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 155:sc= -2.24! (180deg=-2.9) USER MOD Set 1.2: A 123 MET CE :methyl 151:sc= -3.17 (180deg=-4.08!) USER MOD Set 1.3: A 133 TYR OH : rot 14:sc= -0.788 USER MOD Set 2.1: A 87 GLN : amide:sc= -6.09! C(o=-13!,f=-8.1!) USER MOD Set 2.2: A 91 GLN : amide:sc= -7.01! C(o=-13!,f=-7.2!) USER MOD Set 3.1: A 62 GLN : amide:sc= -0.132 X(o=-2.7,f=-3) USER MOD Set 3.2: A 67 LYS NZ :NH3+ -125:sc= -2.55 (180deg=-4.42!) USER MOD Set 4.1: A 33 SER OG : rot -101:sc= 1.26 USER MOD Set 4.2: A 75 HIS : no HE2:sc= -2.5 K(o=-1.2,f=-2.9!) USER MOD Single : A 1 ALA N :NH3+ -106:sc= 0.0207 (180deg=0) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.672 K(o=-0.67,f=-2.3!) USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 12 GLN : amide:sc= -0.175 X(o=-0.17,f=-0.21) USER MOD Single : A 13 THR OG1 : rot 180:sc= -0.58 USER MOD Single : A 20 ASN : amide:sc= -2.49 K(o=-2.5,f=0) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 HIS : no HE2:sc= -0.209! C(o=-0.21!,f=-4!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 HIS : no HE2:sc= -1.95! C(o=-1.9!,f=-3.1!) USER MOD Single : A 38 LYS NZ :NH3+ 177:sc= -1.06 (180deg=-1.2) USER MOD Single : A 45 THR OG1 : rot -134:sc= 0.0387 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 GLN : amide:sc= -0.111 K(o=-0.11,f=-2.6!) USER MOD Single : A 59 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.29) USER MOD Single : A 63 SER OG : rot -91:sc= 0.245 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=-0.13) USER MOD Single : A 73 HIS : no HD1:sc= -0.522 X(o=-0.52,f=-0.87) USER MOD Single : A 76 MET CE :methyl -123:sc=-0.00361 (180deg=-0.333) USER MOD Single : A 83 GLN : amide:sc= -0.167 K(o=-0.17,f=-2.1!) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= -1.48 K(o=-1.5,f=-6.6!) USER MOD Single : A 86 HIS : no HE2:sc= -0.701 K(o=-0.7,f=-2.5!) USER MOD Single : A 93 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0.207 (180deg=0.207) USER MOD Single : A 95 ASN : amide:sc= -0.543 K(o=-0.54,f=-3.4!) USER MOD Single : A 96 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 99 LYS NZ :NH3+ -143:sc= 1.21 (180deg=-0.0278) USER MOD Single : A 101 GLN : amide:sc= -0.0034 X(o=-0.0034,f=-0.36) USER MOD Single : A 102 TYR OH : rot 2:sc= -1.24 USER MOD Single : A 103 LYS NZ :NH3+ -144:sc= -0.136 (180deg=-0.801) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -1.17 K(o=-1.2,f=0) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00344) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 141.599 25.982 -31.230 1.00 1.00 N ATOM 2 CA ALA A 1 142.741 25.095 -31.392 1.00 1.00 C ATOM 3 C ALA A 1 142.781 24.077 -30.260 1.00 1.00 C ATOM 4 O ALA A 1 142.458 24.393 -29.115 1.00 1.00 O ATOM 5 CB ALA A 1 144.038 25.903 -31.398 1.00 1.00 C ATOM 0 H1 ALA A 1 140.867 25.737 -31.927 1.00 1.00 H new ATOM 0 H2 ALA A 1 141.212 25.878 -30.270 1.00 1.00 H new ATOM 0 H3 ALA A 1 141.901 26.966 -31.377 1.00 1.00 H new ATOM 0 HA ALA A 1 142.640 24.570 -32.342 1.00 1.00 H new ATOM 0 HB1 ALA A 1 144.886 25.229 -31.520 1.00 1.00 H new ATOM 0 HB2 ALA A 1 144.019 26.615 -32.223 1.00 1.00 H new ATOM 0 HB3 ALA A 1 144.135 26.442 -30.456 1.00 1.00 H new ATOM 11 N ARG A 2 143.184 22.856 -30.585 1.00 1.00 N ATOM 12 CA ARG A 2 143.270 21.805 -29.584 1.00 1.00 C ATOM 13 C ARG A 2 144.621 21.873 -28.881 1.00 1.00 C ATOM 14 O ARG A 2 145.645 22.128 -29.514 1.00 1.00 O ATOM 15 CB ARG A 2 143.088 20.438 -30.247 1.00 1.00 C ATOM 16 CG ARG A 2 141.651 20.316 -30.764 1.00 1.00 C ATOM 17 CD ARG A 2 141.459 18.960 -31.446 1.00 1.00 C ATOM 18 NE ARG A 2 140.096 18.844 -31.954 1.00 1.00 N ATOM 19 CZ ARG A 2 139.104 18.437 -31.167 1.00 1.00 C ATOM 20 NH1 ARG A 2 139.344 18.146 -29.919 1.00 1.00 N ATOM 21 NH2 ARG A 2 137.893 18.334 -31.642 1.00 1.00 N ATOM 0 H ARG A 2 143.454 22.572 -31.527 1.00 1.00 H new ATOM 0 HA ARG A 2 142.480 21.946 -28.847 1.00 1.00 H new ATOM 0 HB2 ARG A 2 143.794 20.322 -31.069 1.00 1.00 H new ATOM 0 HB3 ARG A 2 143.299 19.643 -29.532 1.00 1.00 H new ATOM 0 HG2 ARG A 2 140.948 20.421 -29.938 1.00 1.00 H new ATOM 0 HG3 ARG A 2 141.438 21.121 -31.468 1.00 1.00 H new ATOM 0 HD2 ARG A 2 142.171 18.851 -32.264 1.00 1.00 H new ATOM 0 HD3 ARG A 2 141.662 18.156 -30.738 1.00 1.00 H new ATOM 0 HE ARG A 2 139.901 19.079 -32.927 1.00 1.00 H new ATOM 0 HH11 ARG A 2 140.291 18.231 -29.548 1.00 1.00 H new ATOM 0 HH12 ARG A 2 138.585 17.834 -29.313 1.00 1.00 H new ATOM 0 HH21 ARG A 2 137.706 18.566 -32.618 1.00 1.00 H new ATOM 0 HH22 ARG A 2 137.133 18.022 -31.038 1.00 1.00 H new ATOM 35 N ARG A 3 144.620 21.661 -27.568 1.00 1.00 N ATOM 36 CA ARG A 3 145.860 21.718 -26.800 1.00 1.00 C ATOM 37 C ARG A 3 146.450 20.329 -26.592 1.00 1.00 C ATOM 38 O ARG A 3 145.724 19.344 -26.463 1.00 1.00 O ATOM 39 CB ARG A 3 145.611 22.379 -25.442 1.00 1.00 C ATOM 40 CG ARG A 3 145.328 23.868 -25.646 1.00 1.00 C ATOM 41 CD ARG A 3 145.040 24.527 -24.295 1.00 1.00 C ATOM 42 NE ARG A 3 144.787 25.953 -24.473 1.00 1.00 N ATOM 43 CZ ARG A 3 144.805 26.789 -23.439 1.00 1.00 C ATOM 44 NH1 ARG A 3 145.050 26.339 -22.238 1.00 1.00 N ATOM 45 NH2 ARG A 3 144.577 28.061 -23.626 1.00 1.00 N ATOM 0 H ARG A 3 143.786 21.451 -27.019 1.00 1.00 H new ATOM 0 HA ARG A 3 146.575 22.312 -27.369 1.00 1.00 H new ATOM 0 HB2 ARG A 3 144.768 21.902 -24.942 1.00 1.00 H new ATOM 0 HB3 ARG A 3 146.479 22.248 -24.797 1.00 1.00 H new ATOM 0 HG2 ARG A 3 146.183 24.349 -26.121 1.00 1.00 H new ATOM 0 HG3 ARG A 3 144.477 23.998 -26.314 1.00 1.00 H new ATOM 0 HD2 ARG A 3 144.177 24.053 -23.828 1.00 1.00 H new ATOM 0 HD3 ARG A 3 145.886 24.381 -23.624 1.00 1.00 H new ATOM 0 HE ARG A 3 144.593 26.315 -25.407 1.00 1.00 H new ATOM 0 HH11 ARG A 3 145.228 25.345 -22.092 1.00 1.00 H new ATOM 0 HH12 ARG A 3 145.064 26.981 -21.446 1.00 1.00 H new ATOM 0 HH21 ARG A 3 144.385 28.412 -24.564 1.00 1.00 H new ATOM 0 HH22 ARG A 3 144.590 28.703 -22.834 1.00 1.00 H new ATOM 59 N ARG A 4 147.779 20.266 -26.559 1.00 1.00 N ATOM 60 CA ARG A 4 148.478 19.002 -26.363 1.00 1.00 C ATOM 61 C ARG A 4 149.541 19.160 -25.278 1.00 1.00 C ATOM 62 O ARG A 4 150.212 20.190 -25.201 1.00 1.00 O ATOM 63 CB ARG A 4 149.151 18.563 -27.674 1.00 1.00 C ATOM 64 CG ARG A 4 148.118 18.436 -28.806 1.00 1.00 C ATOM 65 CD ARG A 4 147.342 17.116 -28.685 1.00 1.00 C ATOM 66 NE ARG A 4 146.277 17.064 -29.683 1.00 1.00 N ATOM 67 CZ ARG A 4 145.151 16.394 -29.455 1.00 1.00 C ATOM 68 NH1 ARG A 4 144.999 15.727 -28.341 1.00 1.00 N ATOM 69 NH2 ARG A 4 144.200 16.396 -30.347 1.00 1.00 N ATOM 0 H ARG A 4 148.391 21.075 -26.665 1.00 1.00 H new ATOM 0 HA ARG A 4 147.755 18.245 -26.058 1.00 1.00 H new ATOM 0 HB2 ARG A 4 149.916 19.287 -27.954 1.00 1.00 H new ATOM 0 HB3 ARG A 4 149.654 17.607 -27.527 1.00 1.00 H new ATOM 0 HG2 ARG A 4 147.425 19.276 -28.769 1.00 1.00 H new ATOM 0 HG3 ARG A 4 148.622 18.481 -29.772 1.00 1.00 H new ATOM 0 HD2 ARG A 4 148.020 16.273 -28.822 1.00 1.00 H new ATOM 0 HD3 ARG A 4 146.918 17.025 -27.685 1.00 1.00 H new ATOM 0 HE ARG A 4 146.399 17.550 -30.571 1.00 1.00 H new ATOM 0 HH11 ARG A 4 145.745 15.720 -27.645 1.00 1.00 H new ATOM 0 HH12 ARG A 4 144.135 15.214 -28.168 1.00 1.00 H new ATOM 0 HH21 ARG A 4 144.320 16.911 -31.219 1.00 1.00 H new ATOM 0 HH22 ARG A 4 143.336 15.882 -30.173 1.00 1.00 H new ATOM 83 N ALA A 5 149.695 18.134 -24.446 1.00 1.00 N ATOM 84 CA ALA A 5 150.686 18.180 -23.376 1.00 1.00 C ATOM 85 C ALA A 5 151.067 16.771 -22.929 1.00 1.00 C ATOM 86 O ALA A 5 150.275 15.835 -23.039 1.00 1.00 O ATOM 87 CB ALA A 5 150.140 18.966 -22.184 1.00 1.00 C ATOM 0 H ALA A 5 149.154 17.271 -24.490 1.00 1.00 H new ATOM 0 HA ALA A 5 151.576 18.678 -23.760 1.00 1.00 H new ATOM 0 HB1 ALA A 5 150.889 18.993 -21.392 1.00 1.00 H new ATOM 0 HB2 ALA A 5 149.905 19.984 -22.496 1.00 1.00 H new ATOM 0 HB3 ALA A 5 149.236 18.483 -21.812 1.00 1.00 H new ATOM 93 N SER A 6 152.291 16.638 -22.431 1.00 1.00 N ATOM 94 CA SER A 6 152.794 15.349 -21.970 1.00 1.00 C ATOM 95 C SER A 6 151.975 14.816 -20.795 1.00 1.00 C ATOM 96 O SER A 6 151.712 13.617 -20.704 1.00 1.00 O ATOM 97 CB SER A 6 154.258 15.488 -21.553 1.00 1.00 C ATOM 98 OG SER A 6 155.019 15.954 -22.659 1.00 1.00 O ATOM 0 H SER A 6 152.954 17.407 -22.336 1.00 1.00 H new ATOM 0 HA SER A 6 152.707 14.639 -22.793 1.00 1.00 H new ATOM 0 HB2 SER A 6 154.346 16.183 -20.718 1.00 1.00 H new ATOM 0 HB3 SER A 6 154.643 14.528 -21.210 1.00 1.00 H new ATOM 0 HG SER A 6 155.958 16.046 -22.394 1.00 1.00 H new ATOM 104 N GLY A 7 151.588 15.708 -19.889 1.00 1.00 N ATOM 105 CA GLY A 7 150.815 15.304 -18.721 1.00 1.00 C ATOM 106 C GLY A 7 151.735 14.788 -17.618 1.00 1.00 C ATOM 107 O GLY A 7 152.906 14.498 -17.861 1.00 1.00 O ATOM 0 H GLY A 7 151.795 16.706 -19.940 1.00 1.00 H new ATOM 0 HA2 GLY A 7 150.235 16.150 -18.352 1.00 1.00 H new ATOM 0 HA3 GLY A 7 150.103 14.527 -19.001 1.00 1.00 H new ATOM 111 N GLU A 8 151.202 14.675 -16.405 1.00 1.00 N ATOM 112 CA GLU A 8 151.994 14.194 -15.275 1.00 1.00 C ATOM 113 C GLU A 8 152.462 12.759 -15.516 1.00 1.00 C ATOM 114 O GLU A 8 151.700 11.920 -15.996 1.00 1.00 O ATOM 115 CB GLU A 8 151.153 14.246 -13.993 1.00 1.00 C ATOM 116 CG GLU A 8 150.844 15.702 -13.624 1.00 1.00 C ATOM 117 CD GLU A 8 149.656 16.212 -14.437 1.00 1.00 C ATOM 118 OE1 GLU A 8 149.205 15.490 -15.310 1.00 1.00 O ATOM 119 OE2 GLU A 8 149.209 17.314 -14.164 1.00 1.00 O ATOM 0 H GLU A 8 150.235 14.907 -16.179 1.00 1.00 H new ATOM 0 HA GLU A 8 152.868 14.836 -15.169 1.00 1.00 H new ATOM 0 HB2 GLU A 8 150.224 13.694 -14.136 1.00 1.00 H new ATOM 0 HB3 GLU A 8 151.690 13.762 -13.177 1.00 1.00 H new ATOM 0 HG2 GLU A 8 150.624 15.776 -12.559 1.00 1.00 H new ATOM 0 HG3 GLU A 8 151.718 16.326 -13.813 1.00 1.00 H new ATOM 126 N ASN A 9 153.722 12.483 -15.180 1.00 1.00 N ATOM 127 CA ASN A 9 154.274 11.144 -15.368 1.00 1.00 C ATOM 128 C ASN A 9 153.544 10.135 -14.483 1.00 1.00 C ATOM 129 O ASN A 9 153.243 9.022 -14.914 1.00 1.00 O ATOM 130 CB ASN A 9 155.770 11.136 -15.035 1.00 1.00 C ATOM 131 CG ASN A 9 156.345 9.741 -15.261 1.00 1.00 C ATOM 132 OD1 ASN A 9 155.669 8.872 -15.812 1.00 1.00 O ATOM 133 ND2 ASN A 9 157.560 9.474 -14.865 1.00 1.00 N ATOM 0 H ASN A 9 154.372 13.160 -14.781 1.00 1.00 H new ATOM 0 HA ASN A 9 154.138 10.861 -16.412 1.00 1.00 H new ATOM 0 HB2 ASN A 9 156.294 11.860 -15.659 1.00 1.00 H new ATOM 0 HB3 ASN A 9 155.922 11.438 -13.999 1.00 1.00 H new ATOM 0 HD21 ASN A 9 157.951 8.544 -15.012 1.00 1.00 H new ATOM 0 HD22 ASN A 9 158.118 10.196 -14.409 1.00 1.00 H new ATOM 140 N LEU A 10 153.251 10.543 -13.249 1.00 1.00 N ATOM 141 CA LEU A 10 152.540 9.682 -12.306 1.00 1.00 C ATOM 142 C LEU A 10 151.248 10.366 -11.868 1.00 