365 1.00 1.00 H new ATOM 0 HB2 TYR A 102 111.443 10.224 -5.177 1.00 1.00 H new ATOM 0 HB3 TYR A 102 111.085 11.744 -5.971 1.00 1.00 H new ATOM 0 HD1 TYR A 102 109.191 13.203 -4.548 1.00 1.00 H new ATOM 0 HD2 TYR A 102 111.990 10.393 -2.871 1.00 1.00 H new ATOM 0 HE1 TYR A 102 108.935 14.263 -2.326 1.00 1.00 H new ATOM 0 HE2 TYR A 102 111.745 11.486 -0.659 1.00 1.00 H new ATOM 0 HH TYR A 102 109.369 14.102 -0.126 1.00 1.00 H new ATOM 1647 N LYS A 103 108.678 9.176 -7.557 1.00 1.00 N ATOM 1648 CA LYS A 103 108.488 8.870 -8.964 1.00 1.00 C ATOM 1649 C LYS A 103 109.798 8.978 -9.703 1.00 1.00 C ATOM 1650 O LYS A 103 109.898 9.664 -10.719 1.00 1.00 O ATOM 1651 CB LYS A 103 107.456 9.818 -9.573 1.00 1.00 C ATOM 1652 CG LYS A 103 106.074 9.471 -9.012 1.00 1.00 C ATOM 1653 CD LYS A 103 105.018 10.402 -9.610 1.00 1.00 C ATOM 1654 CE LYS A 103 103.654 10.081 -8.993 1.00 1.00 C ATOM 1655 NZ LYS A 103 102.614 10.970 -9.587 1.00 1.00 N ATOM 0 H LYS A 103 108.333 8.457 -6.921 1.00 1.00 H new ATOM 0 HA LYS A 103 108.121 7.848 -9.055 1.00 1.00 H new ATOM 0 HB2 LYS A 103 107.709 10.852 -9.339 1.00 1.00 H new ATOM 0 HB3 LYS A 103 107.456 9.728 -10.659 1.00 1.00 H new ATOM 0 HG2 LYS A 103 105.829 8.434 -9.242 1.00 1.00 H new ATOM 0 HG3 LYS A 103 106.079 9.564 -7.926 1.00 1.00 H new ATOM 0 HD2 LYS A 103 105.282 11.442 -9.417 1.00 1.00 H new ATOM 0 HD3 LYS A 103 104.979 10.279 -10.692 1.00 1.00 H new ATOM 0 HE2 LYS A 103 103.399 9.036 -9.172 1.00 1.00 H new ATOM 0 HE3 LYS A 103 103.691 10.219 -7.912 1.00 1.00 H new ATOM 0 HZ1 LYS A 103 101.688 10.750 -9.167 1.00 1.00 H new ATOM 0 HZ2 LYS A 103 102.855 11.963 -9.394 1.00 1.00 H new ATOM 0 HZ3 LYS A 103 102.572 10.817 -10.615 1.00 1.00 H new ATOM 1669 N VAL A 104 110.805 8.310 -9.183 1.00 1.00 N ATOM 1670 CA VAL A 104 112.107 8.347 -9.795 1.00 1.00 C ATOM 1671 C VAL A 104 112.231 7.229 -10.822 1.00 1.00 C ATOM 1672 O VAL A 104 112.036 6.056 -10.501 1.00 1.00 O ATOM 1673 CB VAL A 104 113.165 8.200 -8.715 1.00 1.00 C ATOM 1674 CG1 VAL A 104 114.549 8.299 -9.346 1.00 1.00 C ATOM 1675 CG2 VAL A 104 112.985 9.316 -7.684 1.00 1.00 C ATOM 0 H VAL A 104 110.744 7.738 -8.341 1.00 1.00 H new ATOM 0 HA VAL A 104 112.248 9.298 -10.308 1.00 1.00 H new ATOM 0 HB VAL A 104 113.063 7.232 -8.225 1.00 1.00 H new ATOM 0 HG11 VAL A 104 115.310 8.194 -8.573 1.00 1.00 H new ATOM 0 HG12 VAL A 104 114.670 7.506 -10.084 1.00 1.00 H new ATOM 0 HG13 VAL A 104 114.658 9.268 -9.833 1.00 1.00 H new ATOM 0 HG21 VAL A 104 113.741 9.217 -6.905 1.00 1.00 H new ATOM 0 HG22 VAL A 104 113.092 10.284 -8.173 1.00 1.00 H new ATOM 0 HG23 VAL A 104 111.993 9.243 -7.238 1.00 1.00 H new ATOM 1685 N THR A 105 112.535 7.604 -12.062 1.00 1.00 N ATOM 1686 CA THR A 105 112.659 6.639 -13.140 1.00 1.00 C ATOM 1687 C THR A 105 114.059 6.645 -13.730 1.00 1.00 C ATOM 1688 O THR A 105 114.680 5.598 -13.904 1.00 1.00 O ATOM 1689 CB THR A 105 111.646 6.967 -14.237 1.00 1.00 C ATOM 1690 OG1 THR A 105 111.636 8.368 -14.467 1.00 1.00 O ATOM 1691 CG2 THR A 105 110.249 6.512 -13.808 1.00 1.00 C ATOM 0 H THR A 105 112.699 8.571 -12.341 1.00 1.00 H new ATOM 0 HA THR A 105 112.464 5.647 -12.732 1.00 1.00 H new ATOM 0 HB THR A 105 111.928 6.447 -15.153 1.00 1.00 H new ATOM 0 HG1 THR A 105 110.988 8.579 -15.171 1.00 1.00 H new ATOM 0 HG21 THR A 105 109.532 6.749 -14.594 1.00 1.00 H new ATOM 0 HG22 THR A 105 110.254 5.436 -13.634 1.00 1.00 H new ATOM 0 HG23 THR A 105 109.964 7.027 -12.890 1.00 1.00 H new ATOM 1699 N GLY A 106 114.538 7.841 -14.053 1.00 1.00 N ATOM 1700 CA GLY A 106 115.858 7.990 -14.647 1.00 1.00 C ATOM 1701 C GLY A 106 116.902 8.376 -13.610 1.00 1.00 C ATOM 1702 O GLY A 106 116.615 9.094 -12.651 1.00 1.00 O ATOM 0 H GLY A 106 114.034 8.717 -13.914 1.00 1.00 H new ATOM 0 HA2 GLY A 106 116.149 7.055 -15.126 1.00 1.00 H new ATOM 0 HA3 GLY A 106 115.822 8.750 -15.427 1.00 1.00 H new ATOM 1706 N PHE A 107 118.119 7.895 -13.824 1.00 1.00 N ATOM 1707 CA PHE A 107 119.234 8.180 -12.930 1.00 1.00 C ATOM 1708 C PHE A 107 120.387 8.801 -13.728 1.00 1.00 C ATOM 1709 O PHE A 107 120.550 8.491 -14.909 1.00 1.00 O ATOM 1710 CB PHE A 107 119.707 6.880 -12.280 1.00 1.00 C ATOM 1711 CG PHE A 107 119.484 5.733 -13.236 1.00 1.00 C ATOM 1712 CD1 PHE A 107 120.400 5.483 -14.266 1.00 1.00 C ATOM 1713 CD2 PHE A 107 118.355 4.919 -13.092 1.00 1.00 C ATOM 1714 CE1 PHE A 107 120.185 4.418 -15.151 1.00 1.00 C ATOM 1715 CE2 PHE A 107 118.140 3.855 -13.976 1.00 1.00 C ATOM 1716 CZ PHE A 107 119.055 3.604 -15.006 1.00 1.00 C ATOM 0 H PHE A 107 118.361 7.300 -14.617 1.00 1.00 H new ATOM 0 HA PHE A 107 118.911 8.879 -12.158 1.00 1.00 H new ATOM 0 HB2 PHE A 107 120.763 6.953 -12.022 1.00 1.00 H new ATOM 0 HB3 PHE A 107 119.163 6.705 -11.352 1.00 1.00 H new ATOM 0 HD1 PHE A 107 121.272 6.111 -14.378 1.00 1.00 H new ATOM 0 HD2 PHE A 107 117.649 5.112 -12.298 1.00 1.00 H new ATOM 0 HE1 PHE A 107 120.891 4.225 -15.945 1.00 1.00 H new ATOM 0 HE2 PHE A 107 117.268 3.228 -13.864 1.00 1.00 H new ATOM 0 HZ PHE A 107 118.889 2.783 -15.688 1.00 1.00 H new ATOM 1726 N PRO A 108 121.195 9.651 -13.133 1.00 1.00 N ATOM 1727 CA PRO A 108 121.065 10.079 -11.707 1.00 1.00 C ATOM 1728 C PRO A 108 119.981 11.125 -11.520 1.00 1.00 C ATOM 1729 O PRO A 108 119.766 11.963 -12.397 1.00 1.00 O ATOM 1730 CB PRO A 108 122.425 10.684 -11.401 1.00 1.00 C ATOM 1731 CG PRO A 108 122.873 11.254 -12.705 1.00 1.00 C ATOM 1732 CD PRO A 108 122.343 10.309 -13.783 1.00 1.00 C ATOM 0 HA PRO A 108 120.788 9.250 -11.055 1.00 1.00 H new ATOM 0 HB2 PRO A 108 122.355 11.454 -10.633 1.00 1.00 H new ATOM 0 HB3 PRO A 108 123.123 9.931 -11.035 1.00 1.00 H new ATOM 0 HG2 PRO A 108 122.483 12.262 -12.844 1.00 1.00 H new ATOM 0 HG3 PRO A 108 123.960 11.324 -12.747 1.00 1.00 H new ATOM 0 HD2 PRO A 108 122.040 10.852 -14.678 1.00 1.00 H new ATOM 0 HD3 PRO A 108 123.099 9.586 -14.089 1.00 1.00 H new ATOM 1740 N GLU A 109 119.313 11.089 -10.377 1.00 1.00 N ATOM 1741 CA GLU A 109 118.269 12.058 -10.099 1.00 1.00 C ATOM 1742 C GLU A 109 118.393 12.549 -8.667 1.00 1.00 C ATOM 1743 O GLU A 109 118.391 11.753 -7.724 1.00 1.00 O ATOM 1744 CB GLU A 109 116.892 11.432 -10.325 1.00 1.00 C ATOM 1745 CG GLU A 109 115.814 12.497 -10.125 1.00 1.00 C ATOM 1746 CD GLU A 109 114.442 11.931 -10.475 1.00 1.00 C ATOM 1747 OE1 GLU A 109 114.396 10.873 -11.080 1.00 1.00 O ATOM 1748 OE2 GLU A 109 113.458 12.564 -10.131 1.00 1.00 O ATOM 0 H GLU A 109 119.474 10.407 -9.636 1.00 1.00 H new ATOM 0 HA GLU A 109 118.381 12.904 -10.777 1.00 1.00 H new ATOM 0 HB2 GLU A 109 116.829 11.018 -11.332 1.00 1.00 H new ATOM 0 HB3 GLU A 109 116.737 10.606 -9.631 1.00 1.00 H new ATOM 0 HG2 GLU A 109 115.820 12.841 -9.091 1.00 1.00 H new ATOM 0 HG3 GLU A 109 116.028 13.363 -10.751 1.00 1.00 H new ATOM 1755 N LEU A 110 118.490 13.861 -8.500 1.00 1.00 N ATOM 1756 CA LEU A 110 118.600 14.468 -7.190 1.00 1.00 C ATOM 1757 C LEU A 110 117.328 15.249 -6.936 1.00 1.00 C ATOM 1758 O LEU A 110 116.964 16.144 -7.701 1.00 1.00 O ATOM 1759 CB LEU A 110 119.820 15.403 -7.157 1.00 1.00 C ATOM 1760 CG LEU A 110 120.625 15.245 -5.852 1.00 1.00 C ATOM 1761 CD1 LEU A 110 122.005 15.885 -6.030 1.00 1.00 C ATOM 1762 CD2 LEU A 110 119.912 15.949 -4.695 1.00 1.00 C ATOM 0 H LEU A 110 118.494 14.529 -9.270 1.00 1.00 H new ATOM 0 HA LEU A 110 118.732 13.709 -6.419 1.00 1.00 H new ATOM 0 HB2 LEU A 110 120.464 15.190 -8.010 1.00 1.00 H new ATOM 0 HB3 LEU A 110 119.489 16.437 -7.257 1.00 1.00 H new ATOM 0 HG LEU A 110 120.719 14.182 -5.628 1.00 1.00 H new ATOM 0 HD11 LEU A 110 122.578 15.776 -5.109 1.00 1.00 H new ATOM 0 HD12 LEU A 110 122.532 15.392 -6.846 1.00 1.00 H new ATOM 0 HD13 LEU A 110 121.888 16.944 -6.261 1.00 1.00 H new ATOM 0 HD21 LEU A 110 120.494 15.828 -3.781 1.00 1.00 H new ATOM 0 HD22 LEU A 110 119.810 17.010 -4.922 1.00 1.00 H new ATOM 0 HD23 LEU A 110 118.923 15.511 -4.557 1.00 1.00 H new ATOM 1774 N VAL A 111 116.647 14.873 -5.877 1.00 1.00 N ATOM 1775 CA VAL A 111 115.388 15.497 -5.517 1.00 1.00 C ATOM 1776 C VAL A 111 115.500 16.216 -4.186 1.00 1.00 C ATOM 1777 O VAL A 111 115.972 15.644 -3.204 1.00 1.00 O ATOM 1778 CB VAL A 111 114.306 14.424 -5.430 1.00 1.00 C ATOM 1779 CG1 VAL A 111 113.901 13.988 -6.836 1.00 1.00 C ATOM 1780 CG2 VAL A 111 114.869 13.232 -4.688 1.00 1.00 C ATOM 0 H VAL A 111 116.945 14.132 -5.243 1.00 1.00 H new ATOM 0 HA VAL A 111 115.129 16.230 -6.281 1.00 1.00 H new ATOM 0 HB VAL A 111 113.434 14.820 -4.909 1.00 1.00 H new ATOM 0 HG11 VAL A 111 113.128 13.222 -6.771 1.00 1.00 H new ATOM 0 HG12 VAL A 111 113.515 14.846 -7.386 1.00 1.00 H new ATOM 0 HG13 VAL A 111 114.770 13.584 -7.356 1.00 1.00 H new ATOM 0 HG21 VAL A 111 114.108 12.455 -4.617 1.00 1.00 H new ATOM 0 HG22 VAL A 111 115.734 12.844 -5.226 1.00 1.00 H new ATOM 0 HG23 VAL A 111 115.171 13.537 -3.686 1.00 1.00 H new ATOM 1790 N PHE A 112 115.069 17.458 -4.152 1.00 1.00 N ATOM 1791 CA PHE A 112 115.133 18.236 -2.932 1.00 1.00 C ATOM 1792 C PHE A 112 113.772 18.234 -2.248 1.00 1.00 C ATOM 1793 O PHE A 112 112.758 18.565 -2.859 1.00 1.00 O ATOM 1794 CB PHE A 112 115.584 19.658 -3.266 1.00 1.00 C ATOM 1795 CG PHE A 112 116.937 19.579 -3.940 1.00 1.00 C ATOM 1796 CD1 PHE A 112 118.103 19.476 -3.167 1.00 1.00 C ATOM 1797 CD2 PHE A 112 117.024 19.591 -5.335 1.00 1.00 C ATOM 1798 CE1 PHE A 112 119.352 19.388 -3.796 1.00 1.00 C ATOM 1799 CE2 PHE A 112 118.271 19.499 -5.965 1.00 1.00 C ATOM 1800 CZ PHE A 112 119.436 19.397 -5.194 1.00 1.00 C ATOM 0 H PHE A 112 114.671 17.951 -4.952 1.00 1.00 H new ATOM 0 HA PHE A 112 115.855 17.796 -2.244 1.00 1.00 H new ATOM 0 HB2 PHE A 112 114.860 