1.00 C ATOM 143 O LEU A 10 151.219 11.582 -11.682 1.00 1.00 O ATOM 144 CB LEU A 10 153.407 9.412 -11.068 1.00 1.00 C ATOM 145 CG LEU A 10 154.725 8.745 -11.475 1.00 1.00 C ATOM 146 CD1 LEU A 10 155.590 8.532 -10.230 1.00 1.00 C ATOM 147 CD2 LEU A 10 154.443 7.389 -12.133 1.00 1.00 C ATOM 0 H LEU A 10 153.494 11.462 -12.880 1.00 1.00 H new ATOM 0 HA LEU A 10 152.315 8.736 -12.798 1.00 1.00 H new ATOM 0 HB2 LEU A 10 153.611 10.348 -10.548 1.00 1.00 H new ATOM 0 HB3 LEU A 10 152.867 8.771 -10.371 1.00 1.00 H new ATOM 0 HG LEU A 10 155.248 9.387 -12.184 1.00 1.00 H new ATOM 0 HD11 LEU A 10 156.529 8.057 -10.516 1.00 1.00 H new ATOM 0 HD12 LEU A 10 155.798 9.494 -9.762 1.00 1.00 H new ATOM 0 HD13 LEU A 10 155.060 7.892 -9.524 1.00 1.00 H new ATOM 0 HD21 LEU A 10 155.385 6.921 -12.420 1.00 1.00 H new ATOM 0 HD22 LEU A 10 153.917 6.745 -11.428 1.00 1.00 H new ATOM 0 HD23 LEU A 10 153.826 7.536 -13.020 1.00 1.00 H new ATOM 159 N GLN A 11 150.182 9.593 -11.698 1.00 1.00 N ATOM 160 CA GLN A 11 148.913 10.174 -11.278 1.00 1.00 C ATOM 161 C GLN A 11 149.045 10.771 -9.883 1.00 1.00 C ATOM 162 O GLN A 11 149.590 10.140 -8.977 1.00 1.00 O ATOM 163 CB GLN A 11 147.810 9.115 -11.285 1.00 1.00 C ATOM 164 CG GLN A 11 147.519 8.709 -12.730 1.00 1.00 C ATOM 165 CD GLN A 11 146.415 7.657 -12.777 1.00 1.00 C ATOM 166 OE1 GLN A 11 145.845 7.304 -11.746 1.00 1.00 O ATOM 167 NE2 GLN A 11 146.076 7.141 -13.926 1.00 1.00 N ATOM 0 H GLN A 11 150.169 8.583 -11.841 1.00 1.00 H new ATOM 0 HA GLN A 11 148.647 10.963 -11.981 1.00 1.00 H new ATOM 0 HB2 GLN A 11 148.119 8.246 -10.705 1.00 1.00 H new ATOM 0 HB3 GLN A 11 146.908 9.508 -10.815 1.00 1.00 H new ATOM 0 HG2 GLN A 11 147.220 9.584 -13.307 1.00 1.00 H new ATOM 0 HG3 GLN A 11 148.424 8.316 -13.193 1.00 1.00 H new ATOM 0 HE21 GLN A 11 146.552 7.437 -14.778 1.00 1.00 H new ATOM 0 HE22 GLN A 11 145.335 6.441 -13.972 1.00 1.00 H new ATOM 176 N GLN A 12 148.546 11.990 -9.713 1.00 1.00 N ATOM 177 CA GLN A 12 148.619 12.655 -8.419 1.00 1.00 C ATOM 178 C GLN A 12 147.684 11.972 -7.430 1.00 1.00 C ATOM 179 O GLN A 12 146.491 11.822 -7.694 1.00 1.00 O ATOM 180 CB GLN A 12 148.231 14.129 -8.566 1.00 1.00 C ATOM 181 CG GLN A 12 149.245 14.847 -9.462 1.00 1.00 C ATOM 182 CD GLN A 12 150.610 14.894 -8.781 1.00 1.00 C ATOM 183 OE1 GLN A 12 150.725 15.371 -7.652 1.00 1.00 O ATOM 184 NE2 GLN A 12 151.658 14.424 -9.402 1.00 1.00 N ATOM 0 H GLN A 12 148.091 12.533 -10.447 1.00 1.00 H new ATOM 0 HA GLN A 12 149.641 12.591 -8.046 1.00 1.00 H new ATOM 0 HB2 GLN A 12 147.232 14.210 -8.994 1.00 1.00 H new ATOM 0 HB3 GLN A 12 148.197 14.605 -7.586 1.00 1.00 H new ATOM 0 HG2 GLN A 12 149.325 14.331 -10.419 1.00 1.00 H new ATOM 0 HG3 GLN A 12 148.901 15.859 -9.674 1.00 1.00 H new ATOM 0 HE21 GLN A 12 151.562 14.029 -10.337 1.00 1.00 H new ATOM 0 HE22 GLN A 12 152.573 14.452 -8.952 1.00 1.00 H new ATOM 193 N THR A 13 148.230 11.557 -6.293 1.00 1.00 N ATOM 194 CA THR A 13 147.427 10.889 -5.279 1.00 1.00 C ATOM 195 C THR A 13 146.619 11.909 -4.486 1.00 1.00 C ATOM 196 O THR A 13 146.893 13.108 -4.544 1.00 1.00 O ATOM 197 CB THR A 13 148.331 10.092 -4.337 1.00 1.00 C ATOM 198 OG1 THR A 13 148.969 10.981 -3.430 1.00 1.00 O ATOM 199 CG2 THR A 13 149.384 9.341 -5.152 1.00 1.00 C ATOM 0 H THR A 13 149.215 11.670 -6.053 1.00 1.00 H new ATOM 0 HA THR A 13 146.737 10.205 -5.774 1.00 1.00 H new ATOM 0 HB THR A 13 147.732 9.374 -3.777 1.00 1.00 H new ATOM 0 HG1 THR A 13 149.547 10.471 -2.825 1.00 1.00 H new ATOM 0 HG21 THR A 13 150.028 8.773 -4.480 1.00 1.00 H new ATOM 0 HG22 THR A 13 148.890 8.659 -5.844 1.00 1.00 H new ATOM 0 HG23 THR A 13 149.986 10.055 -5.714 1.00 1.00 H new ATOM 207 N ARG A 14 145.612 11.430 -3.761 1.00 1.00 N ATOM 208 CA ARG A 14 144.759 12.317 -2.976 1.00 1.00 C ATOM 209 C ARG A 14 144.431 11.692 -1.619 1.00 1.00 C ATOM 210 O ARG A 14 143.263 11.495 -1.285 1.00 1.00 O ATOM 211 CB ARG A 14 143.453 12.594 -3.735 1.00 1.00 C ATOM 212 CG ARG A 14 143.721 13.525 -4.925 1.00 1.00 C ATOM 213 CD ARG A 14 142.547 13.467 -5.909 1.00 1.00 C ATOM 214 NE ARG A 14 141.312 13.117 -5.217 1.00 1.00 N ATOM 215 CZ ARG A 14 140.234 12.727 -5.890 1.00 1.00 C ATOM 216 NH1 ARG A 14 140.264 12.668 -7.193 1.00 1.00 N ATOM 217 NH2 ARG A 14 139.144 12.409 -5.248 1.00 1.00 N ATOM 0 H ARG A 14 145.368 10.441 -3.701 1.00 1.00 H new ATOM 0 HA ARG A 14 145.296 13.252 -2.814 1.00 1.00 H new ATOM 0 HB2 ARG A 14 143.022 11.657 -4.087 1.00 1.00 H new ATOM 0 HB3 ARG A 14 142.723 13.049 -3.065 1.00 1.00 H new ATOM 0 HG2 ARG A 14 143.862 14.547 -4.573 1.00 1.00 H new ATOM 0 HG3 ARG A 14 144.643 13.231 -5.427 1.00 1.00 H new ATOM 0 HD2 ARG A 14 142.432 14.432 -6.403 1.00 1.00 H new ATOM 0 HD3 ARG A 14 142.754 12.733 -6.687 1.00 1.00 H new ATOM 0 HE ARG A 14 141.275 13.172 -4.199 1.00 1.00 H new ATOM 0 HH11 ARG A 14 141.115 12.921 -7.696 1.00 1.00 H new ATOM 0 HH12 ARG A 14 139.437 12.369 -7.709 1.00 1.00 H new ATOM 0 HH21 ARG A 14 139.119 12.460 -4.230 1.00 1.00 H new ATOM 0 HH22 ARG A 14 138.317 12.110 -5.764 1.00 1.00 H new ATOM 231 N PRO A 15 145.434 11.384 -0.838 1.00 1.00 N ATOM 232 CA PRO A 15 145.247 10.774 0.512 1.00 1.00 C ATOM 233 C PRO A 15 144.649 11.778 1.490 1.00 1.00 C ATOM 234 O PRO A 15 144.172 11.415 2.566 1.00 1.00 O ATOM 235 CB PRO A 15 146.662 10.366 0.930 1.00 1.00 C ATOM 236 CG PRO A 15 147.571 11.265 0.163 1.00 1.00 C ATOM 237 CD PRO A 15 146.856 11.592 -1.149 1.00 1.00 C ATOM 0 HA PRO A 15 144.556 9.931 0.501 1.00 1.00 H new ATOM 0 HB2 PRO A 15 146.805 10.485 2.004 1.00 1.00 H new ATOM 0 HB3 PRO A 15 146.855 9.319 0.697 1.00 1.00 H new ATOM 0 HG2 PRO A 15 147.783 12.174 0.726 1.00 1.00 H new ATOM 0 HG3 PRO A 15 148.527 10.778 -0.028 1.00 1.00 H new ATOM 0 HD2 PRO A 15 147.050 12.617 -1.465 1.00 1.00 H new ATOM 0 HD3 PRO A 15 147.188 10.941 -1.958 1.00 1.00 H new ATOM 245 N ILE A 16 144.689 13.045 1.097 1.00 1.00 N ATOM 246 CA ILE A 16 144.159 14.124 1.922 1.00 1.00 C ATOM 247 C ILE A 16 143.198 14.985 1.108 1.00 1.00 C ATOM 248 O ILE A 16 143.492 15.332 -0.037 1.00 1.00 O ATOM 249 CB ILE A 16 145.307 14.993 2.426 1.00 1.00 C ATOM 250 CG1 ILE A 16 144.753 16.065 3.368 1.00 1.00 C ATOM 251 CG2 ILE A 16 145.986 15.662 1.230 1.00 1.00 C ATOM 252 CD1 ILE A 16 145.904 16.755 4.100 1.00 1.00 C ATOM 0 H ILE A 16 145.085 13.352 0.208 1.00 1.00 H new ATOM 0 HA ILE A 16 143.625 13.691 2.767 1.00 1.00 H new ATOM 0 HB ILE A 16 146.031 14.380 2.963 1.00 1.00 H new ATOM 0 HG12 ILE A 16 144.178 16.798 2.802 1.00 1.00 H new ATOM 0 HG13 ILE A 16 144.071 15.613 4.088 1.00 1.00 H new ATOM 0 HG21 ILE A 16 146.808 16.286 1.580 1.00 1.00 H new ATOM 0 HG22 ILE A 16 146.372 14.897 0.556 1.00 1.00 H new ATOM 0 HG23 ILE A 16 145.262 16.281 0.700 1.00 1.00 H new ATOM 0 HD11 ILE A 16 145.505 17.517 4.769 1.00 1.00 H new ATOM 0 HD12 ILE A 16 146.460 16.018 4.680 1.00 1.00 H new ATOM 0 HD13 ILE A 16 146.569 17.222 3.374 1.00 1.00 H new ATOM 264 N ALA A 17 142.055 15.327 1.700 1.00 1.00 N ATOM 265 CA ALA A 17 141.063 16.151 1.010 1.00 1.00 C ATOM 266 C ALA A 17 140.701 17.375 1.846 1.00 1.00 C ATOM 267 O ALA A 17 140.635 17.305 3.073 1.00 1.00 O ATOM 268 CB ALA A 17 139.803 15.331 0.728 1.00 1.00 C ATOM 0 H ALA A 17 141.794 15.050 2.646 1.00 1.00 H new ATOM 0 HA ALA A 17 141.495 16.487 0.067 1.00 1.00 H new ATOM 0 HB1 ALA A 17 139.071 15.954 0.214 1.00 1.00 H new ATOM 0 HB2 ALA A 17 140.058 14.477 0.100 1.00 1.00 H new ATOM 0 HB3 ALA A 17 139.381 14.977 1.669 1.00 1.00 H new ATOM 274 N ALA A 18 140.472 18.498 1.170 1.00 1.00 N ATOM 275 CA ALA A 18 140.124 19.738 1.855 1.00 1.00 C ATOM 276 C ALA A 18 138.774 19.618 2.557 1.00 1.00 C ATOM 277 O ALA A 18 138.584 20.153 3.650 1.00 1.00 O ATOM 278 CB ALA A 18 140.082 20.895 0.854 1.00 1.00 C ATOM 0 H ALA A 18 140.521 18.574 0.154 1.00 1.00 H new ATOM 0 HA ALA A 18 140.888 19.934 2.608 1.00 1.00 H new ATOM 0 HB1 ALA A 18 139.821 21.817 1.374 1.00 1.00 H new ATOM 0 HB2 ALA A 18 141.060 21.007 0.386 1.00 1.00 H new ATOM 0 HB3 ALA A 18 139.335 20.687 0.088 1.00 1.00 H new ATOM 284 N ALA A 19 137.837 18.917 1.925 1.00 1.00 N ATOM 285 CA ALA A 19 136.510 18.743 2.508 1.00 1.00 C ATOM 286 C ALA A 19 135.827 17.499 1.940 1.00 1.00 C ATOM 287 O ALA A 19 136.005 17.162 0.769 1.00 1.00 O ATOM 288 CB ALA A 19 135.653 19.979 2.219 1.00 1.00 C ATOM 0 H ALA A 19 137.969 18.465 1.020 1.00 1.00 H new ATOM 0 HA ALA A 19 136.619 18.617 3.585 1.00 1.00 H new ATOM 0 HB1 ALA A 19 134.663 19.846 2.656 1.00 1.00 H new ATOM 0 HB2 ALA A 19 136.126 20.859 2.654 1.00 1.00 H new ATOM 0 HB3 ALA A 19 135.559 20.113 1.141 1.00 1.00 H new ATOM 294 N ASN A 20 135.043 16.825 2.781 1.00 1.00 N ATOM 295 CA ASN A 20 134.331 15.622 2.358 1.00 1.00 C ATOM 296 C ASN A 20 132.865 15.700 2.754 1.00 1.00 C ATOM 297 O ASN A 20 132.520 16.270 3.789 1.00 1.00 O ATOM 298 CB ASN A 20 134.950 14.386 3.001 1.00 1.00 C ATOM 299 CG ASN A 20 136.402 14.242 2.561 1.00 1.00 C ATOM 300 OD1 ASN A 20 137.260 13.878 3.363 1.00 1.00 O ATOM 301 ND2 ASN A 20 136.731 14.508 1.325 1.00 1.00 N ATOM 0 H ASN A 20 134.886 17.090 3.753 1.00 1.00 H new ATOM 0 HA ASN A 20 134.410 15.550 1.273 1.00 1.00 H new ATOM 0 HB2 ASN A 20 134.896 14.465 4.087 1.00 1.00 H new ATOM 0 HB3 ASN A 20 134.386 13.497 2.718 1.00 1.00 H new ATOM 0 HD21 ASN A 20 137.701 14.414 1.024 1.00 1.00 H new ATOM 0 HD22 ASN A 20 136.018 14.810 0.661 1.00 1.00 H new ATOM 308 N LEU A 21 132.005 15.131 1.920 1.00 1.00 N ATOM 309 CA LEU A 21 130.575 15.146 2.191 1.00 1.00 C ATOM 310 C LEU A 21 130.229 14.132 3.268 1.00 1.00 C ATOM 311 O LEU A 21 130.739 13.011 3.292 1.00 1.00 O ATOM 312 CB LEU A 21 129.779 14.844 0.919 1.00 1.00 C ATOM 313 CG LEU A 21 128.311 15.236 1.133 1.00 1.00 C ATOM 314 CD1 LEU A 21 128.121 16.719 0.795 1.00 1.00 C ATOM 315 CD2 LEU A 21 127.407 14.396 0.228 1.00 1.00 C ATOM 0 H LEU A 21 132.270 14.657 1.057 1.00 1.00 H new ATOM 0 HA LEU A 21 130.308 16.143 2.542 1.00 1.00 H new ATOM 0 HB2 LEU A 21 130.195 15.396 0.076 1.00 1.00 H new ATOM 0 HB3 LEU A 21 129.852 13.785 0.674 1.00 1.00 H new ATOM 0 HG LEU A 21 128.046 15.057 2.175 1.00 1.00 H new ATOM 0 HD11 LEU A 21 127.078 16.996 0.947 1.00 1.00 H new ATOM 0 HD12 LEU A 21 128.756 17.324 1.443 1.00 1.00 H new ATOM 0 HD13 LEU A 21 128.394 16.893 -0.246 1.00 1.00 H new ATOM 0 HD21 LEU A 21 126.367 14.681 0.387 1.00 1.00 H new ATOM 0 HD22 LEU A 21 127.675 14.568 -0.814 1.00 1.00 H new ATOM 0 HD23 LEU A 21 127.534 13.340 0.466 1.00 1.00 H new ATOM 327 N GLN A 22 129.339 14.560 4.150 1.00 1.00 N ATOM 328 CA GLN A 22 128.882 13.722 5.244 1.00 1.00 C ATOM 329 C GLN A 22 127.543 13.102 4.887 1.00 1.00 C ATOM 330 O GLN A 22 126.515 13.780 4.884 1.00 1.00 O ATOM 331 CB GLN A 22 128.745 14.565 6.505 1.00 1.00 C ATOM 332 CG GLN A 22 130.129 15.062 6.912 1.00 1.00 C ATOM 333 CD GLN A 22 130.026 15.923 8.165 1.00 1.00 C ATOM 334 OE1 GLN A 22 128.948 16.048 8.746 1.00 1.00 O ATOM 335 NE2 GLN A 22 131.087 16.527 8.620 1.00 1.00 N ATOM 0 H GLN A 22 128.918 15.489 4.128 1.00 1.00 H new ATOM 0 HA GLN A 22 129.606 12.926 5.421 1.00 1.00 H new ATOM 0 HB2 GLN A 22 128.078 15.408 6.326 1.00 1.00 H new ATOM 0 HB3 GLN A 22 128.304 13.975 7.308 1.00 1.00 H new ATOM 0 HG2 GLN A 22 130.789 14.214 7.096 1.00 1.00 H new ATOM 0 HG3 GLN A 22 130.571 15.639 6.100 1.00 1.00 H new ATOM 0 HE21 GLN A 22 131.980 16.423 8.138 1.00 1.00 H new ATOM 0 HE22 GLN A 22 131.025 17.104 9.459 1.00 1.00 H new ATOM 344 N TRP A 23 127.554 11.807 4.597 1.00 1.00 N ATOM 345 CA TRP A 23 126.322 11.118 4.257 1.00 1.00 C ATOM 346 C TRP A 23 125.531 10.826 5.526 1.00 1.00 C ATOM 347 O TRP A 23 126.077 10.381 6.535 1.00 1.00 O ATOM 348 CB TRP A 23 126.634 9.801 3.550 1.00 1.00 C ATOM 349 CG TRP A 23 127.485 10.057 2.347 1.00 1.00 C ATOM 350 CD1 TRP A 23 127.207 10.950 1.372 1.00 1.00 C ATOM 351 CD2 TRP A 23 128.745 9.428 1.977 1.00 1.00 C ATOM 352 NE1 TRP A 23 128.211 10.899 0.420 1.00 1.00 N ATOM 353 CE2 TRP A 23 129.180 9.980 0.750 1.00 1.00 C ATOM 354 CE3 TRP A 23 129.543 8.440 2.576 1.00 1.00 C ATOM 355 CZ2 TRP A 23 130.360 9.569 0.140 1.00 1.00 C ATOM 356 CZ3 TRP A 23 130.737 8.022 1.966 1.00 1.00 C ATOM 357 CH2 TRP A 23 131.145 8.585 0.749 1.00 1.00 C ATOM 0 H TRP A 23 128.390 11.223 4.591 1.00 1.00 H new ATOM 0 HA TRP A 23 125.736 11.754 3.594 1.00 1.00 H new ATOM 0 HB2 TRP A 23 127.149 9.125 4.233 1.00 1.00 H new ATOM 0 HB3 TRP A 23 125.708 9.310 3.253 1.00 1.00 H new ATOM 0 HD1 TRP A 23 126.343 11.597 1.340 1.00 1.00 H new ATOM 0 HE1 TRP A 23 128.230 11.473 -0.423 1.00 1.00 H new ATOM 0 HE3 TRP A 23 129.236 7.998 3.513 1.00 1.00 H new ATOM 0 HZ2 TRP A 23 130.668 10.007 -0.798 1.00 1.00 H new ATOM 0 HZ3 TRP A 23 131.344 7.263 2.437 1.00 1.00 H new ATOM 0 HH2 TRP A 23 132.063 8.260 0.283 1.00 1.00 H new ATOM 368 N GLU A 24 124.227 11.056 5.438 1.00 1.00 N ATOM 369 CA GLU A 24 123.320 10.795 6.546 1.00 1.00 C ATOM 370 C GLU A 24 122.232 9.835 6.073 1.00 1.00 C ATOM 371 O GLU A 24 122.044 9.648 4.871 1.00 1.00 O ATOM 372 CB GLU A 24 122.683 12.099 7.033 1.00 1.00 C ATOM 373 CG GLU A 24 123.749 12.987 7.679 1.00 1.00 C ATOM 374 CD GLU A 24 123.144 14.339 8.040 1.00 1.00 C ATOM 375 OE1 GLU A 24 121.939 14.479 7.914 1.00 1.00 O ATOM 376 OE2 GLU A 24 123.896 15.220 8.426 1.00 1.00 O ATOM 0 H GLU A 24 123.772 11.426 4.603 1.00 1.00 H new ATOM 0 HA GLU A 24 123.876 10.353 7.373 1.00 1.00 H new ATOM 0 HB2 GLU A 24 122.219 12.622 6.197 1.00 1.00 H new ATOM 0 HB3 GLU A 24 121.893 11.882 7.752 1.00 1.00 H new ATOM 0 HG2 GLU A 24 124.144 12.505 8.573 1.00 1.00 H new ATOM 0 HG3 GLU A 24 124.586 13.124 6.994 1.00 1.00 H new ATOM 383 N SER A 25 121.514 9.234 7.011 1.00 1.00 N ATOM 384 CA SER A 25 120.458 8.315 6.643 1.00 1.00 C ATOM 385 C SER A 25 119.205 9.100 6.289 1.00 1.00 C ATOM 386 O SER A 25 119.048 10.252 6.693 1.00 1.00 O ATOM 387 CB SER A 25 120.177 7.334 7.780 1.00 1.00 C ATOM 388 OG SER A 25 121.167 6.312 7.772 1.00 1.00 O ATOM 0 H SER A 25 121.643 9.365 8.014 1.00 1.00 H new ATOM 0 HA SER A 25 120.774 7.737 5.774 1.00 1.00 H new ATOM 0 HB2 SER A 25 120.184 7.856 8.737 1.00 1.00 H new ATOM 0 HB3 SER A 25 119.185 6.897 7.663 1.00 1.00 H new ATOM 0 HG SER A 25 120.992 5.681 8.501 1.00 1.00 H new ATOM 394 N TYR A 26 118.323 8.477 5.533 1.00 1.00 N ATOM 395 CA TYR A 26 117.094 9.127 5.129 1.00 1.00 C ATOM 396 C TYR A 26 116.290 9.508 6.360 1.00 1.00 C ATOM 397 O TYR A 26 115.722 10.600 6.447 1.00 1.00 O ATOM 398 CB TYR A 26 116.284 8.181 4.246 1.00 1.00 C ATOM 399 CG TYR A 26 114.932 8.780 3.961 1.00 1.00 C ATOM 400 CD1 TYR A 26 114.755 9.622 2.858 1.00 1.00 C ATOM 401 CD2 TYR A 26 113.850 8.478 4.793 1.00 1.00 C ATOM 402 CE1 TYR A 26 113.496 10.166 2.588 1.00 1.00 C ATOM 403 CE2 TYR A 26 112.587 9.019 4.521 1.00 1.00 C ATOM 404 CZ TYR A 26 112.410 9.864 3.419 1.00 1.00 C ATOM 405 OH TYR A 26 111.166 10.402 3.150 1.00 1.00 O ATOM 0 H TYR A 26 118.435 7.524 5.187 1.00 1.00 H new ATOM 0 HA TYR A 26 117.327 10.030 4.565 1.00 1.00 H new ATOM 0 HB2 TYR A 26 116.815 7.997 3.312 1.00 1.00 H new ATOM 0 HB3 TYR A 26 116.168 7.217 4.741 1.00 1.00 H new ATOM 0 HD1 TYR A 26 115.592 9.852 2.215 1.00 1.00 H new ATOM 0 HD2 TYR A 26 113.988 7.828 5.645 1.00 1.00 H new ATOM 0 HE1 TYR A 26 113.361 10.819 1.739 1.00 1.00 H new ATOM 0 HE2 TYR A 26 111.750 8.784 5.161 1.00 1.00 H new ATOM 0 HH TYR A 26 110.523 10.092 3.822 1.00 1.00 H new ATOM 415 N ALA A 27 116.260 8.580 7.310 1.00 1.00 N ATOM 416 CA ALA A 27 115.533 8.784 8.549 1.00 1.00 C ATOM 417 C ALA A 27 116.190 9.865 9.370 1.00 1.00 C ATOM 418 O ALA A 27 115.514 10.681 9.998 1.00 1.00 O ATOM 419 CB ALA A 27 115.495 7.487 9.355 1.00 1.00 C ATOM 0 H ALA A 27 116.733 7.679 7.242 1.00 1.00 H new ATOM 0 HA ALA A 27 114.515 9.089 8.305 1.00 1.00 H new ATOM 0 HB1 ALA A 27 114.947 7.651 10.283 1.00 1.00 H new ATOM 0 HB2 ALA A 27 114.998 6.711 8.773 1.00 1.00 H new ATOM 0 HB3 ALA A 27 116.513 7.172 9.585 1.00 1.00 H new ATOM 425 N GLU A 28 117.503 9.852 9.364 1.00 1.00 N ATOM 426 CA GLU A 28 118.277 10.809 10.121 1.00 1.00 C ATOM 427 C GLU A 28 118.109 12.207 9.554 1.00 1.00 C ATOM 428 O GLU A 28 118.052 13.187 10.298 1.00 1.00 O ATOM 429 CB GLU A 28 119.739 10.393 10.081 1.00 1.00 C ATOM 430 CG GLU A 28 119.931 9.145 10.951 1.00 1.00 C ATOM 431 CD GLU A 28 119.790 9.501 12.429 1.00 1.00 C ATOM 432 OE1 GLU A 28 119.968 10.662 12.759 1.00 1.00 O ATOM 433 OE2 GLU A 28 119.518 8.604 13.210 1.00 1.00 O ATOM 0 H GLU A 28 118.063 9.181 8.837 1.00 1.00 H new ATOM 0 HA GLU A 28 117.925 10.826 11.152 1.00 1.00 H new ATOM 0 HB2 GLU A 28 120.043 10.186 9.055 1.00 1.00 H new ATOM 0 HB3 GLU A 28 120.371 11.204 10.443 1.00 1.00 H new ATOM 0 HG2 GLU A 28 119.194 8.388 10.681 1.00 1.00 H new ATOM 0 HG3 GLU A 28 120.915 8.713 10.766 1.00 1.00 H new ATOM 440 N ALA A 29 118.031 12.297 8.237 1.00 1.00 N ATOM 441 CA ALA A 29 117.873 13.577 7.568 1.00 1.00 C ATOM 442 C ALA A 29 116.597 14.293 7.967 1.00 1.00 C ATOM 443 O ALA A 29 116.595 15.503 8.195 1.00 1.00 O ATOM 444 CB ALA A 29 117.777 13.340 6.071 1.00 1.00 C ATOM 0 H ALA A 29 118.075 11.495 7.608 1.00 1.00 H new ATOM 0 HA ALA A 29 118.731 14.186 7.851 1.00 1.00 H new ATOM 0 HB1 ALA A 29 117.658 14.295 5.558 1.00 1.00 H new ATOM 0 HB2 ALA A 29 118.686 12.851 5.721 1.00 1.00 H new ATOM 0 HB3 ALA A 29 116.918 12.704 5.858 1.00 1.00 H new ATOM 450 N LEU A 30 115.508 13.551 7.993 1.00 1.00 N ATOM 451 CA LEU A 30 114.225 14.138 8.301 1.00 1.00 C ATOM 452 C LEU A 30 114.181 14.681 9.714 1.00 1.00 C ATOM 453 O LEU A 30 113.639 15.748 9.948 1.00 1.00 O ATOM 454 CB LEU A 30 113.126 13.103 8.113 1.00 1.00 C ATOM 455 CG LEU A 30 113.043 12.727 6.638 1.00 1.00 C ATOM 456 CD1 LEU A 30 112.532 11.298 6.506 1.00 1.00 C ATOM 457 CD2 LEU A 30 112.066 13.663 5.917 1.00 1.00 C ATOM 0 H LEU A 30 115.488 12.549 7.806 1.00 1.00 H new ATOM 0 HA LEU A 30 114.068 14.973 7.618 1.00 1.00 H new ATOM 0 HB2 LEU A 30 113.335 12.219 8.715 1.00 1.00 H new ATOM 0 HB3 LEU A 30 112.171 13.502 8.454 1.00 1.00 H new ATOM 0 HG LEU A 30 114.035 12.814 6.194 1.00 1.00 H new ATOM 0 HD11 LEU A 30 112.473 11.029 5.451 1.00 1.00 H new ATOM 0 HD12 LEU A 30 113.215 10.619 7.016 1.00 1.00 H new ATOM 0 HD13 LEU A 30 111.542 11.223 6.956 1.00 1.00 H new ATOM 0 HD21 LEU A 30 112.011 13.390 4.863 1.00 1.00 H new ATOM 0 HD22 LEU A 30 111.077 13.574 6.367 1.00 1.00 H new ATOM 0 HD23 LEU A 30 112.414 14.692 6.007 1.00 1.00 H new ATOM 469 N GLU A 31 114.743 13.950 10.665 1.00 1.00 N ATOM 470 CA GLU A 31 114.692 14.419 12.029 1.00 1.00 C ATOM 471 C GLU A 31 115.426 15.728 12.155 1.00 1.00 C ATOM 472 O GLU A 31 114.992 16.632 12.856 1.00 1.00 O ATOM 473 CB GLU A 31 115.292 13.421 13.023 1.00 1.00 C ATOM 474 CG GLU A 31 115.448 12.077 12.355 1.00 1.00 C ATOM 475 CD GLU A 31 115.874 11.026 13.375 1.00 1.00 C ATOM 476 OE1 GLU A 31 115.998 11.375 14.538 1.00 1.00 O ATOM 477 OE2 GLU A 31 116.069 9.888 12.980 1.00 1.00 O ATOM 0 H GLU A 31 115.222 13.061 10.520 1.00 1.00 H new ATOM 0 HA GLU A 31 113.637 14.543 12.274 1.00 1.00 H new ATOM 0 HB2 GLU A 31 116.260 13.779 13.374 1.00 1.00 H new ATOM 0 HB3 GLU A 31 114.648 13.331 13.898 1.00 1.00 H new ATOM 0 HG2 GLU A 31 114.507 11.783 11.891 1.00 1.00 H new ATOM 0 HG3 GLU A 31 116.190 12.143 11.559 1.00 1.00 H new ATOM 484 N HIS A 32 116.538 15.831 11.444 1.00 1.00 N ATOM 485 CA HIS A 32 117.300 17.057 11.478 1.00 1.00 C ATOM 486 C HIS A 32 116.507 18.194 10.828 1.00 1.00 C ATOM 487 O HIS A 32 116.445 19.300 11.363 1.00 1.00 O ATOM 488 CB HIS A 32 118.640 16.888 10.755 1.00 1.00 C ATOM 489 CG HIS A 32 119.546 15.996 11.561 1.00 1.00 C ATOM 490 ND1 HIS A 32 119.885 14.720 11.145 1.00 1.00 N ATOM 491 CD2 HIS A 32 120.195 16.184 12.758 1.00 1.00 C ATOM 492 CE1 HIS A 32 120.703 14.192 12.072 1.00 1.00 C ATOM 493 NE2 HIS A 32 120.925 15.044 13.077 1.00 1.00 N ATOM 0 H HIS A 32 116.922 15.095 10.851 1.00 1.00 H new ATOM 0 HA HIS A 32 117.494 17.303 12.522 1.00 1.00 H new ATOM 0 HB2 HIS A 32 118.478 16.459 9.766 1.00 1.00 H new ATOM 0 HB3 HIS A 32 119.109 17.861 10.608 1.00 1.00 H new ATOM 0 HD1 HIS A 32 119.571 14.263 10.289 1.00 1.00 H new ATOM 0 HD2 HIS A 32 120.146 17.080 13.359 1.00 1.00 H new ATOM 0 HE1 HIS A 32 121.128 13.201 12.012 1.00 1.00 H new ATOM 501 N SER A 33 115.916 17.922 9.660 1.00 1.00 N ATOM 502 CA SER A 33 115.146 18.923 8.930 1.00 1.00 C ATOM 503 C SER A 33 113.920 19.383 9.695 1.00 1.00 C ATOM 504 O SER A 33 113.561 20.557 9.652 1.00 1.00 O ATOM 505 CB SER A 33 114.733 18.357 7.578 1.00 1.00 C ATOM 506 OG SER A 33 115.900 17.912 6.925 1.00 1.00 O ATOM 0 H SER A 33 115.959 17.012 9.202 1.00 1.00 H new ATOM 0 HA SER A 33 115.784 19.796 8.795 1.00 1.00 H new ATOM 0 HB2 SER A 33 114.029 17.534 7.707 1.00 1.00 H new ATOM 0 HB3 SER A 33 114.228 19.118 6.983 1.00 1.00 H new ATOM 0 HG SER A 33 116.178 18.578 6.262 1.00 1.00 H new ATOM 512 N LYS A 34 113.279 18.472 10.416 1.00 1.00 N ATOM 513 CA LYS A 34 112.115 18.847 11.188 1.00 1.00 C ATOM 514 C LYS A 34 112.532 19.918 12.168 1.00 1.00 C ATOM 515 O LYS A 34 111.740 20.772 12.568 1.00 1.00 O ATOM 516 CB LYS A 34 111.567 17.644 11.945 1.00 1.00 C ATOM 517 CG LYS A 34 110.954 16.657 10.948 1.00 1.00 C ATOM 518 CD LYS A 34 110.674 15.318 11.637 1.00 1.00 C ATOM 519 CE LYS A 34 110.755 14.185 10.613 1.00 1.00 C ATOM 520 NZ LYS A 34 109.847 13.080 11.030 1.00 1.00 N ATOM 0 H LYS A 34 113.543 17.489 10.479 1.00 1.00 H new ATOM 0 HA LYS A 34 111.333 19.216 