20.142 -3.922 1.00 1.00 H new ATOM 0 HB3 PHE A 112 115.645 20.260 -2.359 1.00 1.00 H new ATOM 0 HD1 PHE A 112 118.038 19.465 -2.089 1.00 1.00 H new ATOM 0 HD2 PHE A 112 116.126 19.672 -5.929 1.00 1.00 H new ATOM 0 HE1 PHE A 112 120.251 19.313 -3.202 1.00 1.00 H new ATOM 0 HE2 PHE A 112 118.335 19.507 -7.043 1.00 1.00 H new ATOM 0 HZ PHE A 112 120.399 19.325 -5.678 1.00 1.00 H new ATOM 1810 N ILE A 113 113.762 17.839 -0.973 1.00 1.00 N ATOM 1811 CA ILE A 113 112.530 17.780 -0.189 1.00 1.00 C ATOM 1812 C ILE A 113 112.713 18.468 1.151 1.00 1.00 C ATOM 1813 O ILE A 113 113.818 18.540 1.685 1.00 1.00 O ATOM 1814 CB ILE A 113 112.083 16.326 0.027 1.00 1.00 C ATOM 1815 CG1 ILE A 113 113.201 15.545 0.715 1.00 1.00 C ATOM 1816 CG2 ILE A 113 111.735 15.680 -1.319 1.00 1.00 C ATOM 1817 CD1 ILE A 113 112.718 14.131 1.051 1.00 1.00 C ATOM 0 H ILE A 113 114.597 17.555 -0.461 1.00 1.00 H new ATOM 0 HA ILE A 113 111.755 18.302 -0.750 1.00 1.00 H new ATOM 0 HB ILE A 113 111.196 16.311 0.660 1.00 1.00 H new ATOM 0 HG12 ILE A 113 114.075 15.495 0.065 1.00 1.00 H new ATOM 0 HG13 ILE A 113 113.509 16.059 1.625 1.00 1.00 H new ATOM 0 HG21 ILE A 113 111.419 14.649 -1.157 1.00 1.00 H new ATOM 0 HG22 ILE A 113 110.926 16.237 -1.792 1.00 1.00 H new ATOM 0 HG23 ILE A 113 112.612 15.693 -1.966 1.00 1.00 H new ATOM 0 HD11 ILE A 113 113.520 13.579 1.541 1.00 1.00 H new ATOM 0 HD12 ILE A 113 111.857 14.189 1.717 1.00 1.00 H new ATOM 0 HD13 ILE A 113 112.432 13.617 0.134 1.00 1.00 H new ATOM 1829 N ASP A 114 111.600 18.918 1.713 1.00 1.00 N ATOM 1830 CA ASP A 114 111.617 19.539 3.018 1.00 1.00 C ATOM 1831 C ASP A 114 111.384 18.442 4.041 1.00 1.00 C ATOM 1832 O ASP A 114 111.307 17.265 3.692 1.00 1.00 O ATOM 1833 CB ASP A 114 110.525 20.607 3.130 1.00 1.00 C ATOM 1834 CG ASP A 114 109.151 19.950 3.145 1.00 1.00 C ATOM 1835 OD1 ASP A 114 109.071 18.779 2.807 1.00 1.00 O ATOM 1836 OD2 ASP A 114 108.198 20.625 3.496 1.00 1.00 O ATOM 0 H ASP A 114 110.677 18.862 1.281 1.00 1.00 H new ATOM 0 HA ASP A 114 112.573 20.034 3.188 1.00 1.00 H new ATOM 0 HB2 ASP A 114 110.668 21.190 4.040 1.00 1.00 H new ATOM 0 HB3 ASP A 114 110.596 21.300 2.292 1.00 1.00 H new ATOM 1841 N ALA A 115 111.302 18.818 5.297 1.00 1.00 N ATOM 1842 CA ALA A 115 111.114 17.854 6.378 1.00 1.00 C ATOM 1843 C ALA A 115 109.729 17.206 6.347 1.00 1.00 C ATOM 1844 O ALA A 115 109.502 16.200 7.019 1.00 1.00 O ATOM 1845 CB ALA A 115 111.306 18.559 7.718 1.00 1.00 C ATOM 0 H ALA A 115 111.362 19.789 5.605 1.00 1.00 H new ATOM 0 HA ALA A 115 111.852 17.063 6.245 1.00 1.00 H new ATOM 0 HB1 ALA A 115 111.167 17.844 8.529 1.00 1.00 H new ATOM 0 HB2 ALA A 115 112.312 18.975 7.770 1.00 1.00 H new ATOM 0 HB3 ALA A 115 110.576 19.363 7.814 1.00 1.00 H new ATOM 1851 N GLU A 116 108.811 17.758 5.558 1.00 1.00 N ATOM 1852 CA GLU A 116 107.469 17.187 5.447 1.00 1.00 C ATOM 1853 C GLU A 116 107.379 16.316 4.199 1.00 1.00 C ATOM 1854 O GLU A 116 106.332 15.739 3.913 1.00 1.00 O ATOM 1855 CB GLU A 116 106.421 18.298 5.372 1.00 1.00 C ATOM 1856 CG GLU A 116 106.335 19.009 6.721 1.00 1.00 C ATOM 1857 CD GLU A 116 105.383 20.195 6.619 1.00 1.00 C ATOM 1858 OE1 GLU A 116 104.864 20.422 5.539 1.00 1.00 O ATOM 1859 OE2 GLU A 116 105.190 20.862 7.623 1.00 1.00 O ATOM 0 H GLU A 116 108.968 18.591 4.991 1.00 1.00 H new ATOM 0 HA GLU A 116 107.276 16.578 6.330 1.00 1.00 H new ATOM 0 HB2 GLU A 116 106.685 19.010 4.590 1.00 1.00 H new ATOM 0 HB3 GLU A 116 105.450 17.879 5.107 1.00 1.00 H new ATOM 0 HG2 GLU A 116 105.986 18.316 7.486 1.00 1.00 H new ATOM 0 HG3 GLU A 116 107.324 19.350 7.027 1.00 1.00 H new ATOM 1866 N GLY A 117 108.482 16.207 3.470 1.00 1.00 N ATOM 1867 CA GLY A 117 108.501 15.382 2.273 1.00 1.00 C ATOM 1868 C GLY A 117 107.984 16.137 1.057 1.00 1.00 C ATOM 1869 O GLY A 117 107.681 15.525 0.033 1.00 1.00 O ATOM 0 H GLY A 117 109.364 16.673 3.684 1.00 1.00 H new ATOM 0 HA2 GLY A 117 109.519 15.041 2.083 1.00 1.00 H new ATOM 0 HA3 GLY A 117 107.892 14.493 2.435 1.00 1.00 H new ATOM 1873 N LYS A 118 107.888 17.460 1.148 1.00 1.00 N ATOM 1874 CA LYS A 118 107.416 18.238 0.011 1.00 1.00 C ATOM 1875 C LYS A 118 108.585 18.547 -0.904 1.00 1.00 C ATOM 1876 O LYS A 118 109.639 18.949 -0.434 1.00 1.00 O ATOM 1877 CB LYS A 118 106.730 19.524 0.477 1.00 1.00 C ATOM 1878 CG LYS A 118 105.286 19.194 0.861 1.00 1.00 C ATOM 1879 CD LYS A 118 104.588 20.442 1.417 1.00 1.00 C ATOM 1880 CE LYS A 118 103.142 20.093 1.792 1.00 1.00 C ATOM 1881 NZ LYS A 118 102.480 21.279 2.407 1.00 1.00 N ATOM 0 H LYS A 118 108.125 18.004 1.977 1.00 1.00 H new ATOM 0 HA LYS A 118 106.677 17.655 -0.539 1.00 1.00 H new ATOM 0 HB2 LYS A 118 107.261 19.949 1.329 1.00 1.00 H new ATOM 0 HB3 LYS A 118 106.749 20.272 -0.316 1.00 1.00 H new ATOM 0 HG2 LYS A 118 104.746 18.824 -0.010 1.00 1.00 H new ATOM 0 HG3 LYS A 118 105.273 18.398 1.606 1.00 1.00 H new ATOM 0 HD2 LYS A 118 105.123 20.812 2.292 1.00 1.00 H new ATOM 0 HD3 LYS A 118 104.600 21.240 0.675 1.00 1.00 H new ATOM 0 HE2 LYS A 118 102.593 19.777 0.905 1.00 1.00 H new ATOM 0 HE3 LYS A 118 103.129 19.255 2.490 1.00 1.00 H new ATOM 0 HZ1 LYS A 118 101.500 21.038 2.659 1.00 1.00 H new ATOM 0 HZ2 LYS A 118 102.999 21.561 3.263 1.00 1.00 H new ATOM 0 HZ3 LYS A 118 102.478 22.067 1.728 1.00 1.00 H new ATOM 1895 N GLN A 119 108.404 18.341 -2.200 1.00 1.00 N ATOM 1896 CA GLN A 119 109.466 18.570 -3.165 1.00 1.00 C ATOM 1897 C GLN A 119 109.668 20.055 -3.459 1.00 1.00 C ATOM 1898 O GLN A 119 108.733 20.752 -3.853 1.00 1.00 O ATOM 1899 CB GLN A 119 109.117 17.814 -4.452 1.00 1.00 C ATOM 1900 CG GLN A 119 109.706 18.523 -5.667 1.00 1.00 C ATOM 1901 CD GLN A 119 109.656 17.592 -6.874 1.00 1.00 C ATOM 1902 OE1 GLN A 119 109.558 16.375 -6.715 1.00 1.00 O ATOM 1903 NE2 GLN A 119 109.719 18.092 -8.077 1.00 1.00 N ATOM 0 H GLN A 119 107.528 18.014 -2.608 1.00 1.00 H new ATOM 0 HA GLN A 119 110.404 18.205 -2.747 1.00 1.00 H new ATOM 0 HB2 GLN A 119 109.501 16.795 -4.397 1.00 1.00 H new ATOM 0 HB3 GLN A 119 108.034 17.742 -4.556 1.00 1.00 H new ATOM 0 HG2 GLN A 119 109.147 19.435 -5.875 1.00 1.00 H new ATOM 0 HG3 GLN A 119 110.735 18.819 -5.465 1.00 1.00 H new ATOM 0 HE21 GLN A 119 109.800 19.100 -8.207 1.00 1.00 H new ATOM 0 HE22 GLN A 119 109.687 17.475 -8.888 1.00 1.00 H new ATOM 1912 N LEU A 120 110.901 20.530 -3.283 1.00 1.00 N ATOM 1913 CA LEU A 120 111.206 21.931 -3.560 1.00 1.00 C ATOM 1914 C LEU A 120 111.780 22.086 -4.963 1.00 1.00 C ATOM 1915 O LEU A 120 111.597 23.117 -5.603 1.00 1.00 O ATOM 1916 CB LEU A 120 112.227 22.489 -2.556 1.00 1.00 C ATOM 1917 CG LEU A 120 111.720 22.285 -1.125 1.00 1.00 C ATOM 1918 CD1 LEU A 120 112.172 20.939 -0.582 1.00 1.00 C ATOM 1919 CD2 LEU A 120 112.266 23.377 -0.212 1.00 1.00 C ATOM 0 H LEU A 120 111.692 19.975 -2.955 1.00 1.00 H new ATOM 0 HA LEU A 120 110.272 22.486 -3.473 1.00 1.00 H new ATOM 0 HB2 LEU A 120 113.187 21.989 -2.685 1.00 1.00 H new ATOM 0 HB3 LEU A 120 112.392 23.550 -2.744 1.00 1.00 H new ATOM 0 HG LEU A 120 110.631 22.325 -1.149 1.00 1.00 H new ATOM 0 HD11 LEU A 120 111.801 20.814 0.435 1.00 1.00 H new ATOM 0 HD12 LEU A 120 111.778 20.142 -1.212 1.00 1.00 H new ATOM 0 HD13 LEU A 120 113.261 20.895 -0.579 1.00 1.00 H new ATOM 0 HD21 LEU A 120 111.898 23.221 0.802 1.00 1.00 H new ATOM 0 HD22 LEU A 120 113.355 23.341 -0.213 1.00 1.00 H new ATOM 0 HD23 LEU A 120 111.935 24.351 -0.572 1.00 1.00 H new ATOM 1931 N ALA A 121 112.459 21.038 -5.444 1.00 1.00 N ATOM 1932 CA ALA A 121 113.042 21.050 -6.783 1.00 1.00 C ATOM 1933 C ALA A 121 113.691 19.705 -7.103 1.00 1.00 C ATOM 1934 O ALA A 121 113.893 18.882 -6.212 1.00 1.00 O ATOM 1935 CB ALA A 121 114.104 22.142 -6.897 1.00 1.00 C ATOM 0 H ALA A 121 112.616 20.175 -4.924 1.00 1.00 H new ATOM 0 HA ALA A 121 112.236 21.245 -7.490 1.00 1.00 H new ATOM 0 HB1 ALA A 121 114.527 22.135 -7.902 1.00 1.00 H new ATOM 0 HB2 ALA A 121 113.650 23.113 -6.701 1.00 1.00 H new ATOM 0 HB3 ALA A 121 114.895 21.958 -6.170 1.00 1.00 H new ATOM 1941 N ARG A 122 114.027 19.491 -8.369 1.00 1.00 N ATOM 1942 CA ARG A 122 114.670 18.239 -8.767 1.00 1.00 C ATOM 1943 C ARG A 122 115.621 18.466 -9.937 1.00 1.00 C ATOM 1944 O ARG A 122 115.332 19.239 -10.847 1.00 1.00 O ATOM 1945 CB ARG A 122 113.618 17.187 -9.141 1.00 1.00 C ATOM 1946 CG ARG A 122 112.782 17.656 -10.335 1.00 1.00 C ATOM 1947 CD ARG A 122 111.767 16.562 -10.685 1.00 1.00 C ATOM 1948 NE ARG A 122 110.975 16.946 -11.849 1.00 1.00 N ATOM 1949 CZ ARG A 122 110.083 16.113 -12.376 1.00 1.00 C ATOM 1950 NH1 ARG A 122 109.890 14.935 -11.845 1.00 1.00 N ATOM 1951 NH2 ARG A 122 109.394 16.473 -13.425 1.00 1.00 N ATOM 0 H ARG A 122 113.870 20.154 -9.128 1.00 1.00 H new ATOM 0 HA ARG A 122 115.247 17.872 -7.918 1.00 1.00 H new ATOM 0 HB2 ARG A 122 114.109 16.245 -9.383 1.00 1.00 H new ATOM 0 HB3 ARG A 122 112.967 16.997 -8.287 1.00 1.00 H new ATOM 0 HG2 ARG A 122 112.267 18.586 -10.094 1.00 1.00 H new ATOM 0 HG3 ARG A 122 113.426 17.861 -11.190 1.00 1.00 H new ATOM 0 HD2 ARG A 122 112.288 15.626 -10.886 1.00 1.00 H new ATOM 0 HD3 ARG A 122 111.109 16.384 -9.834 1.00 1.00 H new ATOM 0 HE ARG A 122 111.108 17.868 -12.265 1.00 1.00 H new ATOM 0 HH11 ARG A 122 110.424 14.652 -11.024 1.00 1.00 H new ATOM 0 HH12 ARG A 122 109.205 14.298 -12.252 1.00 1.00 H new ATOM 0 HH21 ARG A 122 109.540 17.393 -13.840 1.00 1.00 H new ATOM 0 HH22 ARG A 122 108.710 15.834 -13.830 1.00 1.00 H new ATOM 1965 N MET A 123 116.755 17.763 -9.907 1.00 1.00 N ATOM 1966 CA MET A 123 117.737 17.875 -10.974 1.00 1.00 C ATOM 1967 C MET A 123 118.399 16.533 -11.272 1.00 1.00 C ATOM 1968 O MET A 123 118.436 