10.524 1.00 1.00 H new ATOM 0 HB2 LYS A 34 112.364 17.161 12.510 1.00 1.00 H new ATOM 0 HB3 LYS A 34 110.815 17.965 12.666 1.00 1.00 H new ATOM 0 HG2 LYS A 34 110.029 17.066 10.542 1.00 1.00 H new ATOM 0 HG3 LYS A 34 111.633 16.508 10.108 1.00 1.00 H new ATOM 0 HD2 LYS A 34 111.396 15.151 12.436 1.00 1.00 H new ATOM 0 HD3 LYS A 34 109.686 15.335 12.098 1.00 1.00 H new ATOM 0 HE2 LYS A 34 110.472 14.551 9.626 1.00 1.00 H new ATOM 0 HE3 LYS A 34 111.779 13.820 10.537 1.00 1.00 H new ATOM 0 HZ1 LYS A 34 109.899 12.307 10.336 1.00 1.00 H new ATOM 0 HZ2 LYS A 34 110.137 12.727 11.964 1.00 1.00 H new ATOM 0 HZ3 LYS A 34 108.870 13.434 11.081 1.00 1.00 H new ATOM 534 N GLN A 35 113.789 19.823 12.586 1.00 1.00 N ATOM 535 CA GLN A 35 114.321 20.752 13.571 1.00 1.00 C ATOM 536 C GLN A 35 115.073 21.895 12.929 1.00 1.00 C ATOM 537 O GLN A 35 114.973 23.042 13.366 1.00 1.00 O ATOM 538 CB GLN A 35 115.287 20.018 14.494 1.00 1.00 C ATOM 539 CG GLN A 35 114.569 18.836 15.107 1.00 1.00 C ATOM 540 CD GLN A 35 115.514 18.056 16.016 1.00 1.00 C ATOM 541 OE1 GLN A 35 116.476 17.449 15.543 1.00 1.00 O ATOM 542 NE2 GLN A 35 115.296 18.037 17.303 1.00 1.00 N ATOM 0 H GLN A 35 114.452 19.119 12.261 1.00 1.00 H new ATOM 0 HA GLN A 35 113.471 21.156 14.122 1.00 1.00 H new ATOM 0 HB2 GLN A 35 116.161 19.681 13.936 1.00 1.00 H new ATOM 0 HB3 GLN A 35 115.646 20.688 15.275 1.00 1.00 H new ATOM 0 HG2 GLN A 35 113.707 19.181 15.678 1.00 1.00 H new ATOM 0 HG3 GLN A 35 114.190 18.184 14.320 1.00 1.00 H new ATOM 0 HE21 GLN A 35 114.499 18.540 17.693 1.00 1.00 H new ATOM 0 HE22 GLN A 35 115.923 17.519 17.919 1.00 1.00 H new ATOM 551 N ASP A 36 115.865 21.574 11.919 1.00 1.00 N ATOM 552 CA ASP A 36 116.685 22.576 11.243 1.00 1.00 C ATOM 553 C ASP A 36 116.048 23.132 9.961 1.00 1.00 C ATOM 554 O ASP A 36 116.402 24.226 9.521 1.00 1.00 O ATOM 555 CB ASP A 36 118.048 21.966 10.908 1.00 1.00 C ATOM 556 CG ASP A 36 118.842 21.724 12.188 1.00 1.00 C ATOM 557 OD1 ASP A 36 118.481 22.295 13.206 1.00 1.00 O ATOM 558 OD2 ASP A 36 119.798 20.967 12.134 1.00 1.00 O ATOM 0 H ASP A 36 115.960 20.629 11.547 1.00 1.00 H new ATOM 0 HA ASP A 36 116.785 23.416 11.930 1.00 1.00 H new ATOM 0 HB2 ASP A 36 117.913 21.027 10.371 1.00 1.00 H new ATOM 0 HB3 ASP A 36 118.602 22.634 10.248 1.00 1.00 H new ATOM 563 N HIS A 37 115.093 22.399 9.384 1.00 1.00 N ATOM 564 CA HIS A 37 114.390 22.851 8.175 1.00 1.00 C ATOM 565 C HIS A 37 115.249 22.781 6.910 1.00 1.00 C ATOM 566 O HIS A 37 114.909 23.391 5.896 1.00 1.00 O ATOM 567 CB HIS A 37 113.896 24.286 8.366 1.00 1.00 C ATOM 568 CG HIS A 37 113.467 24.483 9.794 1.00 1.00 C ATOM 569 ND1 HIS A 37 114.174 25.286 10.674 1.00 1.00 N ATOM 570 CD2 HIS A 37 112.407 23.983 10.510 1.00 1.00 C ATOM 571 CE1 HIS A 37 113.539 25.245 11.859 1.00 1.00 C ATOM 572 NE2 HIS A 37 112.455 24.466 11.814 1.00 1.00 N ATOM 0 H HIS A 37 114.787 21.490 9.732 1.00 1.00 H new ATOM 0 HA HIS A 37 113.553 22.168 8.034 1.00 1.00 H new ATOM 0 HB2 HIS A 37 114.688 24.991 8.112 1.00 1.00 H new ATOM 0 HB3 HIS A 37 113.062 24.487 7.694 1.00 1.00 H new ATOM 0 HD1 HIS A 37 115.022 25.812 10.462 1.00 1.00 H new ATOM 0 HD2 HIS A 37 111.652 23.317 10.120 1.00 1.00 H new ATOM 0 HE1 HIS A 37 113.866 25.777 12.740 1.00 1.00 H new ATOM 580 N LYS A 38 116.365 22.061 6.968 1.00 1.00 N ATOM 581 CA LYS A 38 117.255 21.957 5.811 1.00 1.00 C ATOM 582 C LYS A 38 116.696 20.987 4.745 1.00 1.00 C ATOM 583 O LYS A 38 116.374 19.847 5.073 1.00 1.00 O ATOM 584 CB LYS A 38 118.617 21.439 6.276 1.00 1.00 C ATOM 585 CG LYS A 38 119.542 22.616 6.588 1.00 1.00 C ATOM 586 CD LYS A 38 120.681 22.141 7.493 1.00 1.00 C ATOM 587 CE LYS A 38 121.972 22.866 7.110 1.00 1.00 C ATOM 588 NZ LYS A 38 121.689 24.317 6.928 1.00 1.00 N ATOM 0 H LYS A 38 116.674 21.546 7.792 1.00 1.00 H new ATOM 0 HA LYS A 38 117.343 22.947 5.363 1.00 1.00 H new ATOM 0 HB2 LYS A 38 118.496 20.816 7.162 1.00 1.00 H new ATOM 0 HB3 LYS A 38 119.061 20.811 5.503 1.00 1.00 H new ATOM 0 HG2 LYS A 38 119.945 23.031 5.664 1.00 1.00 H new ATOM 0 HG3 LYS A 38 118.982 23.413 7.077 1.00 1.00 H new ATOM 0 HD2 LYS A 38 120.437 22.338 8.537 1.00 1.00 H new ATOM 0 HD3 LYS A 38 120.813 21.064 7.394 1.00 1.00 H new ATOM 0 HE2 LYS A 38 122.725 22.726 7.886 1.00 1.00 H new ATOM 0 HE3 LYS A 38 122.379 22.445 6.191 1.00 1.00 H new ATOM 0 HZ1 LYS A 38 122.575 24.820 6.717 1.00 1.00 H new ATOM 0 HZ2 LYS A 38 121.023 24.445 6.140 1.00 1.00 H new ATOM 0 HZ3 LYS A 38 121.272 24.701 7.800 1.00 1.00 H new ATOM 602 N PRO A 39 116.597 21.384 3.481 1.00 1.00 N ATOM 603 CA PRO A 39 116.096 20.471 2.407 1.00 1.00 C ATOM 604 C PRO A 39 116.935 19.193 2.310 1.00 1.00 C ATOM 605 O PRO A 39 118.114 19.190 2.667 1.00 1.00 O ATOM 606 CB PRO A 39 116.219 21.270 1.107 1.00 1.00 C ATOM 607 CG PRO A 39 116.499 22.687 1.482 1.00 1.00 C ATOM 608 CD PRO A 39 116.926 22.720 2.950 1.00 1.00 C ATOM 0 HA PRO A 39 115.074 20.155 2.614 1.00 1.00 H new ATOM 0 HB2 PRO A 39 117.021 20.871 0.485 1.00 1.00 H new ATOM 0 HB3 PRO A 39 115.300 21.201 0.525 1.00 1.00 H new ATOM 0 HG2 PRO A 39 117.285 23.099 0.849 1.00 1.00 H new ATOM 0 HG3 PRO A 39 115.612 23.302 1.331 1.00 1.00 H new ATOM 0 HD2 PRO A 39 117.991 22.930 3.045 1.00 1.00 H new ATOM 0 HD3 PRO A 39 116.397 23.501 3.496 1.00 1.00 H new ATOM 616 N ILE A 40 116.313 18.108 1.847 1.00 1.00 N ATOM 617 CA ILE A 40 117.007 16.824 1.732 1.00 1.00 C ATOM 618 C ILE A 40 117.210 16.453 0.265 1.00 1.00 C ATOM 619 O ILE A 40 116.269 16.507 -0.524 1.00 1.00 O ATOM 620 CB ILE A 40 116.188 15.707 2.388 1.00 1.00 C ATOM 621 CG1 ILE A 40 115.382 16.261 3.573 1.00 1.00 C ATOM 622 CG2 ILE A 40 117.140 14.617 2.887 1.00 1.00 C ATOM 623 CD1 ILE A 40 114.519 15.148 4.175 1.00 1.00 C ATOM 0 H ILE A 40 115.338 18.091 1.548 1.00 1.00 H new ATOM 0 HA ILE A 40 117.970 16.928 2.232 1.00 1.00 H new ATOM 0 HB ILE A 40 115.496 15.293 1.655 1.00 1.00 H new ATOM 0 HG12 ILE A 40 116.057 16.660 4.330 1.00 1.00 H new ATOM 0 HG13 ILE A 40 114.750 17.086 3.242 1.00 1.00 H new ATOM 0 HG21 ILE A 40 116.565 13.818 3.355 1.00 1.00 H new ATOM 0 HG22 ILE A 40 117.704 14.213 2.046 1.00 1.00 H new ATOM 0 HG23 ILE A 40 117.830 15.042 3.616 1.00 1.00 H new ATOM 0 HD11 ILE A 40 113.949 15.544 5.015 1.00 1.00 H new ATOM 0 HD12 ILE A 40 113.833 14.769 3.417 1.00 1.00 H new ATOM 0 HD13 ILE A 40 115.160 14.338 4.522 1.00 1.00 H new ATOM 635 N GLY A 41 118.422 16.035 -0.083 1.00 1.00 N ATOM 636 CA GLY A 41 118.713 15.609 -1.446 1.00 1.00 C ATOM 637 C GLY A 41 118.879 14.091 -1.483 1.00 1.00 C ATOM 638 O GLY A 41 119.815 13.552 -0.891 1.00 1.00 O ATOM 0 H GLY A 41 119.215 15.982 0.557 1.00 1.00 H new ATOM 0 HA2 GLY A 41 117.906 15.913 -2.113 1.00 1.00 H new ATOM 0 HA3 GLY A 41 119.622 16.093 -1.803 1.00 1.00 H new ATOM 642 N LEU A 42 117.992 13.410 -2.212 1.00 1.00 N ATOM 643 CA LEU A 42 118.085 11.962 -2.351 1.00 1.00 C ATOM 644 C LEU A 42 118.812 11.655 -3.651 1.00 1.00 C ATOM 645 O LEU A 42 118.378 12.062 -4.728 1.00 1.00 O ATOM 646 CB LEU A 42 116.704 11.290 -2.443 1.00 1.00 C ATOM 647 CG LEU A 42 115.797 11.619 -1.251 1.00 1.00 C ATOM 648 CD1 LEU A 42 115.576 13.118 -1.116 1.00 1.00 C ATOM 649 CD2 LEU A 42 114.436 10.968 -1.485 1.00 1.00 C ATOM 0 H LEU A 42 117.210 13.836 -2.709 1.00 1.00 H new ATOM 0 HA LEU A 42 118.604 11.581 -1.471 1.00 1.00 H new ATOM 0 HB2 LEU A 42 116.213 11.605 -3.364 1.00 1.00 H new ATOM 0 HB3 LEU A 42 116.835 10.210 -2.505 1.00 1.00 H new ATOM 0 HG LEU A 42 116.276 11.248 -0.345 1.00 1.00 H new ATOM 0 HD11 LEU A 42 114.929 13.315 -0.261 1.00 1.00 H new ATOM 0 HD12 LEU A 42 116.535 13.615 -0.967 1.00 1.00 H new ATOM 0 HD13 LEU A 42 115.106 13.500 -2.022 1.00 1.00 H new ATOM 0 HD21 LEU A 42 113.777 11.191 -0.646 1.00 1.00 H new ATOM 0 HD22 LEU A 42 113.999 11.359 -2.404 1.00 1.00 H new ATOM 0 HD23 LEU A 42 114.559 9.888 -1.572 1.00 1.00 H new ATOM 661 N PHE A 43 119.927 10.954 -3.545 1.00 1.00 N ATOM 662 CA PHE A 43 120.712 10.624 -4.727 1.00 1.00 C ATOM 663 C PHE A 43 120.326 9.236 -5.242 1.00 1.00 C ATOM 664 O PHE A 43 120.703 8.225 -4.648 1.00 1.00 O ATOM 665 CB PHE A 43 122.198 10.673 -4.344 1.00 1.00 C ATOM 666 CG PHE A 43 123.090 10.672 -5.567 1.00 1.00 C ATOM 667 CD1 PHE A 43 122.992 11.698 -6.518 1.00 1.00 C ATOM 668 CD2 PHE A 43 124.040 9.653 -5.734 1.00 1.00 C ATOM 669 CE1 PHE A 43 123.835 11.699 -7.635 1.00 1.00 C ATOM 670 CE2 PHE A 43 124.884 9.661 -6.850 1.00 1.00 C ATOM 671 CZ PHE A 43 124.780 10.682 -7.801 1.00 1.00 C ATOM 0 H PHE A 43 120.308 10.605 -2.666 1.00 1.00 H new ATOM 0 HA PHE A 43 120.517 11.340 -5.526 1.00 1.00 H new ATOM 0 HB2 PHE A 43 122.392 11.568 -3.752 1.00 1.00 H new ATOM 0 HB3 PHE A 43 122.441 9.816 -3.716 1.00 1.00 H new ATOM 0 HD1 PHE A 43 122.266 12.487 -6.388 1.00 1.00 H new ATOM 0 HD2 PHE A 43 124.120 8.863 -5.002 1.00 1.00 H new ATOM 0 HE1 PHE A 43 123.756 12.486 -8.370 1.00 1.00 H new ATOM 0 HE2 PHE A 43 125.617 8.878 -6.978 1.00 1.00 H new ATOM 0 HZ PHE A 43 125.430 10.685 -8.664 1.00 1.00 H new ATOM 681 N PHE A 44 119.603 9.183 -6.368 1.00 1.00 N ATOM 682 CA PHE A 44 119.203 7.912 -6.982 1.00 1.00 C ATOM 683 C PHE A 44 120.197 7.547 -8.078 1.00 1.00 C ATOM 684 O PHE A 44 120.411 8.332 -9.003 1.00 1.00 O ATOM 685 CB PHE A 44 117.800 8.024 -7.578 1.00 1.00 C ATOM 686 CG PHE A 44 116.779 7.908 -6.476 1.00 1.00 C ATOM 687 CD1 PHE A 44 116.348 9.051 -5.789 1.00 1.00 C ATOM 688 CD2 PHE A 44 116.258 6.652 -6.145 1.00 1.00 C ATOM 689 CE1 PHE A 44 115.395 8.931 -4.772 1.00 1.00 C ATOM 690 CE2 PHE A 44 115.309 6.536 -5.128 1.00 1.00 C ATOM 691 CZ PHE A 44 114.879 7.675 -4.444 1.00 1.00 C ATOM 0 H PHE A 44 119.283 10.009 -6.873 1.00 1.00 H new ATOM 0 HA PHE A 44 119.195 7.136 -6.217 1.00 1.00 H new ATOM 0 HB2 PHE A 44 117.687 8.977 -8.095 1.00 1.00 H new ATOM 0 HB3 PHE A 44 117.643 7.239 -8.318 1.00 1.00 H new ATOM 0 HD1 PHE A 44 116.750 10.020 -6.044 1.00 1.00 H new ATOM 0 HD2 PHE A 44 116.590 5.772 -6.676 1.00 1.00 H new ATOM 0 HE1 PHE A 44 115.058 9.809 -4.241 1.00 1.00 H new ATOM 0 HE2 PHE A 44 114.908 5.567 -4.871 1.00 1.00 H new ATOM 0 HZ PHE A 44 114.144 7.584 -3.658 1.00 1.00 H new ATOM 701 N THR A 45 120.813 6.365 -7.969 1.00 1.00 N ATOM 702 CA THR A 45 121.795 5.964 -8.979 1.00 1.00 C ATOM 703 C THR A 45 121.988 4.449 -9.119 1.00 1.00 C ATOM 704 O THR A 45 121.356 3.651 -8.429 1.00 1.00 O ATOM 705 CB THR A 45 123.143 6.609 -8.649 1.00 1.00 C ATOM 706 OG1 THR A 45 123.433 6.402 -7.274 1.00 1.00 O ATOM 707 CG2 THR A 45 123.087 8.109 -8.934 1.00 1.00 C ATOM 0 H THR A 45 120.657 5.691 -7.220 1.00 1.00 H new ATOM 0 HA THR A 45 121.400 6.308 -9.935 1.00 1.00 H new ATOM 0 HB THR A 45 123.920 6.157 -9.266 1.00 1.00 H new ATOM 0 HG1 THR