15.635 -10.430 1.00 1.00 O ATOM 1969 CB MET A 123 118.843 18.857 -10.594 1.00 1.00 C ATOM 1970 CG MET A 123 118.269 20.261 -10.384 1.00 1.00 C ATOM 1971 SD MET A 123 119.617 21.463 -10.450 1.00 1.00 S ATOM 1972 CE MET A 123 120.185 21.263 -8.748 1.00 1.00 C ATOM 0 H MET A 123 117.010 17.117 -9.160 1.00 1.00 H new ATOM 0 HA MET A 123 117.197 18.225 -11.854 1.00 1.00 H new ATOM 0 HB2 MET A 123 119.338 18.521 -9.683 1.00 1.00 H new ATOM 0 HB3 MET A 123 119.600 18.881 -11.378 1.00 1.00 H new ATOM 0 HG2 MET A 123 117.528 20.484 -11.152 1.00 1.00 H new ATOM 0 HG3 MET A 123 117.759 20.319 -9.422 1.00 1.00 H new ATOM 0 HE1 MET A 123 121.235 21.547 -8.679 1.00 1.00 H new ATOM 0 HE2 MET A 123 119.593 21.899 -8.090 1.00 1.00 H new ATOM 0 HE3 MET A 123 120.071 20.222 -8.446 1.00 1.00 H new ATOM 1982 N GLY A 124 118.932 16.426 -12.481 1.00 1.00 N ATOM 1983 CA GLY A 124 119.614 15.209 -12.909 1.00 1.00 C ATOM 1984 C GLY A 124 121.063 15.516 -13.255 1.00 1.00 C ATOM 1985 O GLY A 124 121.679 16.391 -12.647 1.00 1.00 O ATOM 0 H GLY A 124 118.906 17.165 -13.183 1.00 1.00 H new ATOM 0 HA2 GLY A 124 119.572 14.461 -12.117 1.00 1.00 H new ATOM 0 HA3 GLY A 124 119.107 14.784 -13.776 1.00 1.00 H new ATOM 1989 N PHE A 125 121.596 14.821 -14.252 1.00 1.00 N ATOM 1990 CA PHE A 125 122.962 15.075 -14.683 1.00 1.00 C ATOM 1991 C PHE A 125 122.952 16.260 -15.623 1.00 1.00 C ATOM 1992 O PHE A 125 122.185 16.281 -16.586 1.00 1.00 O ATOM 1993 CB PHE A 125 123.547 13.859 -15.407 1.00 1.00 C ATOM 1994 CG PHE A 125 124.785 14.278 -16.176 1.00 1.00 C ATOM 1995 CD1 PHE A 125 125.977 14.557 -15.495 1.00 1.00 C ATOM 1996 CD2 PHE A 125 124.737 14.391 -17.572 1.00 1.00 C ATOM 1997 CE1 PHE A 125 127.117 14.949 -16.209 1.00 1.00 C ATOM 1998 CE2 PHE A 125 125.877 14.783 -18.285 1.00 1.00 C ATOM 1999 CZ PHE A 125 127.066 15.062 -17.605 1.00 1.00 C ATOM 0 H PHE A 125 121.111 14.088 -14.770 1.00 1.00 H new ATOM 0 HA PHE A 125 123.580 15.278 -13.808 1.00 1.00 H new ATOM 0 HB2 PHE A 125 123.799 13.080 -14.687 1.00 1.00 H new ATOM 0 HB3 PHE A 125 122.808 13.437 -16.088 1.00 1.00 H new ATOM 0 HD1 PHE A 125 126.017 14.470 -14.419 1.00 1.00 H new ATOM 0 HD2 PHE A 125 123.819 14.175 -18.099 1.00 1.00 H new ATOM 0 HE1 PHE A 125 128.036 15.164 -15.683 1.00 1.00 H new ATOM 0 HE2 PHE A 125 125.837 14.870 -19.361 1.00 1.00 H new ATOM 0 HZ PHE A 125 127.945 15.364 -18.155 1.00 1.00 H new ATOM 2009 N GLU A 126 123.802 17.239 -15.362 1.00 1.00 N ATOM 2010 CA GLU A 126 123.864 18.413 -16.209 1.00 1.00 C ATOM 2011 C GLU A 126 125.307 18.904 -16.310 1.00 1.00 C ATOM 2012 O GLU A 126 126.028 18.900 -15.315 1.00 1.00 O ATOM 2013 CB GLU A 126 122.981 19.513 -15.623 1.00 1.00 C ATOM 2014 CG GLU A 126 121.597 18.939 -15.310 1.00 1.00 C ATOM 2015 CD GLU A 126 120.612 20.070 -15.048 1.00 1.00 C ATOM 2016 OE1 GLU A 126 120.651 21.044 -15.782 1.00 1.00 O ATOM 2017 OE2 GLU A 126 119.832 19.944 -14.119 1.00 1.00 O ATOM 0 H GLU A 126 124.453 17.243 -14.577 1.00 1.00 H new ATOM 0 HA GLU A 126 123.506 18.157 -17.206 1.00 1.00 H new ATOM 0 HB2 GLU A 126 123.434 19.914 -14.717 1.00 1.00 H new ATOM 0 HB3 GLU A 126 122.893 20.339 -16.329 1.00 1.00 H new ATOM 0 HG2 GLU A 126 121.250 18.329 -16.144 1.00 1.00 H new ATOM 0 HG3 GLU A 126 121.653 18.286 -14.439 1.00 1.00 H new ATOM 2024 N PRO A 127 125.746 19.327 -17.468 1.00 1.00 N ATOM 2025 CA PRO A 127 127.135 19.823 -17.655 1.00 1.00 C ATOM 2026 C PRO A 127 127.332 21.210 -17.064 1.00 1.00 C ATOM 2027 O PRO A 127 126.372 21.963 -16.880 1.00 1.00 O ATOM 2028 CB PRO A 127 127.300 19.855 -19.169 1.00 1.00 C ATOM 2029 CG PRO A 127 125.932 20.138 -19.669 1.00 1.00 C ATOM 2030 CD PRO A 127 124.987 19.390 -18.732 1.00 1.00 C ATOM 0 HA PRO A 127 127.867 19.192 -17.151 1.00 1.00 H new ATOM 0 HB2 PRO A 127 128.006 20.626 -19.478 1.00 1.00 H new ATOM 0 HB3 PRO A 127 127.677 18.906 -19.550 1.00 1.00 H new ATOM 0 HG2 PRO A 127 125.726 21.208 -19.661 1.00 1.00 H new ATOM 0 HG3 PRO A 127 125.813 19.798 -20.698 1.00 1.00 H new ATOM 0 HD2 PRO A 127 124.041 19.918 -18.608 1.00 1.00 H new ATOM 0 HD3 PRO A 127 124.750 18.395 -19.109 1.00 1.00 H new ATOM 2038 N GLY A 128 128.584 21.535 -16.776 1.00 1.00 N ATOM 2039 CA GLY A 128 128.903 22.838 -16.209 1.00 1.00 C ATOM 2040 C GLY A 128 129.757 22.711 -14.966 1.00 1.00 C ATOM 2041 O GLY A 128 130.460 23.659 -14.616 1.00 1.00 O ATOM 0 H GLY A 128 129.387 20.923 -16.923 1.00 1.00 H new ATOM 0 HA2 GLY A 128 129.427 23.440 -16.951 1.00 1.00 H new ATOM 0 HA3 GLY A 128 127.981 23.365 -15.965 1.00 1.00 H new ATOM 2045 N GLY A 129 129.743 21.565 -14.297 1.00 1.00 N ATOM 2046 CA GLY A 129 130.571 21.398 -13.119 1.00 1.00 C ATOM 2047 C GLY A 129 129.824 21.697 -11.817 1.00 1.00 C ATOM 2048 O GLY A 129 128.627 21.977 -11.815 1.00 1.00 O ATOM 0 H GLY A 129 129.177 20.754 -14.547 1.00 1.00 H new ATOM 0 HA2 GLY A 129 130.948 20.376 -13.089 1.00 1.00 H new ATOM 0 HA3 GLY A 129 131.437 22.056 -13.194 1.00 1.00 H new ATOM 2052 N GLY A 130 130.545 21.543 -10.711 1.00 1.00 N ATOM 2053 CA GLY A 130 129.959 21.702 -9.380 1.00 1.00 C ATOM 2054 C GLY A 130 129.478 23.116 -9.062 1.00 1.00 C ATOM 2055 O GLY A 130 128.411 23.285 -8.472 1.00 1.00 O ATOM 0 H GLY A 130 131.538 21.308 -10.708 1.00 1.00 H new ATOM 0 HA2 GLY A 130 129.118 21.016 -9.284 1.00 1.00 H new ATOM 0 HA3 GLY A 130 130.698 21.407 -8.635 1.00 1.00 H new ATOM 2059 N ALA A 131 130.258 24.119 -9.423 1.00 1.00 N ATOM 2060 CA ALA A 131 129.888 25.498 -9.138 1.00 1.00 C ATOM 2061 C ALA A 131 128.563 25.832 -9.803 1.00 1.00 C ATOM 2062 O ALA A 131 127.674 26.423 -9.191 1.00 1.00 O ATOM 2063 CB ALA A 131 130.958 26.437 -9.699 1.00 1.00 C ATOM 0 H ALA A 131 131.147 24.008 -9.911 1.00 1.00 H new ATOM 0 HA ALA A 131 129.800 25.621 -8.059 1.00 1.00 H new ATOM 0 HB1 ALA A 131 130.683 27.470 -9.487 1.00 1.00 H new ATOM 0 HB2 ALA A 131 131.918 26.214 -9.233 1.00 1.00 H new ATOM 0 HB3 ALA A 131 131.036 26.297 -10.777 1.00 1.00 H new ATOM 2069 N ALA A 132 128.453 25.481 -11.064 1.00 1.00 N ATOM 2070 CA ALA A 132 127.252 25.768 -11.817 1.00 1.00 C ATOM 2071 C ALA A 132 126.030 25.020 -11.260 1.00 1.00 C ATOM 2072 O ALA A 132 124.921 25.557 -11.248 1.00 1.00 O ATOM 2073 CB ALA A 132 127.486 25.390 -13.277 1.00 1.00 C ATOM 0 H ALA A 132 129.180 24.996 -11.590 1.00 1.00 H new ATOM 0 HA ALA A 132 127.036 26.833 -11.733 1.00 1.00 H new ATOM 0 HB1 ALA A 132 126.587 25.602 -13.856 1.00 1.00 H new ATOM 0 HB2 ALA A 132 128.319 25.971 -13.674 1.00 1.00 H new ATOM 0 HB3 ALA A 132 127.719 24.327 -13.345 1.00 1.00 H new ATOM 2079 N TYR A 133 126.231 23.780 -10.817 1.00 1.00 N ATOM 2080 CA TYR A 133 125.140 22.963 -10.281 1.00 1.00 C ATOM 2081 C TYR A 133 124.550 23.582 -9.018 1.00 1.00 C ATOM 2082 O TYR A 133 123.329 23.614 -8.846 1.00 1.00 O ATOM 2083 CB TYR A 133 125.668 21.569 -9.953 1.00 1.00 C ATOM 2084 CG TYR A 133 124.527 20.670 -9.547 1.00 1.00 C ATOM 2085 CD1 TYR A 133 124.071 20.658 -8.224 1.00 1.00 C ATOM 2086 CD2 TYR A 133 123.928 19.841 -10.501 1.00 1.00 C ATOM 2087 CE1 TYR A 133 123.011 19.816 -7.857 1.00 1.00 C ATOM 2088 CE2 TYR A 133 122.872 19.000 -10.138 1.00 1.00 C ATOM 2089 CZ TYR A 133 122.414 18.986 -8.817 1.00 1.00 C ATOM 2090 OH TYR A 133 121.373 18.153 -8.460 1.00 1.00 O ATOM 0 H TYR A 133 127.140 23.317 -10.818 1.00 1.00 H new ATOM 0 HA TYR A 133 124.355 22.907 -11.036 1.00 1.00 H new ATOM 0 HB2 TYR A 133 126.181 21.152 -10.820 1.00 1.00 H new ATOM 0 HB3 TYR A 133 126.400 21.628 -9.148 1.00 1.00 H new ATOM 0 HD1 TYR A 133 124.535 21.296 -7.486 1.00 1.00 H new ATOM 0 HD2 TYR A 133 124.282 19.851 -11.521 1.00 1.00 H new ATOM 0 HE1 TYR A 133 122.655 19.807 -6.837 1.00 1.00 H new ATOM 0 HE2 TYR A 133 122.410 18.362 -10.877 1.00 1.00 H new ATOM 0 HH TYR A 133 121.020 18.426 -7.588 1.00 1.00 H new ATOM 2100 N VAL A 134 125.412 24.048 -8.128 1.00 1.00 N ATOM 2101 CA VAL A 134 124.931 24.627 -6.893 1.00 1.00 C ATOM 2102 C VAL A 134 124.152 25.916 -7.163 1.00 1.00 C ATOM 2103 O VAL A 134 123.193 26.219 -6.478 1.00 1.00 O ATOM 2104 CB VAL A 134 126.081 24.853 -5.919 1.00 1.00 C ATOM 2105 CG1 VAL A 134 126.705 23.510 -5.544 1.00 1.00 C ATOM 2106 CG2 VAL A 134 127.141 25.735 -6.548 1.00 1.00 C ATOM 0 H VAL A 134 126.426 24.036 -8.237 1.00 1.00 H new ATOM 0 HA VAL A 134 124.242 23.923 -6.427 1.00 1.00 H new ATOM 0 HB VAL A 134 125.692 25.344 -5.027 1.00 1.00 H new ATOM 0 HG11 VAL A 134 127.527 23.673 -4.847 1.00 1.00 H new ATOM 0 HG12 VAL A 134 125.952 22.877 -5.075 1.00 1.00 H new ATOM 0 HG13 VAL A 134 127.082 23.020 -6.442 1.00 1.00 H new ATOM 0 HG21 VAL A 134 127.955 25.887 -5.840 1.00 1.00 H new ATOM 0 HG22 VAL A 134 127.527 25.255 -7.447 1.00 1.00 H new ATOM 0 HG23 VAL A 134 126.704 26.698 -6.810 1.00 1.00 H new ATOM 2116 N SER A 135 124.554 26.686 -8.156 1.00 1.00 N ATOM 2117 CA SER A 135 123.830 27.916 -8.454 1.00 1.00 C ATOM 2118 C SER A 135 122.374 27.592 -8.788 1.00 1.00 C ATOM 2119 O SER A 135 121.445 28.291 -8.377 1.00 1.00 O ATOM 2120 CB SER A 135 124.468 28.625 -9.651 1.00 1.00 C ATOM 2121 OG SER A 135 123.750 29.822 -9.917 1.00 1.00 O ATOM 0 H SER A 135 125.355 26.494 -8.758 1.00 1.00 H new ATOM 0 HA SER A 135 123.873 28.566 -7.580 1.00 1.00 H new ATOM 0 HB2 SER A 135 125.513 28.852 -9.441 1.00 1.00 H new ATOM 0 HB3 SER A 135 124.453 27.975 -10.526 1.00 1.00 H new ATOM 0 HG SER A 135 124.154 30.283 -10.682 1.00 1.00 H new ATOM 2127 N LYS A 136 122.206 26.538 -9.577 1.00 1.00 N ATOM 2128 CA LYS A 136 120.884 26.108 -10.030 1.00 1.00 C ATOM 2129 C LYS A 136 119.991 25.638 -8.886 1.00 1.00 C ATOM 2130 O LYS A 136 118.797 25.934 -8.860 1.00 1.00 O ATOM 2131 CB LYS A 136 