A 45 123.744 7.242 -6.875 1.00 1.00 H new ATOM 0 HG21 THR A 45 124.050 8.561 -8.697 1.00 1.00 H new ATOM 0 HG22 THR A 45 122.860 8.271 -9.988 1.00 1.00 H new ATOM 0 HG23 THR A 45 122.311 8.567 -8.321 1.00 1.00 H new ATOM 715 N GLY A 46 122.945 4.094 -9.979 1.00 1.00 N ATOM 716 CA GLY A 46 123.362 2.716 -10.212 1.00 1.00 C ATOM 717 C GLY A 46 124.880 2.719 -10.131 1.00 1.00 C ATOM 718 O GLY A 46 125.571 2.957 -11.120 1.00 1.00 O ATOM 0 H GLY A 46 123.459 4.771 -10.542 1.00 1.00 H new ATOM 0 HA2 GLY A 46 122.933 2.047 -9.466 1.00 1.00 H new ATOM 0 HA3 GLY A 46 123.024 2.365 -11.187 1.00 1.00 H new ATOM 722 N SER A 47 125.379 2.538 -8.918 1.00 1.00 N ATOM 723 CA SER A 47 126.807 2.607 -8.639 1.00 1.00 C ATOM 724 C SER A 47 127.687 1.676 -9.469 1.00 1.00 C ATOM 725 O SER A 47 128.832 2.027 -9.756 1.00 1.00 O ATOM 726 CB SER A 47 127.040 2.310 -7.157 1.00 1.00 C ATOM 727 OG SER A 47 126.510 3.375 -6.377 1.00 1.00 O ATOM 0 H SER A 47 124.806 2.339 -8.098 1.00 1.00 H new ATOM 0 HA SER A 47 127.106 3.618 -8.917 1.00 1.00 H new ATOM 0 HB2 SER A 47 126.562 1.370 -6.883 1.00 1.00 H new ATOM 0 HB3 SER A 47 128.106 2.195 -6.960 1.00 1.00 H new ATOM 0 HG SER A 47 126.656 3.188 -5.426 1.00 1.00 H new ATOM 733 N ASP A 48 127.209 0.478 -9.804 1.00 1.00 N ATOM 734 CA ASP A 48 128.039 -0.478 -10.532 1.00 1.00 C ATOM 735 C ASP A 48 127.706 -0.616 -12.019 1.00 1.00 C ATOM 736 O ASP A 48 128.396 -1.367 -12.711 1.00 1.00 O ATOM 737 CB ASP A 48 127.889 -1.850 -9.877 1.00 1.00 C ATOM 738 CG ASP A 48 128.538 -1.857 -8.497 1.00 1.00 C ATOM 739 OD1 ASP A 48 129.300 -0.945 -8.215 1.00 1.00 O ATOM 740 OD2 ASP A 48 128.264 -2.777 -7.742 1.00 1.00 O ATOM 0 H ASP A 48 126.268 0.151 -9.587 1.00 1.00 H new ATOM 0 HA ASP A 48 129.058 -0.094 -10.481 1.00 1.00 H new ATOM 0 HB2 ASP A 48 126.833 -2.104 -9.790 1.00 1.00 H new ATOM 0 HB3 ASP A 48 128.350 -2.612 -10.506 1.00 1.00 H new ATOM 745 N TRP A 49 126.643 0.032 -12.520 1.00 1.00 N ATOM 746 CA TRP A 49 126.294 -0.161 -13.937 1.00 1.00 C ATOM 747 C TRP A 49 126.006 1.122 -14.707 1.00 1.00 C ATOM 748 O TRP A 49 126.112 1.122 -15.934 1.00 1.00 O ATOM 749 CB TRP A 49 125.077 -1.081 -14.050 1.00 1.00 C ATOM 750 CG TRP A 49 124.072 -0.721 -13.007 1.00 1.00 C ATOM 751 CD1 TRP A 49 124.247 -0.894 -11.680 1.00 1.00 C ATOM 752 CD2 TRP A 49 122.741 -0.146 -13.176 1.00 1.00 C ATOM 753 NE1 TRP A 49 123.116 -0.459 -11.019 1.00 1.00 N ATOM 754 CE2 TRP A 49 122.156 0.010 -11.896 1.00 1.00 C ATOM 755 CE3 TRP A 49 121.993 0.252 -14.300 1.00 1.00 C ATOM 756 CZ2 TRP A 49 120.875 0.541 -11.738 1.00 1.00 C ATOM 757 CZ3 TRP A 49 120.702 0.788 -14.143 1.00 1.00 C ATOM 758 CH2 TRP A 49 120.144 0.931 -12.865 1.00 1.00 C ATOM 0 H TRP A 49 126.037 0.664 -11.997 1.00 1.00 H new ATOM 0 HA TRP A 49 127.181 -0.602 -14.392 1.00 1.00 H new ATOM 0 HB2 TRP A 49 124.633 -0.992 -15.042 1.00 1.00 H new ATOM 0 HB3 TRP A 49 125.383 -2.120 -13.930 1.00 1.00 H new ATOM 0 HD1 TRP A 49 125.129 -1.306 -11.211 1.00 1.00 H new ATOM 0 HE1 TRP A 49 123.002 -0.481 -10.006 1.00 1.00 H new ATOM 0 HE3 TRP A 49 122.413 0.145 -15.289 1.00 1.00 H new ATOM 0 HZ2 TRP A 49 120.450 0.650 -10.751 1.00 1.00 H new ATOM 0 HZ3 TRP A 49 120.137 1.091 -15.012 1.00 1.00 H new ATOM 0 HH2 TRP A 49 119.152 1.341 -12.751 1.00 1.00 H new ATOM 769 N CYS A 50 125.671 2.212 -14.032 1.00 1.00 N ATOM 770 CA CYS A 50 125.411 3.464 -14.734 1.00 1.00 C ATOM 771 C CYS A 50 126.657 4.348 -14.664 1.00 1.00 C ATOM 772 O CYS A 50 127.396 4.308 -13.680 1.00 1.00 O ATOM 773 CB CYS A 50 124.213 4.175 -14.111 1.00 1.00 C ATOM 774 SG CYS A 50 124.576 5.938 -14.001 1.00 1.00 S ATOM 0 H CYS A 50 125.574 2.258 -13.018 1.00 1.00 H new ATOM 0 HA CYS A 50 125.179 3.257 -15.779 1.00 1.00 H new ATOM 0 HB2 CYS A 50 123.321 4.010 -14.715 1.00 1.00 H new ATOM 0 HB3 CYS A 50 124.007 3.770 -13.120 1.00 1.00 H new ATOM 779 N MET A 51 126.912 5.112 -15.727 1.00 1.00 N ATOM 780 CA MET A 51 128.106 5.961 -15.776 1.00 1.00 C ATOM 781 C MET A 51 127.794 7.441 -15.557 1.00 1.00 C ATOM 782 O MET A 51 128.594 8.154 -14.950 1.00 1.00 O ATOM 783 CB MET A 51 128.794 5.783 -17.130 1.00 1.00 C ATOM 784 CG MET A 51 130.125 6.535 -17.132 1.00 1.00 C ATOM 785 SD MET A 51 130.953 6.292 -18.721 1.00 1.00 S ATOM 786 CE MET A 51 132.548 5.764 -18.055 1.00 1.00 C ATOM 0 H MET A 51 126.318 5.162 -16.555 1.00 1.00 H new ATOM 0 HA MET A 51 128.759 5.648 -14.962 1.00 1.00 H new ATOM 0 HB2 MET A 51 128.963 4.724 -17.327 1.00 1.00 H new ATOM 0 HB3 MET A 51 128.152 6.157 -17.927 1.00 1.00 H new ATOM 0 HG2 MET A 51 129.955 7.597 -16.957 1.00 1.00 H new ATOM 0 HG3 MET A 51 130.759 6.176 -16.321 1.00 1.00 H new ATOM 0 HE1 MET A 51 133.234 5.555 -18.876 1.00 1.00 H new ATOM 0 HE2 MET A 51 132.961 6.555 -17.430 1.00 1.00 H new ATOM 0 HE3 MET A 51 132.412 4.863 -17.457 1.00 1.00 H new ATOM 796 N TRP A 52 126.649 7.912 -16.036 1.00 1.00 N ATOM 797 CA TRP A 52 126.288 9.314 -15.856 1.00 1.00 C ATOM 798 C TRP A 52 126.217 9.621 -14.370 1.00 1.00 C ATOM 799 O TRP A 52 126.458 10.748 -13.942 1.00 1.00 O ATOM 800 CB TRP A 52 124.931 9.601 -16.501 1.00 1.00 C ATOM 801 CG TRP A 52 125.046 9.482 -17.988 1.00 1.00 C ATOM 802 CD1 TRP A 52 125.822 10.264 -18.773 1.00 1.00 C ATOM 803 CD2 TRP A 52 124.383 8.539 -18.877 1.00 1.00 C ATOM 804 NE1 TRP A 52 125.676 9.861 -20.088 1.00 1.00 N ATOM 805 CE2 TRP A 52 124.800 8.802 -20.204 1.00 1.00 C ATOM 806 CE3 TRP A 52 123.470 7.492 -18.664 1.00 1.00 C ATOM 807 CZ2 TRP A 52 124.326 8.051 -21.281 1.00 1.00 C ATOM 808 CZ3 TRP A 52 122.991 6.735 -19.746 1.00 1.00 C ATOM 809 CH2 TRP A 52 123.419 7.014 -21.051 1.00 1.00 C ATOM 0 H TRP A 52 125.963 7.354 -16.545 1.00 1.00 H new ATOM 0 HA TRP A 52 127.042 9.941 -16.332 1.00 1.00 H new ATOM 0 HB2 TRP A 52 124.184 8.901 -16.127 1.00 1.00 H new ATOM 0 HB3 TRP A 52 124.593 10.602 -16.231 1.00 1.00 H new ATOM 0 HD1 TRP A 52 126.452 11.071 -18.429 1.00 1.00 H new ATOM 0 HE1 TRP A 52 126.157 10.294 -20.876 1.00 1.00 H new ATOM 0 HE3 TRP A 52 123.135 7.268 -17.662 1.00 1.00 H new ATOM 0 HZ2 TRP A 52 124.658 8.270 -22.285 1.00 1.00 H new ATOM 0 HZ3 TRP A 52 122.289 5.933 -19.571 1.00 1.00 H new ATOM 0 HH2 TRP A 52 123.048 6.427 -21.878 1.00 1.00 H new ATOM 820 N CYS A 53 125.891 8.603 -13.593 1.00 1.00 N ATOM 821 CA CYS A 53 125.794 8.761 -12.155 1.00 1.00 C ATOM 822 C CYS A 53 127.162 9.019 -11.575 1.00 1.00 C ATOM 823 O CYS A 53 127.334 9.889 -10.724 1.00 1.00 O ATOM 824 CB CYS A 53 125.212 7.506 -11.510 1.00 1.00 C ATOM 825 SG CYS A 53 125.807 6.061 -12.411 1.00 1.00 S ATOM 0 H CYS A 53 125.690 7.663 -13.933 1.00 1.00 H new ATOM 0 HA CYS A 53 125.136 9.605 -11.950 1.00 1.00 H new ATOM 0 HB2 CYS A 53 125.510 7.447 -10.463 1.00 1.00 H new ATOM 0 HB3 CYS A 53 124.123 7.541 -11.530 1.00 1.00 H new ATOM 830 N ILE A 54 128.139 8.271 -12.059 1.00 1.00 N ATOM 831 CA ILE A 54 129.489 8.442 -11.592 1.00 1.00 C ATOM 832 C ILE A 54 129.942 9.844 -11.924 1.00 1.00 C ATOM 833 O ILE A 54 130.561 10.514 -11.102 1.00 1.00 O ATOM 834 CB ILE A 54 130.413 7.442 -12.271 1.00 1.00 C ATOM 835 CG1 ILE A 54 130.059 6.026 -11.811 1.00 1.00 C ATOM 836 CG2 ILE A 54 131.860 7.756 -11.896 1.00 1.00 C ATOM 837 CD1 ILE A 54 130.826 5.003 -12.652 1.00 1.00 C ATOM 0 H ILE A 54 128.017 7.548 -12.768 1.00 1.00 H new ATOM 0 HA ILE A 54 129.523 8.277 -10.515 1.00 1.00 H new ATOM 0 HB ILE A 54 130.295 7.510 -13.352 1.00 1.00 H new ATOM 0 HG12 ILE A 54 130.307 5.903 -10.757 1.00 1.00 H new ATOM 0 HG13 ILE A 54 128.986 5.859 -11.908 1.00 1.00 H new ATOM 0 HG21 ILE A 54 132.525 7.041 -12.381 1.00 1.00 H new ATOM 0 HG22 ILE A 54 132.110 8.765 -12.224 1.00 1.00 H new ATOM 0 HG23 ILE A 54 131.979 7.686 -10.815 1.00 1.00 H new ATOM 0 HD11 ILE A 54 130.571 3.996 -12.321 1.00 1.00 H new ATOM 0 HD12 ILE A 54 130.556 5.119 -13.702 1.00 1.00 H new ATOM 0 HD13 ILE A 54 131.897 5.164 -12.533 1.00 1.00 H new ATOM 849 N LYS A 55 129.665 10.282 -13.155 1.00 1.00 N ATOM 850 CA LYS A 55 130.083 11.597 -13.596 1.00 1.00 C ATOM 851 C LYS A 55 129.435 12.682 -12.753 1.00 1.00 C ATOM 852 O LYS A 55 130.112 13.609 -12.318 1.00 1.00 O ATOM 853 CB LYS A 55 129.723 11.804 -15.074 1.00 1.00 C ATOM 854 CG LYS A 55 130.396 10.746 -15.972 1.00 1.00 C ATOM 855 CD LYS A 55 131.916 10.965 -16.061 1.00 1.00 C ATOM 856 CE LYS A 55 132.507 9.954 -17.049 1.00 1.00 C ATOM 857 NZ LYS A 55 133.985 10.133 -17.132 1.00 1.00 N ATOM 0 H LYS A 55 129.155 9.742 -13.854 1.00 1.00 H new ATOM 0 HA LYS A 55 131.165 11.664 -13.478 1.00 1.00 H new ATOM 0 HB2 LYS A 55 128.641 11.752 -15.197 1.00 1.00 H new ATOM 0 HB3 LYS A 55 130.032 12.801 -15.389 1.00 1.00 H new ATOM 0 HG2 LYS A 55 130.194 9.750 -15.577 1.00 1.00 H new ATOM 0 HG3 LYS A 55 129.963 10.787 -16.971 1.00 1.00 H new ATOM 0 HD2 LYS A 55 132.132 11.982 -16.388 1.00 1.00 H new ATOM 0 HD3 LYS A 55 132.372 10.843 -15.079 1.00 1.00 H new ATOM 0 HE2 LYS A 55 132.272 8.939 -16.729 1.00 1.00 H new ATOM 0 HE3 LYS A 55 132.059 10.090 -18.034 1.00 1.00 H new ATOM 0 HZ1 LYS A 55 134.381 9.445 -17.804 1.00 1.00 H new ATOM 0 HZ2 LYS A 55 134.200 11.097 -17.457 1.00 1.00 H new ATOM 0 HZ3 LYS A 55 134.406 9.982 -16.193 1.00 1.00 H new ATOM 871 N MET A 56 128.126 12.578 -12.509 1.00 1.00 N ATOM 872 CA MET A 56 127.452 13.581 -11.711 1.00 1.00 C ATOM 873 C MET A 56 128.047 13.564 -10.326 1.00 1.00 C ATOM 874 O MET A 56 128.344 14.602 -9.736 1.00 1.00 O ATOM 875 CB MET A 56 125.949 13.308 -11.630 1.00 1.00 C ATOM 876 CG MET A 56 125.279 14.445 -10.852 1.00 1.00 C ATOM 877 SD MET A 56 123.496 14.166 -10.778 1.00 1.00 S ATOM 878 CE MET A 56 123.176 15.298 -9.406 1.00 1.00 C ATOM 0 H MET A 56 127.530 11.823 -12.848 1.00 1.00 H new ATOM 0 HA MET A 56 127.587 14.557 -12.176 1.00 1.00 H new ATOM 0 HB2 MET A 56 125.525 13.235 -12.631 1.00 1.00 H new ATOM 0 HB3 MET A 56 125.765 12.354 -11.136 1.00 1.00 H new ATOM 0 HG2 MET A 56 125.690 14.500 -9.844 1.00 1.00 H new ATOM 0 HG3 MET A 56 125.487 15.400 -11.334 1.00 1.00 H new ATOM 0 HE1 MET A 56 122.142 15.641 -9.451 1.00 1.00 H new ATOM 0 HE2 MET A 56 123.346 14.782 -8.461 1.00 1.00 H new ATOM 0 HE3 MET A 56 123.846 16.155 -9.477 1.00 1.00 H new ATOM 888 N GLN A 57 128.217 12.350 -9.821 1.00 1.00 N ATOM 889 CA GLN A 57 128.771 12.142 -8.507 1.00 1.00 C ATOM 890 C GLN A 57 130.226 12.588 -8.460 1.00 1.00 C ATOM 891 O GLN A 57 130.622 13.310 -7.547 1.00 1.00 O ATOM 892 CB GLN A 57 128.651 10.660 -8.148 1.00 1.00 C ATOM 893 CG GLN A 57 129.619 10.332 -7.025 1.00 1.00 C ATOM 894 CD GLN A 57 129.207 9.035 -6.334 1.00 1.00 C ATOM 895 OE1 GLN A 57 128.095 8.545 -6.538 1.00 1.00 O ATOM 896 NE2 GLN A 57 130.039 8.449 -5.520 1.00 1.00 N ATOM 0 H GLN A 57 127.974 11.491 -10.314 1.00 1.00 H new ATOM 0 HA GLN A 