121.044 24.986 -11.049 1.00 1.00 C ATOM 2132 CG LYS A 136 121.679 25.556 -12.315 1.00 1.00 C ATOM 2133 CD LYS A 136 121.843 24.446 -13.353 1.00 1.00 C ATOM 2134 CE LYS A 136 122.532 25.016 -14.592 1.00 1.00 C ATOM 2135 NZ LYS A 136 122.724 23.934 -15.596 1.00 1.00 N ATOM 0 H LYS A 136 122.973 25.960 -9.920 1.00 1.00 H new ATOM 0 HA LYS A 136 120.396 26.972 -10.481 1.00 1.00 H new ATOM 0 HB2 LYS A 136 121.667 24.191 -10.640 1.00 1.00 H new ATOM 0 HB3 LYS A 136 120.074 24.545 -11.279 1.00 1.00 H new ATOM 0 HG2 LYS A 136 121.056 26.355 -12.718 1.00 1.00 H new ATOM 0 HG3 LYS A 136 122.649 25.995 -12.081 1.00 1.00 H new ATOM 0 HD2 LYS A 136 122.432 23.628 -12.938 1.00 1.00 H new ATOM 0 HD3 LYS A 136 120.870 24.035 -13.620 1.00 1.00 H new ATOM 0 HE2 LYS A 136 121.931 25.819 -15.018 1.00 1.00 H new ATOM 0 HE3 LYS A 136 123.495 25.448 -14.319 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 123.193 24.322 -16.439 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 123.314 23.182 -15.187 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 121.799 23.541 -15.864 1.00 1.00 H new ATOM 2149 N VAL A 137 120.560 24.892 -7.951 1.00 1.00 N ATOM 2150 CA VAL A 137 119.767 24.395 -6.838 1.00 1.00 C ATOM 2151 C VAL A 137 119.274 25.560 -5.984 1.00 1.00 C ATOM 2152 O VAL A 137 118.156 25.540 -5.472 1.00 1.00 O ATOM 2153 CB VAL A 137 120.573 23.371 -6.016 1.00 1.00 C ATOM 2154 CG1 VAL A 137 121.530 24.062 -5.079 1.00 1.00 C ATOM 2155 CG2 VAL A 137 119.621 22.509 -5.189 1.00 1.00 C ATOM 0 H VAL A 137 121.544 24.623 -7.939 1.00 1.00 H new ATOM 0 HA VAL A 137 118.889 23.876 -7.224 1.00 1.00 H new ATOM 0 HB VAL A 137 121.139 22.753 -6.713 1.00 1.00 H new ATOM 0 HG11 VAL A 137 122.086 23.316 -4.511 1.00 1.00 H new ATOM 0 HG12 VAL A 137 122.226 24.672 -5.655 1.00 1.00 H new ATOM 0 HG13 VAL A 137 120.971 24.698 -4.392 1.00 1.00 H new ATOM 0 HG21 VAL A 137 120.195 21.786 -4.609 1.00 1.00 H new ATOM 0 HG22 VAL A 137 119.049 23.145 -4.513 1.00 1.00 H new ATOM 0 HG23 VAL A 137 118.938 21.980 -5.854 1.00 1.00 H new ATOM 2165 N LYS A 138 120.130 26.564 -5.823 1.00 1.00 N ATOM 2166 CA LYS A 138 119.797 27.729 -5.018 1.00 1.00 C ATOM 2167 C LYS A 138 118.556 28.431 -5.557 1.00 1.00 C ATOM 2168 O LYS A 138 117.670 28.812 -4.791 1.00 1.00 O ATOM 2169 CB LYS A 138 120.976 28.707 -5.013 1.00 1.00 C ATOM 2170 CG LYS A 138 122.106 28.134 -4.157 1.00 1.00 C ATOM 2171 CD LYS A 138 123.352 29.015 -4.284 1.00 1.00 C ATOM 2172 CE LYS A 138 124.416 28.528 -3.303 1.00 1.00 C ATOM 2173 NZ LYS A 138 124.088 29.025 -1.938 1.00 1.00 N ATOM 0 H LYS A 138 121.060 26.592 -6.241 1.00 1.00 H new ATOM 0 HA LYS A 138 119.590 27.394 -4.002 1.00 1.00 H new ATOM 0 HB2 LYS A 138 121.326 28.877 -6.031 1.00 1.00 H new ATOM 0 HB3 LYS A 138 120.660 29.673 -4.619 1.00 1.00 H new ATOM 0 HG2 LYS A 138 121.793 28.080 -3.114 1.00 1.00 H new ATOM 0 HG3 LYS A 138 122.335 27.117 -4.475 1.00 1.00 H new ATOM 0 HD2 LYS A 138 123.736 28.977 -5.303 1.00 1.00 H new ATOM 0 HD3 LYS A 138 123.099 30.055 -4.077 1.00 1.00 H new ATOM 0 HE2 LYS A 138 124.459 27.439 -3.306 1.00 1.00 H new ATOM 0 HE3 LYS A 138 125.399 28.887 -3.607 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 124.851 29.647 -1.602 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 123.195 29.557 -1.968 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 123.989 28.218 -1.289 1.00 1.00 H new ATOM 2187 N SER A 139 118.487 28.617 -6.868 1.00 1.00 N ATOM 2188 CA SER A 139 117.335 29.291 -7.449 1.00 1.00 C ATOM 2189 C SER A 139 116.091 28.429 -7.296 1.00 1.00 C ATOM 2190 O SER A 139 114.990 28.938 -7.089 1.00 1.00 O ATOM 2191 CB SER A 139 117.574 29.576 -8.932 1.00 1.00 C ATOM 2192 OG SER A 139 117.813 28.353 -9.616 1.00 1.00 O ATOM 0 H SER A 139 119.198 28.318 -7.536 1.00 1.00 H new ATOM 0 HA SER A 139 117.190 30.234 -6.923 1.00 1.00 H new ATOM 0 HB2 SER A 139 116.709 30.082 -9.360 1.00 1.00 H new ATOM 0 HB3 SER A 139 118.426 30.245 -9.052 1.00 1.00 H new ATOM 0 HG SER A 139 118.123 27.677 -8.978 1.00 1.00 H new ATOM 2198 N ALA A 140 116.274 27.122 -7.413 1.00 1.00 N ATOM 2199 CA ALA A 140 115.162 26.192 -7.310 1.00 1.00 C ATOM 2200 C ALA A 140 114.587 26.134 -5.892 1.00 1.00 C ATOM 2201 O ALA A 140 113.371 26.049 -5.720 1.00 1.00 O ATOM 2202 CB ALA A 140 115.623 24.805 -7.750 1.00 1.00 C ATOM 0 H ALA A 140 117.180 26.684 -7.579 1.00 1.00 H new ATOM 0 HA ALA A 140 114.365 26.546 -7.964 1.00 1.00 H new ATOM 0 HB1 ALA A 140 114.792 24.104 -7.674 1.00 1.00 H new ATOM 0 HB2 ALA A 140 115.969 24.847 -8.783 1.00 1.00 H new ATOM 0 HB3 ALA A 140 116.438 24.472 -7.108 1.00 1.00 H new ATOM 2208 N LEU A 141 115.447 26.152 -4.882 1.00 1.00 N ATOM 2209 CA LEU A 141 114.980 26.072 -3.498 1.00 1.00 C ATOM 2210 C LEU A 141 114.698 27.447 -2.894 1.00 1.00 C ATOM 2211 O LEU A 141 