57 128.218 12.739 -7.782 1.00 1.00 H new ATOM 0 HB2 GLN A 57 127.630 10.430 -7.842 1.00 1.00 H new ATOM 0 HB3 GLN A 57 128.868 10.044 -9.021 1.00 1.00 H new ATOM 0 HG2 GLN A 57 130.629 10.235 -7.423 1.00 1.00 H new ATOM 0 HG3 GLN A 57 129.638 11.147 -6.302 1.00 1.00 H new ATOM 0 HE21 GLN A 57 130.959 8.855 -5.352 1.00 1.00 H new ATOM 0 HE22 GLN A 57 129.770 7.584 -5.051 1.00 1.00 H new ATOM 905 N ASP A 58 131.023 12.168 -9.425 1.00 1.00 N ATOM 906 CA ASP A 58 132.433 12.539 -9.425 1.00 1.00 C ATOM 907 C ASP A 58 132.636 14.022 -9.733 1.00 1.00 C ATOM 908 O ASP A 58 133.554 14.646 -9.199 1.00 1.00 O ATOM 909 CB ASP A 58 133.185 11.694 -10.457 1.00 1.00 C ATOM 910 CG ASP A 58 134.680 12.000 -10.402 1.00 1.00 C ATOM 911 OD1 ASP A 58 135.055 12.905 -9.675 1.00 1.00 O ATOM 912 OD2 ASP A 58 135.429 11.321 -11.083 1.00 1.00 O ATOM 0 H ASP A 58 130.730 11.581 -10.206 1.00 1.00 H new ATOM 0 HA ASP A 58 132.825 12.352 -8.425 1.00 1.00 H new ATOM 0 HB2 ASP A 58 133.016 10.635 -10.263 1.00 1.00 H new ATOM 0 HB3 ASP A 58 132.801 11.900 -11.456 1.00 1.00 H new ATOM 917 N GLN A 59 131.828 14.577 -10.623 1.00 1.00 N ATOM 918 CA GLN A 59 132.016 15.974 -11.001 1.00 1.00 C ATOM 919 C GLN A 59 131.269 16.985 -10.126 1.00 1.00 C ATOM 920 O GLN A 59 131.707 18.131 -10.044 1.00 1.00 O ATOM 921 CB GLN A 59 131.591 16.168 -12.459 1.00 1.00 C ATOM 922 CG GLN A 59 132.462 15.304 -13.375 1.00 1.00 C ATOM 923 CD GLN A 59 133.911 15.780 -13.324 1.00 1.00 C ATOM 924 OE1 GLN A 59 134.180 16.967 -13.504 1.00 1.00 O ATOM 925 NE2 GLN A 59 134.864 14.923 -13.082 1.00 1.00 N ATOM 0 H GLN A 59 131.055 14.100 -11.088 1.00 1.00 H new ATOM 0 HA GLN A 59 133.077 16.176 -10.856 1.00 1.00 H new ATOM 0 HB2 GLN A 59 130.542 15.898 -12.580 1.00 1.00 H new ATOM 0 HB3 GLN A 59 131.685 17.218 -12.738 1.00 1.00 H new ATOM 0 HG2 GLN A 59 132.403 14.260 -13.067 1.00 1.00 H new ATOM 0 HG3 GLN A 59 132.090 15.356 -14.398 1.00 1.00 H new ATOM 0 HE21 GLN A 59 134.639 13.939 -12.933 1.00 1.00 H new ATOM 0 HE22 GLN A 59 135.834 15.237 -13.042 1.00 1.00 H new ATOM 934 N ILE A 60 130.138 16.609 -9.521 1.00 1.00 N ATOM 935 CA ILE A 60 129.382 17.586 -8.721 1.00 1.00 C ATOM 936 C ILE A 60 129.323 17.235 -7.241 1.00 1.00 C ATOM 937 O ILE A 60 129.653 18.078 -6.411 1.00 1.00 O ATOM 938 CB ILE A 60 127.953 17.698 -9.263 1.00 1.00 C ATOM 939 CG1 ILE A 60 128.005 18.207 -10.707 1.00 1.00 C ATOM 940 CG2 ILE A 60 127.137 18.683 -8.412 1.00 1.00 C ATOM 941 CD1 ILE A 60 126.624 18.079 -11.356 1.00 1.00 C ATOM 0 H ILE A 60 129.735 15.673 -9.564 1.00 1.00 H new ATOM 0 HA ILE A 60 129.911 18.535 -8.808 1.00 1.00 H new ATOM 0 HB ILE A 60 127.479 16.717 -9.225 1.00 1.00 H new ATOM 0 HG12 ILE A 60 128.329 19.248 -10.723 1.00 1.00 H new ATOM 0 HG13 ILE A 60 128.738 17.636 -11.277 1.00 1.00 H new ATOM 0 HG21 ILE A 60 126.124 18.753 -8.808 1.00 1.00 H new ATOM 0 HG22 ILE A 60 127.100 18.330 -7.381 1.00 1.00 H new ATOM 0 HG23 ILE A 60 127.607 19.666 -8.442 1.00 1.00 H new ATOM 0 HD11 ILE A 60 126.669 18.443 -12.382 1.00 1.00 H new ATOM 0 HD12 ILE A 60 126.317 17.033 -11.355 1.00 1.00 H new ATOM 0 HD13 ILE A 60 125.901 18.670 -10.793 1.00 1.00 H new ATOM 953 N LEU A 61 128.874 16.047 -6.884 1.00 1.00 N ATOM 954 CA LEU A 61 128.747 15.694 -5.474 1.00 1.00 C ATOM 955 C LEU A 61 130.098 15.745 -4.765 1.00 1.00 C ATOM 956 O LEU A 61 130.187 16.205 -3.627 1.00 1.00 O ATOM 957 CB LEU A 61 128.171 14.283 -5.303 1.00 1.00 C ATOM 958 CG LEU A 61 126.680 14.198 -5.726 1.00 1.00 C ATOM 959 CD1 LEU A 61 125.772 14.759 -4.632 1.00 1.00 C ATOM 960 CD2 LEU A 61 126.410 14.987 -7.003 1.00 1.00 C ATOM 0 H LEU A 61 128.593 15.315 -7.537 1.00 1.00 H new ATOM 0 HA LEU A 61 128.071 16.425 -5.031 1.00 1.00 H new ATOM 0 HB2 LEU A 61 128.755 13.580 -5.897 1.00 1.00 H new ATOM 0 HB3 LEU A 61 128.268 13.977 -4.261 1.00 1.00 H new ATOM 0 HG LEU A 61 126.467 13.143 -5.896 1.00 1.00 H new ATOM 0 HD11 LEU A 61 124.732 14.689 -4.951 1.00 1.00 H new ATOM 0 HD12 LEU A 61 125.910 14.186 -3.715 1.00 1.00 H new ATOM 0 HD13 LEU A 61 126.026 15.803 -4.449 1.00 1.00 H new ATOM 0 HD21 LEU A 61 125.356 14.903 -7.267 1.00 1.00 H new ATOM 0 HD22 LEU A 61 126.662 16.035 -6.843 1.00 1.00 H new ATOM 0 HD23 LEU A 61 127.019 14.587 -7.813 1.00 1.00 H new ATOM 972 N GLN A 62 131.146 15.249 -5.424 1.00 1.00 N ATOM 973 CA GLN A 62 132.476 15.224 -4.821 1.00 1.00 C ATOM 974 C GLN A 62 133.245 16.523 -5.081 1.00 1.00 C ATOM 975 O GLN A 62 134.415 16.636 -4.718 1.00 1.00 O ATOM 976 CB GLN A 62 133.289 14.050 -5.381 1.00 1.00 C ATOM 977 CG GLN A 62 132.591 12.721 -5.072 1.00 1.00 C ATOM 978 CD GLN A 62 132.503 12.500 -3.567 1.00 1.00 C ATOM 979 OE1 GLN A 62 133.502 12.621 -2.860 1.00 1.00 O ATOM 980 NE2 GLN A 62 131.358 12.171 -3.038 1.00 1.00 N ATOM 0 H GLN A 62 131.100 14.863 -6.367 1.00 1.00 H new ATOM 0 HA GLN A 62 132.338 15.111 -3.746 1.00 1.00 H new ATOM 0 HB2 GLN A 62 133.409 14.163 -6.458 1.00 1.00 H new ATOM 0 HB3 GLN A 62 134.289 14.052 -4.947 1.00 1.00 H new ATOM 0 HG2 GLN A 62 131.590 12.720 -5.504 1.00 1.00 H new ATOM 0 HG3 GLN A 62 133.139 11.900 -5.534 1.00 1.00 H new ATOM 0 HE21 GLN A 62 130.533 12.072 -3.629 1.00 1.00 H new ATOM 0 HE22 GLN A 62 131.287 12.013 -2.033 1.00 1.00 H new ATOM 989 N SER A 63 132.602 17.497 -5.722 1.00 1.00 N ATOM 990 CA SER A 63 133.258 18.770 -6.023 1.00 1.00 C ATOM 991 C SER A 63 133.281 19.682 -4.796 1.00 1.00 C ATOM 992 O SER A 63 132.422 19.574 -3.923 1.00 1.00 O ATOM 993 CB SER A 63 132.514 19.473 -7.155 1.00 1.00 C ATOM 994 OG SER A 63 131.443 20.233 -6.609 1.00 1.00 O ATOM 0 H SER A 63 131.635 17.432 -6.041 1.00 1.00 H new ATOM 0 HA SER A 63 134.286 18.561 -6.320 1.00 1.00 H new ATOM 0 HB2 SER A 63 133.194 20.124 -7.705 1.00 1.00 H new ATOM 0 HB3 SER A 63 132.131 18.740 -7.865 1.00 1.00 H new ATOM 0 HG SER A 63 130.631 19.685 -6.588 1.00 1.00 H new ATOM 1000 N SER A 64 134.288 20.553 -4.709 1.00 1.00 N ATOM 1001 CA SER A 64 134.437 21.441 -3.553 1.00 1.00 C ATOM 1002 C SER A 64 133.237 22.356 -3.334 1.00 1.00 C ATOM 1003 O SER A 64 132.794 22.530 -2.200 1.00 1.00 O ATOM 1004 CB SER A 64 135.683 22.309 -3.731 1.00 1.00 C ATOM 1005 OG SER A 64 136.837 21.481 -3.745 1.00 1.00 O ATOM 0 H SER A 64 135.010 20.663 -5.421 1.00 1.00 H new ATOM 0 HA SER A 64 134.522 20.796 -2.678 1.00 1.00 H new ATOM 0 HB2 SER A 64 135.616 22.874 -4.661 1.00 1.00 H new ATOM 0 HB3 SER A 64 135.753 23.035 -2.921 1.00 1.00 H new ATOM 0 HG SER A 64 137.636 22.036 -3.861 1.00 1.00 H new ATOM 1011 N GLU A 65 132.727 22.966 -4.397 1.00 1.00 N ATOM 1012 CA GLU A 65 131.605 23.882 -4.257 1.00 1.00 C ATOM 1013 C GLU A 65 130.366 23.166 -3.735 1.00 1.00 C ATOM 1014 O GLU A 65 129.665 23.683 -2.867 1.00 1.00 O ATOM 1015 CB GLU A 65 131.291 24.516 -5.615 1.00 1.00 C ATOM 1016 CG GLU A 65 132.481 25.359 -6.079 1.00 1.00 C ATOM 1017 CD GLU A 65 132.666 26.559 -5.157 1.00 1.00 C ATOM 1018 OE1 GLU A 65 131.717 26.905 -4.472 1.00 1.00 O ATOM 1019 OE2 GLU A 65 133.752 27.115 -5.152 1.00 1.00 O ATOM 0 H GLU A 65 133.067 22.845 -5.351 1.00 1.00 H new ATOM 0 HA GLU A 65 131.883 24.652 -3.538 1.00 1.00 H new ATOM 0 HB2 GLU A 65 131.075 23.739 -6.349 1.00 1.00 H new ATOM 0 HB3 GLU A 65 130.400 25.139 -5.539 1.00 1.00 H new ATOM 0 HG2 GLU A 65 133.386 24.752 -6.084 1.00 1.00 H new ATOM 0 HG3 GLU A 65 132.319 25.698 -7.102 1.00 1.00 H new ATOM 1026 N PHE A 66 130.106 21.974 -4.255 1.00 1.00 N ATOM 1027 CA PHE A 66 128.958 21.193 -3.822 1.00 1.00 C ATOM 1028 C PHE A 66 129.079 20.790 -2.356 1.00 1.00 C ATOM 1029 O PHE A 66 128.113 20.882 -1.598 1.00 1.00 O ATOM 1030 CB PHE A 66 128.852 19.928 -4.666 1.00 1.00 C ATOM 1031 CG PHE A 66 127.554 19.231 -4.355 1.00 1.00 C ATOM 1032 CD1 PHE A 66 127.470 18.356 -3.265 1.00 1.00 C ATOM 1033 CD2 PHE A 66 126.433 19.461 -5.159 1.00 1.00 C ATOM 1034 CE1 PHE A 66 126.261 17.714 -2.979 1.00 1.00 C ATOM 1035 CE2 PHE A 66 125.226 18.817 -4.873 1.00 1.00 C ATOM 1036 CZ PHE A 66 125.140 17.946 -3.783 1.00 1.00 C ATOM 0 H PHE A 66 130.674 21.528 -4.976 1.00 1.00 H new ATOM 0 HA PHE A 66 128.069 21.812 -3.944 1.00 1.00 H new ATOM 0 HB2 PHE A 66 128.899 20.179 -5.726 1.00 1.00 H new ATOM 0 HB3 PHE A 66 129.693 19.266 -4.458 1.00 1.00 H new ATOM 0 HD1 PHE A 66 128.337 18.177 -2.646 1.00 1.00 H new ATOM 0 HD2 PHE A 66 126.500 20.135 -6.000 1.00 1.00 H new ATOM 0 HE1 PHE A 66 126.193 17.040 -2.138 1.00 1.00 H new ATOM 0 HE2 PHE A 66 124.360 18.992 -5.494 1.00 1.00 H new ATOM 0 HZ PHE A 66 124.206 17.451 -3.561 1.00 1.00 H new ATOM 1046 N LYS A 67 130.267 20.324 -1.969 1.00 1.00 N ATOM 1047 CA LYS A 67 130.478 19.892 -0.597 1.00 1.00 C ATOM 1048 C LYS A 67 130.233 21.037 0.355 1.00 1.00 C ATOM 1049 O LYS A 67 129.598 20.865 1.394 1.00 1.00 O ATOM 1050 CB LYS A 67 131.909 19.393 -0.371 1.00 1.00 C ATOM 1051 CG LYS A 67 132.145 18.050 -1.061 1.00 1.00 C ATOM 1052 CD LYS A 67 133.572 17.594 -0.745 1.00 1.00 C ATOM 1053 CE LYS A 67 133.860 16.256 -1.423 1.00 1.00 C ATOM 1054 NZ LYS A 67 132.855 15.246 -0.989 1.00 1.00 N ATOM 0 H LYS A 67 131.081 20.239 -2.577 1.00 1.00 H new ATOM 0 HA LYS A 67 129.779 19.077 -0.412 1.00 1.00 H new ATOM 0 HB2 LYS A 67 132.617 20.129 -0.751 1.00 1.00 H new ATOM 0 HB3 LYS A 67 132.097 19.293 0.698 1.00 1.00 H new ATOM 0 HG2 LYS A 67 131.424 17.311 -0.712 1.00 1.00 H new ATOM 0 HG3 LYS A 67 132.006 18.146 -2.138 1.00 1.00 H new ATOM 0 HD2 LYS A 67 134.285 18.344 -1.086 1.00 1.00 H new ATOM 0 HD3 LYS A 67 133.701 17.499 0.333 1.00 1.00 H new ATOM 0 HE2 LYS A 67 133.828 16.372 -2.506 1.00 1.00 H new ATOM 0 HE3 LYS A 67 134.864 15.917 -1.168 1.00 1.00 H new ATOM 0 HZ1 LYS A 67 133.344 14.415 -0.598 1.00 1.00 H new ATOM 0 HZ2 LYS A 67 132.239 15.660 -0.260 1.00 1.00 H new ATOM 0 HZ3 LYS A 67 132.279 14.957 -1.805 1.00 1.00 H new ATOM 1068 N HIS A 68 130.753 22.207 0.010 1.00 1.00 N ATOM 1069 CA HIS A 68 130.600 23.362 0.855 1.00 1.00 C ATOM 1070 C HIS A 68 129.145 23.781 0.952 1.00 1.00 C ATOM 1071 O HIS A 68 128.637 24.029 2.044 1.00 1.00 O ATOM 1072 CB HIS A 68 131.423 24.526 0.298 1.00 1.00 C ATOM 1073 CG HIS A 68 131.293 25.713 1.210 1.00 1.00 C ATOM 1074 ND1 HIS A 68 130.414 26.754 0.950 1.00 1.00 N ATOM 1075 CD2 HIS A 68 131.914 26.035 2.390 1.00 1.00 C ATOM 1076 CE1 HIS A 68 130.530 27.643 1.953 1.00 1.00 C ATOM 1077 NE2 HIS A 68 131.432 27.253 2.857 1.00 1.00 N ATOM 0 H HIS A 68 131.281 22.372 -0.847 1.00 1.00 H new ATOM 0 HA HIS A 68 130.954 23.099 1.852 1.00 1.00 H new ATOM 0 HB2 HIS A 68 132.470 24.235 0.209 1.00 1.00 H new ATOM 0 HB3 HIS A 68 131.077 24.784 -0.703 1.00 1.00 H new ATOM 0 HD2 HIS A 68 132.664 25.433 2.882 1.00 1.00 H new ATOM 0 HE1 HIS A 68 129.963 28.560 2.019 1.00 1.00 H new ATOM 0 HE2 HIS A 