114.270 27.533 -1.745 1.00 1.00 O ATOM 2212 CB LEU A 141 116.011 25.345 -2.633 1.00 1.00 C ATOM 2213 CG LEU A 141 115.764 23.839 -2.694 1.00 1.00 C ATOM 2214 CD1 LEU A 141 115.854 23.359 -4.139 1.00 1.00 C ATOM 2215 CD2 LEU A 141 116.818 23.115 -1.856 1.00 1.00 C ATOM 0 H LEU A 141 116.459 26.220 -4.989 1.00 1.00 H new ATOM 0 HA LEU A 141 114.042 25.516 -3.515 1.00 1.00 H new ATOM 0 HB2 LEU A 141 117.018 25.572 -2.982 1.00 1.00 H new ATOM 0 HB3 LEU A 141 115.945 25.693 -1.602 1.00 1.00 H new ATOM 0 HG LEU A 141 114.770 23.623 -2.302 1.00 1.00 H new ATOM 0 HD11 LEU A 141 115.677 22.284 -4.177 1.00 1.00 H new ATOM 0 HD12 LEU A 141 115.103 23.872 -4.740 1.00 1.00 H new ATOM 0 HD13 LEU A 141 116.846 23.578 -4.534 1.00 1.00 H new ATOM 0 HD21 LEU A 141 116.642 22.040 -1.899 1.00 1.00 H new ATOM 0 HD22 LEU A 141 117.810 23.336 -2.249 1.00 1.00 H new ATOM 0 HD23 LEU A 141 116.754 23.452 -0.821 1.00 1.00 H new ATOM 2227 N LYS A 142 114.946 28.519 -3.648 1.00 1.00 N ATOM 2228 CA LYS A 142 114.712 29.875 -3.149 1.00 1.00 C ATOM 2229 C LYS A 142 115.609 30.171 -1.947 1.00 1.00 C ATOM 2230 O LYS A 142 115.154 30.713 -0.939 1.00 1.00 O ATOM 2231 CB LYS A 142 113.243 30.058 -2.740 1.00 1.00 C ATOM 2232 CG LYS A 142 112.296 29.535 -3.834 1.00 1.00 C ATOM 2233 CD LYS A 142 112.350 30.418 -5.090 1.00 1.00 C ATOM 2234 CE LYS A 142 111.355 29.870 -6.114 1.00 1.00 C ATOM 2235 NZ LYS A 142 111.406 30.684 -7.360 1.00 1.00 N ATOM 0 H LYS A 142 115.307 28.476 -4.601 1.00 1.00 H new ATOM 0 HA LYS A 142 114.950 30.570 -3.955 1.00 1.00 H new ATOM 0 HB2 LYS A 142 113.053 29.528 -1.806 1.00 1.00 H new ATOM 0 HB3 LYS A 142 113.042 31.113 -2.554 1.00 1.00 H new ATOM 0 HG2 LYS A 142 112.568 28.512 -4.094 1.00 1.00 H new ATOM 0 HG3 LYS A 142 111.276 29.506 -3.451 1.00 1.00 H new ATOM 0 HD2 LYS A 142 112.104 31.450 -4.838 1.00 1.00 H new ATOM 0 HD3 LYS A 142 113.357 30.423 -5.506 1.00 1.00 H new ATOM 0 HE2 LYS A 142 111.589 28.830 -6.340 1.00 1.00 H new ATOM 0 HE3 LYS A 142 110.347 29.888 -5.699 1.00 1.00 H new ATOM 0 HZ1 LYS A 142 110.727 30.305 -8.050 1.00 1.00 H new ATOM 0 HZ2 LYS A 142 111.162 31.671 -7.140 1.00 1.00 H new ATOM 0 HZ3 LYS A 142 112.365 30.646 -7.761 1.00 1.00 H new ATOM 2249 N LEU A 143 116.895 29.853 -2.078 1.00 1.00 N ATOM 2250 CA LEU A 143 117.876 30.128 -1.031 1.00 1.00 C ATOM 2251 C LEU A 143 118.533 31.472 -1.336 1.00 1.00 C ATOM 2252 O LEU A 143 119.101 31.656 -2.413 1.00 1.00 O ATOM 2253 CB LEU A 143 118.959 29.042 -1.046 1.00 1.00 C ATOM 2254 CG LEU A 143 118.628 27.842 -0.137 1.00 1.00 C ATOM 2255 CD1 LEU A 143 117.118 27.595 -0.010 1.00 1.00 C ATOM 2256 CD2 LEU A 143 119.277 26.602 -0.752 1.00 1.00 C ATOM 0 H LEU A 143 117.284 29.401 -2.906 1.00 1.00 H new ATOM 0 HA LEU A 143 117.387 30.145 -0.057 1.00 1.00 H new ATOM 0 HB2 LEU A 143 119.096 28.689 -2.068 1.00 1.00 H new ATOM 0 HB3 LEU A 143 119.907 29.478 -0.730 1.00 1.00 H new ATOM 0 HG LEU A 143 119.006 28.055 0.863 1.00 1.00 H new ATOM 0 HD11 LEU A 143 116.943 26.739 0.641 1.00 1.00 H new ATOM 0 HD12 LEU A 143 116.639 28.478 0.414 1.00 1.00 H new ATOM 0 HD13 LEU A 143 116.698 27.393 -0.995 1.00 1.00 H new ATOM 0 HD21 LEU A 143 119.061 25.733 -0.131 1.00 1.00 H new ATOM 0 HD22 LEU A 143 118.878 26.441 -1.753 1.00 1.00 H new ATOM 0 HD23 LEU A 143 120.356 26.747 -0.811 1.00 1.00 H new ATOM 2268 N ARG A 144 118.458 32.410 -0.394 1.00 1.00 N ATOM 2269 CA ARG A 144 119.058 33.728 -0.595 1.00 1.00 C ATOM 2270 C ARG A 144 120.578 33.619 -0.671 1.00 1.00 C ATOM 2271 O ARG A 144 121.079 32.510 -0.582 1.00 1.00 O ATOM 2272 CB ARG A 144 118.676 34.678 0.544 1.00 1.00 C ATOM 2273 CG ARG A 144 117.189 35.037 0.448 1.00 1.00 C ATOM 2274 CD ARG A 144 116.814 35.992 1.585 1.00 1.00 C ATOM 2275 NE ARG A 144 115.399 36.342 1.512 1.00 1.00 N ATOM 2276 CZ ARG A 144 114.914 37.394 2.166 1.00 1.00 C ATOM 2277 NH1 ARG A 144 115.717 38.164 2.847 1.00 1.00 N ATOM 2278 NH2 ARG A 144 113.639 37.662 2.117 1.00 1.00 N ATOM 2279 OXT ARG A 144 121.218 34.647 -0.811 1.00 1.00 O ATOM 0 H ARG A 144 117.994 32.285 0.506 1.00 1.00 H new ATOM 0 HA ARG A 144 118.678 34.127 -1.535 1.00 1.00 H new ATOM 0 HB2 ARG A 144 118.884 34.209 1.506 1.00 1.00 H new ATOM 0 HB3 ARG A 144 119.281 35.583 0.493 1.00 1.00 H new ATOM 0 HG2 ARG A 144 116.979 35.502 -0.515 1.00 1.00 H new ATOM 0 HG3 ARG A 144 116.582 34.133 0.504 1.00 1.00 H new ATOM 0 HD2 ARG A 144 117.030 35.525 2.546 1.00 1.00 H new ATOM 0 HD3 ARG A 144 117.422 36.895 1.525 1.00 1.00 H new ATOM 0 HE ARG A 144 114.770 35.769 0.949 1.00 1.00 H new ATOM 0 HH11 ARG A 144 116.716 37.959 2.878 1.00 1.00 H new ATOM 0 HH12 ARG A 144 115.346 38.971 3.349 1.00 1.00 H new ATOM 0 HH21 ARG A 144 113.013 37.065 1.577 1.00 1.00 H new ATOM 0 HH22 ARG A 144 113.268 38.469 2.619 1.00 1.00 H new TER 2293 ARG A 144