68 131.708 27.743 3.708 1.00 1.00 H new ATOM 1085 N PHE A 69 128.477 23.870 -0.192 1.00 1.00 N ATOM 1086 CA PHE A 69 127.092 24.278 -0.217 1.00 1.00 C ATOM 1087 C PHE A 69 126.212 23.305 0.554 1.00 1.00 C ATOM 1088 O PHE A 69 125.390 23.715 1.374 1.00 1.00 O ATOM 1089 CB PHE A 69 126.620 24.367 -1.670 1.00 1.00 C ATOM 1090 CG PHE A 69 125.122 24.540 -1.718 1.00 1.00 C ATOM 1091 CD1 PHE A 69 124.535 25.711 -1.223 1.00 1.00 C ATOM 1092 CD2 PHE A 69 124.320 23.528 -2.258 1.00 1.00 C ATOM 1093 CE1 PHE A 69 123.144 25.869 -1.273 1.00 1.00 C ATOM 1094 CE2 PHE A 69 122.933 23.689 -2.309 1.00 1.00 C ATOM 1095 CZ PHE A 69 122.345 24.860 -1.816 1.00 1.00 C ATOM 0 H PHE A 69 128.877 23.664 -1.108 1.00 1.00 H new ATOM 0 HA PHE A 69 127.010 25.253 0.263 1.00 1.00 H new ATOM 0 HB2 PHE A 69 127.107 25.205 -2.168 1.00 1.00 H new ATOM 0 HB3 PHE A 69 126.907 23.465 -2.210 1.00 1.00 H new ATOM 0 HD1 PHE A 69 125.153 26.491 -0.804 1.00 1.00 H new ATOM 0 HD2 PHE A 69 124.773 22.623 -2.635 1.00 1.00 H new ATOM 0 HE1 PHE A 69 122.689 26.771 -0.892 1.00 1.00 H new ATOM 0 HE2 PHE A 69 122.314 22.910 -2.729 1.00 1.00 H new ATOM 0 HZ PHE A 69 121.273 24.983 -1.856 1.00 1.00 H new ATOM 1105 N ALA A 70 126.354 22.020 0.247 1.00 1.00 N ATOM 1106 CA ALA A 70 125.539 20.988 0.860 1.00 1.00 C ATOM 1107 C ALA A 70 125.839 20.785 2.340 1.00 1.00 C ATOM 1108 O ALA A 70 124.933 20.506 3.125 1.00 1.00 O ATOM 1109 CB ALA A 70 125.733 19.666 0.117 1.00 1.00 C ATOM 0 H ALA A 70 127.033 21.671 -0.429 1.00 1.00 H new ATOM 0 HA ALA A 70 124.504 21.323 0.787 1.00 1.00 H new ATOM 0 HB1 ALA A 70 125.119 18.894 0.581 1.00 1.00 H new ATOM 0 HB2 ALA A 70 125.437 19.787 -0.925 1.00 1.00 H new ATOM 0 HB3 ALA A 70 126.782 19.372 0.164 1.00 1.00 H new ATOM 1115 N GLY A 71 127.099 20.910 2.725 1.00 1.00 N ATOM 1116 CA GLY A 71 127.465 20.717 4.115 1.00 1.00 C ATOM 1117 C GLY A 71 126.802 21.770 4.974 1.00 1.00 C ATOM 1118 O GLY A 71 126.432 21.514 6.120 1.00 1.00 O ATOM 0 H GLY A 71 127.874 21.141 2.103 1.00 1.00 H new ATOM 0 HA2 GLY A 71 127.163 19.723 4.445 1.00 1.00 H new ATOM 0 HA3 GLY A 71 128.548 20.774 4.226 1.00 1.00 H new ATOM 1122 N VAL A 72 126.681 22.968 4.423 1.00 1.00 N ATOM 1123 CA VAL A 72 126.093 24.068 5.147 1.00 1.00 C ATOM 1124 C VAL A 72 124.570 24.123 5.019 1.00 1.00 C ATOM 1125 O VAL A 72 123.896 24.443 5.996 1.00 1.00 O ATOM 1126 CB VAL A 72 126.696 25.379 4.640 1.00 1.00 C ATOM 1127 CG1 VAL A 72 125.746 26.532 4.940 1.00 1.00 C ATOM 1128 CG2 VAL A 72 128.031 25.631 5.342 1.00 1.00 C ATOM 0 H VAL A 72 126.984 23.196 3.476 1.00 1.00 H new ATOM 0 HA VAL A 72 126.316 23.918 6.203 1.00 1.00 H new ATOM 0 HB VAL A 72 126.854 25.309 3.564 1.00 1.00 H new ATOM 0 HG11 VAL A 72 126.179 27.464 4.577 1.00 1.00 H new ATOM 0 HG12 VAL A 72 124.793 26.357 4.442 1.00 1.00 H new ATOM 0 HG13 VAL A 72 125.586 26.601 6.016 1.00 1.00 H new ATOM 0 HG21 VAL A 72 128.461 26.565 4.981 1.00 1.00 H new ATOM 0 HG22 VAL A 72 127.869 25.698 6.418 1.00 1.00 H new ATOM 0 HG23 VAL A 72 128.715 24.810 5.128 1.00 1.00 H new ATOM 1138 N HIS A 73 124.029 23.920 3.813 1.00 1.00 N ATOM 1139 CA HIS A 73 122.586 24.074 3.595 1.00 1.00 C ATOM 1140 C HIS A 73 121.785 22.789 3.367 1.00 1.00 C ATOM 1141 O HIS A 73 120.566 22.891 3.226 1.00 1.00 O ATOM 1142 CB HIS A 73 122.360 25.001 2.402 1.00 1.00 C ATOM 1143 CG HIS A 73 122.690 26.415 2.790 1.00 1.00 C ATOM 1144 ND1 HIS A 73 123.724 27.121 2.194 1.00 1.00 N ATOM 1145 CD2 HIS A 73 122.133 27.271 3.708 1.00 1.00 C ATOM 1146 CE1 HIS A 73 123.755 28.345 2.754 1.00 1.00 C ATOM 1147 NE2 HIS A 73 122.806 28.489 3.683 1.00 1.00 N ATOM 0 H HIS A 73 124.559 23.653 2.984 1.00 1.00 H new ATOM 0 HA HIS A 73 122.210 24.480 4.534 1.00 1.00 H new ATOM 0 HB2 HIS A 73 122.983 24.689 1.564 1.00 1.00 H new ATOM 0 HB3 HIS A 73 121.324 24.937 2.071 1.00 1.00 H new ATOM 0 HD2 HIS A 73 121.299 27.035 4.352 1.00 1.00 H new ATOM 0 HE1 HIS A 73 124.461 29.117 2.485 1.00 1.00 H new ATOM 0 HE2 HIS A 73 122.616 29.314 4.252 1.00 1.00 H new ATOM 1155 N LEU A 74 122.401 21.603 3.258 1.00 1.00 N ATOM 1156 CA LEU A 74 121.575 20.421 2.964 1.00 1.00 C ATOM 1157 C LEU A 74 121.937 19.154 3.717 1.00 1.00 C ATOM 1158 O LEU A 74 123.035 19.019 4.257 1.00 1.00 O ATOM 1159 CB LEU A 74 121.635 20.093 1.471 1.00 1.00 C ATOM 1160 CG LEU A 74 120.915 21.161 0.640 1.00 1.00 C ATOM 1161 CD1 LEU A 74 121.925 22.171 0.106 1.00 1.00 C ATOM 1162 CD2 LEU A 74 120.224 20.476 -0.533 1.00 1.00 C ATOM 0 H LEU A 74 123.402 21.438 3.361 1.00 1.00 H new ATOM 0 HA LEU A 74 120.579 20.713 3.296 1.00 1.00 H new ATOM 0 HB2 LEU A 74 122.675 20.021 1.153 1.00 1.00 H new ATOM 0 HB3 LEU A 74 121.179 19.120 1.291 1.00 1.00 H new ATOM 0 HG LEU A 74 120.186 21.681 1.261 1.00 1.00 H new ATOM 0 HD11 LEU A 74 121.407 22.927 -0.484 1.00 1.00 H new ATOM 0 HD12 LEU A 74 122.437 22.650 0.941 1.00 1.00 H new ATOM 0 HD13 LEU A 74 122.655 21.659 -0.521 1.00 1.00 H new ATOM 0 HD21 LEU A 74 119.706 21.222 -1.136 1.00 1.00 H new ATOM 0 HD22 LEU A 74 120.967 19.966 -1.146 1.00 1.00 H new ATOM 0 HD23 LEU A 74 119.504 19.749 -0.157 1.00 1.00 H new ATOM 1174 N HIS A 75 121.030 18.190 3.644 1.00 1.00 N ATOM 1175 CA HIS A 75 121.257 16.870 4.199 1.00 1.00 C ATOM 1176 C HIS A 75 121.275 15.924 3.001 1.00 1.00 C ATOM 1177 O HIS A 75 120.334 15.932 2.205 1.00 1.00 O ATOM 1178 CB HIS A 75 120.149 16.469 5.173 1.00 1.00 C ATOM 1179 CG HIS A 75 120.144 17.385 6.366 1.00 1.00 C ATOM 1180 ND1 HIS A 75 121.107 17.318 7.362 1.00 1.00 N ATOM 1181 CD2 HIS A 75 119.281 18.382 6.745 1.00 1.00 C ATOM 1182 CE1 HIS A 75 120.799 18.249 8.286 1.00 1.00 C ATOM 1183 NE2 HIS A 75 119.695 18.924 7.958 1.00 1.00 N ATOM 0 H HIS A 75 120.119 18.304 3.199 1.00 1.00 H new ATOM 0 HA HIS A 75 122.187 16.840 4.766 1.00 1.00 H new ATOM 0 HB2 HIS A 75 119.182 16.510 4.671 1.00 1.00 H new ATOM 0 HB3 HIS A 75 120.296 15.439 5.498 1.00 1.00 H new ATOM 0 HD1 HIS A 75 121.903 16.681 7.390 1.00 1.00 H new ATOM 0 HD2 HIS A 75 118.412 18.698 6.187 1.00 1.00 H new ATOM 0 HE1 HIS A 75 121.375 18.427 9.182 1.00 1.00 H new ATOM 1191 N MET A 76 122.333 15.135 2.847 1.00 1.00 N ATOM 1192 CA MET A 76 122.422 14.229 1.702 1.00 1.00 C ATOM 1193 C MET A 76 122.112 12.792 2.099 1.00 1.00 C ATOM 1194 O MET A 76 122.565 12.308 3.137 1.00 1.00 O ATOM 1195 CB MET A 76 123.818 14.300 1.078 1.00 1.00 C ATOM 1196 CG MET A 76 123.913 13.313 -0.093 1.00 1.00 C ATOM 1197 SD MET A 76 124.649 14.136 -1.530 1.00 1.00 S ATOM 1198 CE MET A 76 123.216 15.140 -2.001 1.00 1.00 C ATOM 0 H MET A 76 123.128 15.102 3.485 1.00 1.00 H new ATOM 0 HA MET A 76 121.678 14.548 0.972 1.00 1.00 H new ATOM 0 HB2 MET A 76 124.020 15.313 0.729 1.00 1.00 H new ATOM 0 HB3 MET A 76 124.574 14.064 1.827 1.00 1.00 H new ATOM 0 HG2 MET A 76 124.517 12.452 0.193 1.00 1.00 H new ATOM 0 HG3 MET A 76 122.921 12.937 -0.346 1.00 1.00 H new ATOM 0 HE1 MET A 76 122.939 14.918 -3.032 1.00 1.00 H new ATOM 0 HE2 MET A 76 122.378 14.910 -1.343 1.00 1.00 H new ATOM 0 HE3 MET A 76 123.467 16.197 -1.912 1.00 1.00 H new ATOM 1208 N VAL A 77 121.350 12.114 1.244 1.00 1.00 N ATOM 1209 CA VAL A 77 120.994 10.727 1.476 1.00 1.00 C ATOM 1210 C VAL A 77 121.363 9.934 0.231 1.00 1.00 C ATOM 1211 O VAL A 77 121.038 10.340 -0.885 1.00 1.00 O ATOM 1212 CB VAL A 77 119.491 10.603 1.754 1.00 1.00 C ATOM 1213 CG1 VAL A 77 119.138 9.151 2.100 1.00 1.00 C ATOM 1214 CG2 VAL A 77 119.108 11.510 2.928 1.00 1.00 C ATOM 0 H VAL A 77 120.969 12.509 0.384 1.00 1.00 H new ATOM 0 HA VAL A 77 121.530 10.342 2.343 1.00 1.00 H new ATOM 0 HB VAL A 77 118.941 10.904 0.862 1.00 1.00 H new ATOM 0 HG11 VAL A 77 118.069 9.073 2.296 1.00 1.00 H new ATOM 0 HG12 VAL A 77 119.402 8.503 1.264 1.00 1.00 H new ATOM 0 HG13 VAL A 77 119.692 8.843 2.987 1.00 1.00 H new ATOM 0 HG21 VAL A 77 118.039 11.420 3.124 1.00 1.00 H new ATOM 0 HG22 VAL A 77 119.666 11.211 3.816 1.00 1.00 H new ATOM 0 HG23 VAL A 77 119.346 12.545 2.681 1.00 1.00 H new ATOM 1224 N GLU A 78 122.042 8.815 0.421 1.00 1.00 N ATOM 1225 CA GLU A 78 122.443 7.999 -0.708 1.00 1.00 C ATOM 1226 C GLU A 78 121.443 6.876 -0.919 1.00 1.00 C ATOM 1227 O GLU A 78 121.173 6.088 -0.012 1.00 1.00 O ATOM 1228 CB GLU A 78 123.842 7.423 -0.478 1.00 1.00 C ATOM 1229 CG GLU A 78 124.286 6.664 -1.730 1.00 1.00 C ATOM 1230 CD GLU A 78 125.727 6.189 -1.578 1.00 1.00 C ATOM 1231 OE1 GLU A 78 126.257 6.303 -0.485 1.00 1.00 O ATOM 1232 OE2 GLU A 78 126.281 5.725 -2.561 1.00 1.00 O ATOM 0 H GLU A 78 122.323 8.456 1.334 1.00 1.00 H new ATOM 0 HA GLU A 78 122.467 8.624 -1.601 1.00 1.00 H new ATOM 0 HB2 GLU A 78 124.546 8.225 -0.255 1.00 1.00 H new ATOM 0 HB3 GLU A 78 123.836 6.755 0.384 1.00 1.00 H new ATOM 0 HG2 GLU A 78 123.630 5.810 -1.897 1.00 1.00 H new ATOM 0 HG3 GLU A 78 124.199 7.309 -2.604 1.00 1.00 H new ATOM 1239 N VAL A 79 120.906 6.806 -2.130 1.00 1.00 N ATOM 1240 CA VAL A 79 119.942 5.775 -2.472 1.00 1.00 C ATOM 1241 C VAL A 79 120.400 5.093 -3.755 1.00 1.00 C ATOM 1242 O VAL A 79 120.221 5.620 -4.851 1.00 1.00 O ATOM 1243 CB VAL A 79 118.558 6.407 -2.678 1.00 1.00 C ATOM 1244 CG1 VAL A 79 117.472 5.376 -2.364 1.00 1.00 C ATOM 1245 CG2 VAL A 79 118.394 7.625 -1.756 1.00 1.00 C ATOM 0 H VAL A 79 121.123 7.451 -2.889 1.00 1.00 H new ATOM 0 HA VAL A 79 119.874 5.043 -1.667 1.00 1.00 H new ATOM 0 HB VAL A 79 118.464 6.730 -3.715 1.00 1.00 H new ATOM 0 HG11 VAL A 79 116.490 5.826 -2.511 1.00 1.00 H new ATOM 0 HG12 VAL A 79 117.581 4.519 -3.028 1.00 1.00 H new ATOM 0 HG13 VAL A 79 117.570 5.048 -1.329 1.00 1.00 H new ATOM 0 HG21 VAL A 79 117.409 8.067 -1.909 1.00 1.00 H new ATOM 0 HG22 VAL A 79 118.493 7.311 -0.717 1.00 1.00 H new ATOM 0 HG23 VAL A 79 119.163 8.362 -1.987 1.00 1.00 H new ATOM 1255 N ASP A 80 121.094 3.973 -3.589 1.00 1.00 N ATOM 1256 CA ASP A 80 121.696 3.295 -4.736 1.00 1.00 C ATOM 1257 C ASP A 80 121.032 1.992 -5.154 1.00 1.00 C ATOM 1258 O ASP A 80 120.487 1.272 -4.317 1.00 1.00 O ATOM 1259 CB ASP A 80 123.171 3.024 -4.436 1.00 1.00 C ATOM 1260 CG ASP A 80 123.303 2.110 -3.221 1.00 1.00 C ATOM 1261 OD1 ASP A 80 122.285 1.790 -2.632 1.00 1.00 O ATOM 1262 OD2 ASP A 80 124.422 1.740 -2.903 1.00 1.00 O ATOM 0 H ASP A 80 121.253 3.520 -2.689 1.00 1.00 H new ATOM 0 HA ASP A 80 121.558 3.974 -5.577 1.00 1.00 H new ATOM 0 HB2 ASP A 80 123.647 2.562 -5.301 1.00 1.00 H new ATOM 0 HB3 ASP A 80 123.691 3.964 -4.251 1.00 1.00 H new ATOM 1267 N PHE A 81 121.113 1.672 -6.443 1.00 1.00 N ATOM 1268 CA PHE A 81 120.554 0.426 -6.949 1.00 1.00 C ATOM 1269 C PHE A 81 121.656 -0.335 -7.692 1.00 1.00 C ATOM 1270 O PHE A 81 121.672 -0.380 -8.922 1.00 1.00 O ATOM 1271 CB PHE A 81 119.390 0.732 -7.894 1.00 1.00 C ATOM 1272 CG PHE A 81 118.160 1.036 -7.073 1.00 1.00 C ATOM 1273 CD1 PHE A 81 118.059 2.255 -6.393 1.00 1.00 C ATOM 1274 CD2 PHE A 81 117.127 0.096 -6.984 1.00 1.00 C ATOM 1275 CE1 PHE A 81 116.923 2.535 -5.625 1.00 1.00 C ATOM 1276 CE2 PHE A 81 115.991 0.376 -6.215 1.00 1.00 C ATOM 1277 CZ PHE A 81 115.889 1.596 -5.535 1.00 1.00 C ATOM 0 H PHE A 81 121.558 2.256 -7.151 1.00 1.00 H new ATOM 0 HA PHE A 81 120.180 -0.183 -6.126 1.00 1.00 H new ATOM 0 HB2 PHE A 81 119.636 1.580 -8.533 1.00 1.00 H new ATOM 0 HB3 PHE A 81 119.204 -0.118 -8.551 1.00 1.00 H new ATOM 0 HD1 PHE A 81 118.857 2.979 -6.461 1.00 1.00 H new ATOM 0 HD2 PHE A 81 117.206 -0.845 -7.508 1.00 1.00 H new ATOM 0 HE1 PHE A 81 116.844 3.476 -5.101 1.00 1.00 H new ATOM 0 HE2 PHE A 81 115.193 -0.349 -6.146 1.00 1.00 H new ATOM 0 HZ PHE A 81 115.013 1.812 -4.941 1.00 1.00 H new ATOM 1287 N PRO A 82 122.591 -0.910 -6.964 1.00 1.00 N ATOM 1288 CA PRO A 82 123.743 -1.653 -7.560 1.00 1.00 C ATOM 1289 C PRO A 82 123.368 -3.003 -8.163 1.00 1.00 C ATOM 1290 O PRO A 82 122.356 -3.600 -7.799 1.00 1.00 O ATOM 1291 CB PRO A 82 124.713 -1.827 -6.391 1.00 1.00 C ATOM 1292 CG PRO A 82 123.870 -1.779 -5.163 1.00 1.00 C ATOM 1293 CD PRO A 82 122.655 -0.912 -5.488 1.00 1.00 C ATOM 0 HA PRO A 82 124.162 -1.103 -8.402 1.00 1.00 H new ATOM 0 HB2 PRO A 82 125.248 -2.774 -6.463 1.00 1.00 H new ATOM 0 HB3 PRO A 82 125.463 -1.037 -6.383 1.00 1.00 H new ATOM 0 HG2 PRO A 82 123.560 -2.782 -4.869 1.00 1.00 H new ATOM 0 HG3 PRO A 82 124.430 -1.360 -4.327 1.00 1.00 H new ATOM 0 HD2 PRO A 82 121.745 -1.323 -5.051 1.00 1.00 H new ATOM 0 HD3 PRO A 82 122.770 0.098 -5.094 1.00 1.00 H new ATOM 1301 N GLN A 83 124.218 -3.492 -9.057 1.00 1.00 N ATOM 1302 CA GLN A 83 123.983 -4.796 -9.667 1.00 1.00 C ATOM 1303 C GLN A 83 124.246 -5.886 -8.639 1.00 1.00 C ATOM 1304 O GLN A 83 123.470 -6.832 -8.509 1.00 1.00 O ATOM 1305 CB GLN A 83 124.895 -4.985 -10.882 1.00 1.00 C ATOM 1306 CG GLN A 83 126.345 -5.111 -10.419 1.00 1.00 C ATOM 1307 CD GLN A 83 127.288 -4.933 -11.605 1.00 1.00 C ATOM 1308 OE1 GLN A 83 126.923 -4.303 -12.598 1.00 1.00 O ATOM 1309 NE2 GLN A 83 128.484 -5.455 -11.564 1.00 1.00 N ATOM 0 H GLN A 83 125.063 -3.016 -9.372 1.00 1.00 H new ATOM 0 HA GLN A 83 122.947 -4.856 -10.002 1.00 1.00 H new ATOM 0 HB2 GLN A 83 124.600 -5.877 -11.435 1.00 1.00 H new ATOM 0 HB3 GLN A 83 124.792 -4.139 -11.562 1.00 1.00 H new ATOM 0 HG2 GLN A 83 126.559 -4.361 -9.658 1.00 1.00 H new ATOM 0 HG3 GLN A 83 126.505 -6.086 -9.959 1.00 1.00 H new ATOM 0 HE21 GLN A 83 128.785 -5.977 -10.741 1.00 1.00 H new ATOM 0 HE22 GLN A 83 129.118 -5.341 -12.355 1.00 1.00 H new ATOM 1318 N LYS A 84 125.305 -5.706 -7.869 1.00 1.00 N ATOM 1319 CA LYS A 84 125.624 -6.629 -6.804 1.00 1.00 C ATOM 1320 C LYS A 84 125.172 -6.000 -5.494 1.00 1.00 C ATOM 1321 O LYS A 84 125.837 -5.139 -4.916 1.00 1.00 O ATOM 1322 CB LYS A 84 127.114 -6.940 -6.791 1.00 1.00 C ATOM 1323 CG LYS A 84 127.932 -5.657 -6.931 1.00 1.00 C ATOM 1324 CD LYS A 84 129.140 -5.744 -6.002 1.00 1.00 C ATOM 1325 CE LYS A 84 130.023 -4.512 -6.183 1.00 1.00 C ATOM 1326 NZ LYS A 84 131.230 -4.642 -5.320 1.00 1.00 N ATOM 0 H LYS A 84 125.957 -4.927 -7.965 1.00 1.00 H new ATOM 0 HA LYS A 84 125.108 -7.578 -6.952 1.00 1.00 H new ATOM 0 HB2 LYS A 84 127.377 -7.446 -5.862 1.00 1.00 H new ATOM 0 HB3 LYS A 84 127.356 -7.623 -7.606 1.00 1.00 H new ATOM 0 HG2 LYS A 84 128.257 -5.527 -7.963 1.00 1.00 H new ATOM 0 HG3 LYS A 84 127.322 -4.790 -6.678 1.00 1.00 H new ATOM 0 HD2 LYS A 84 128.809 -5.816 -4.966 1.00 1.00 H new ATOM 0 HD3 LYS A 84 129.711 -6.647 -6.217 1.00 1.00 H new ATOM 0 HE2 LYS A 84 130.318 -4.412 -7.228 1.00 1.00 H new ATOM 0 HE3 LYS A 84 129.469 -3.611 -5.920 1.00 1.00 H new ATOM 0 HZ1 LYS A 84 131.835 -3.804 -5.440 1.00 1.00 H new ATOM 0 HZ2 LYS A 84 130.938 -4.719 -4.325 1.00 1.00 H new ATOM 0 HZ3 LYS A 84 131.761 -5.494 -5.592 1.00 1.00 H new ATOM 1340 N ASN A 85 123.996 -6.422 -5.076 1.00 1.00 N ATOM 1341 CA ASN A 85 123.364 -5.896 -3.862 1.00 1.00 C ATOM 1342 C ASN A 85 123.860 -6.571 -2.587 1.00 1.00 C ATOM 1343 O ASN A 85 123.928 -7.795 -2.471 1.00 1.00 O ATOM 1344 CB ASN A 85 121.850 -6.108 -3.943 1.00 1.00 C ATOM 1345 CG ASN A 85 121.248 -5.276 -5.067 1.00 1.00 C ATOM 1346 OD1 ASN A 85 121.765 -4.211 -5.400 1.00 1.00 O ATOM 1347 ND2 ASN A 85 120.175 -5.704 -5.674 1.00 1.00 N ATOM 0 H ASN A 85 123.447 -7.134 -5.558 1.00 1.00 H new ATOM 0 HA ASN A 85 123.626 -4.839 -3.811 1.00 1.00 H new ATOM 0 HB2 ASN A 85 121.634 -7.163 -4.110 1.00 1.00 H new ATOM 0 HB3 ASN A 85 121.388 -5.834 -2.994 1.00 1.00 H new ATOM 0 HD21 ASN A 85 119.762 -5.155 -6.428 1.00 1.00 H new ATOM 0 HD22 ASN A 85 119.749 -6.588 -5.395 1.00 1.00 H new ATOM 1354 N HIS A 86 124.207 -5.703 -1.640 1.00 1.00 N ATOM 1355 CA HIS A 86 124.709 -6.167 -0.352 1.00 1.00 C ATOM 1356 C HIS A 86 124.085 -5.375 0.798 1.00 1.00 C ATOM 1357 O HIS A 86 124.539 -5.473 1.937 1.00 1.00 O ATOM 1358 CB HIS A 86 126.229 -6.016 -0.320 1.00 1.00 C ATOM 1359 CG HIS A 86 126.824 -6.827 -1.438 1.00 1.00 C ATOM 1360 ND1 HIS A 86 126.915 -8.209 -1.382 1.00 1.00 N ATOM 1361 CD2 HIS A 86 127.349 -6.467 -2.655 1.00 1.00 C ATOM 1362 CE1 HIS A 86 127.473 -8.627 -2.533 1.00 1.00 C ATOM 1363 NE2 HIS A 86 127.756 -7.604 -3.345 1.00 1.00 N ATOM 0 H HIS A 86 124.151 -4.689 -1.738 1.00 1.00 H new ATOM 0 HA HIS A 86 124.437 -7.215 -0.228 1.00 1.00 H new ATOM 0 HB2 HIS A 86 126.506 -4.967 -0.427 1.00 1.00 H new ATOM 0 HB3 HIS A 86 126.621 -6.353 0.640 1.00 1.00 H new ATOM 0 HD1 HIS A 86 126.614 -8.802 -0.609 1.00 1.00 H new ATOM 0 HD2 HIS A 86 127.433 -5.454 -3.021 1.00 1.00 H new ATOM 0 HE1 HIS A 86 127.668 -9.662 -2.771 1.00 1.00 H new ATOM 1371 N GLN A 87 123.040 -4.609 0.506 1.00 1.00 N ATOM 1372 CA GLN A 87 122.369 -3.829 1.544 1.00 1.00 C ATOM 1373 C GLN A 87 121.360 -4.718 2.276 1.00 1.00 C ATOM 1374 O GLN A 87 120.814 -5.648 1.682 1.00 1.00 O ATOM 1375 CB GLN A 87 121.655 -2.631 0.907 1.00 1.00 C ATOM 1376 CG GLN A 87 122.688 -1.724 0.232 1.00 1.00 C ATOM 1377 CD GLN A 87 123.264 -0.740 1.245 1.00 1.00 C ATOM 1378 OE1 GLN A 87 123.498 -1.098 2.400 1.00 1.00 O ATOM 1379 NE2 GLN A 87 123.511 0.487 0.876 1.00 1.00 N ATOM 0 H GLN A 87 122.642 -4.510 -0.428 1.00 1.00 H new ATOM 0 HA GLN A 87 123.104 -3.461 2.260 1.00 1.00 H new ATOM 0 HB2 GLN A 87 120.924 -2.976 0.175 1.00 1.00 H new ATOM 0 HB3 GLN A 87 121.107 -2.074 1.667 1.00 1.00 H new ATOM 0 HG2 GLN A 87 123.489 -2.327 -0.196 1.00 1.00 H new ATOM 0 HG3 GLN A 87 122.224 -1.181 -0.591 1.00 1.00 H new ATOM 0 HE21 GLN A 87 123.316 0.781 -0.081 1.00 1.00 H new ATOM 0 HE22 GLN A 87 123.899 1.152 1.545 1.00 1.00 H new ATOM 1388 N PRO A 88 121.100 -4.472 3.543 1.00 1.00 N ATOM 1389 CA PRO A 88 120.136 -5.301 4.326 1.00 1.00 C ATOM 1390 C PRO A 88 118.711 -5.172 3.799 1.00 1.00 C ATOM 1391 O PRO A 88 118.366 -4.189 3.140 1.00 1.00 O ATOM 1392 CB PRO A 88 120.254 -4.765 5.755 1.00 1.00 C ATOM 1393 CG PRO A 88 120.784 -3.381 5.610 1.00 1.00 C ATOM 1394 CD PRO A 88 121.677 -3.395 4.369 1.00 1.00 C ATOM 0 HA PRO A 88 120.364 -6.365 4.258 1.00 1.00 H new ATOM 0 HB2 PRO A 88 119.286 -4.766 6.257 1.00 1.00 H new ATOM 0 HB3 PRO A 88 120.924 -5.383 6.353 1.00 1.00 H new ATOM 0 HG2 PRO A 88 119.972 -2.663 5.497 1.00 1.00 H new ATOM 0 HG3 PRO A 88 121.350 -3.086 6.494 1.00 1.00 H new ATOM 0 HD2 PRO A 88 121.658 -2.437 3.850 1.00 1.00 H new ATOM 0 HD3 PRO A 88 122.717 -3.598 4.625 1.00 1.00 H new ATOM 1402 N GLU A 89 117.899 -6.192 4.053 1.00 1.00 N ATOM 1403 CA GLU A 89 116.527 -6.213 3.565 1.00 1.00 C ATOM 1404 C GLU A 89 115.761 -4.938 3.918 1.00 1.00 C ATOM 1405 O GLU A 89 115.077 -4.383 3.064 1.00 1.00 O ATOM 1406 CB GLU A 89 115.801 -7.424 4.153 1.00 1.00 C ATOM 1407 CG GLU A 89 116.411 -8.707 3.581 1.00 1.00 C ATOM 1408 CD GLU A 89 115.726 -9.927 4.187 1.00 1.00 C ATOM 1409 OE1 GLU A 89 114.846 -9.739 5.014 1.00 1.00 O ATOM 1410 OE2 GLU A 89 116.091 -11.031 3.817 1.00 1.00 O ATOM 0 H GLU A 89 118.168 -7.014 4.594 1.00 1.00 H new ATOM 0 HA GLU A 89 116.566 -6.278 2.478 1.00 1.00 H new ATOM 0 HB2 GLU A 89 115.885 -7.421 5.240 1.00 1.00 H new ATOM 0 HB3 GLU A 89 114.738 -7.376 3.916 1.00 1.00 H new ATOM 0 HG2 GLU A 89 116.301 -8.719 2.497 1.00 1.00 H new ATOM 0 HG3 GLU A 89 117.480 -8.737 3.793 1.00 1.00 H new ATOM 1417 N GLU A 90 115.838 -4.485 5.162 1.00 1.00 N ATOM 1418 CA GLU A 90 115.089 -3.296 5.569 1.00 1.00 C ATOM 1419 C GLU A 90 115.477 -2.071 4.746 1.00 1.00 C ATOM 1420 O GLU A 90 114.622 -1.260 4.391 1.00 1.00 O ATOM 1421 CB GLU A 90 115.329 -3.010 7.056 1.00 1.00 C ATOM 1422 CG GLU A 90 114.741 -4.143 7.909 1.00 1.00 C ATOM 1423 CD GLU A 90 115.710 -5.321 7.962 1.00 1.00 C ATOM 1424 OE1 GLU A 90 116.715 -5.267 7.276 1.00 1.00 O ATOM 1425 OE2 GLU A 90 115.430 -6.257 8.689 1.00 1.00 O ATOM 0 H GLU A 90 116.400 -4.912 5.898 1.00 1.00 H new ATOM 0 HA GLU A 90 114.032 -3.498 5.395 1.00 1.00 H new ATOM 0 HB2 GLU A 90 116.398 -2.915 7.249 1.00 1.00 H new ATOM 0 HB3 GLU A 90 114.870 -2.060 7.331 1.00 1.00 H new ATOM 0 HG2 GLU A 90 114.541 -3.782 8.918 1.00 1.00 H new ATOM 0 HG3 GLU A 90 113.788 -4.466 7.491 1.00 1.00 H new ATOM 1432 N GLN A 91 116.758 -1.941 4.439 1.00 1.00 N ATOM 1433 CA GLN A 91 117.222 -0.801 3.652 1.00 1.00 C ATOM 1434 C GLN A 91 116.711 -0.907 2.220 1.00 1.00 C ATOM 1435 O GLN A 91 116.331 0.099 1.619 1.00 1.00 O ATOM 1436 CB GLN A 91 118.755 -0.740 3.660 1.00 1.00 C ATOM 1437 CG GLN A 91 119.237 0.462 2.835 1.00 1.00 C ATOM 1438 CD GLN A 91 120.758 0.555 2.880 1.00 1.00 C ATOM 1439 OE1 GLN A 91 121.396 -0.067 3.729 1.00 1.00 O ATOM 1440 NE2 GLN A 91 121.382 1.298 2.007 1.00 1.00 N ATOM 0 H GLN A 91 117.488 -2.598 4.716 1.00 1.00 H new ATOM 0 HA GLN A 91 116.831 0.113 4.099 1.00 1.00 H new ATOM 0 HB2 GLN A 91 119.119 -0.658 4.684 1.00 1.00 H new ATOM 0 HB3 GLN A 91 119.166 -1.662 3.249 1.00 1.00 H new ATOM 0 HG2 GLN A 91 118.902 0.362 1.803 1.00 1.00 H new ATOM 0 HG3 GLN A 91 118.797 1.380 3.225 1.00 1.00 H new ATOM 0 HE21 GLN A 91 120.852 1.813 1.304 1.00 1.00 H new ATOM 0 HE22 GLN A 91 122.400 1.364 2.028 1.00 1.00 H new ATOM 1449 N ARG A 92 116.701 -2.117 1.676 1.00 1.00 N ATOM 1450 CA ARG A 92 116.230 -2.326 0.311 1.00 1.00 C ATOM 1451 C ARG A 92 114.738 -2.031 0.181 1.00 1.00 C ATOM 1452 O ARG A 92 114.312 -1.411 -0.795 1.00 1.00 O ATOM 1453 CB ARG A 92 116.520 -3.766 -0.124 1.00 1.00 C ATOM 1454 CG ARG A 92 117.993 -3.898 -0.532 1.00 1.00 C ATOM 1455 CD ARG A 92 118.155 -3.544 -2.014 1.00 1.00 C ATOM 1456 NE ARG A 92 119.544 -3.713 -2.432 1.00 1.00 N ATOM 1457 CZ ARG A 92 120.388 -2.682 -2.502 1.00 1.00 C ATOM 1458 NH1 ARG A 92 120.007 -1.484 -2.149 1.00 1.00 N ATOM 1459 NH2 ARG A 92 121.608 -2.872 -2.921 1.00 1.00 N ATOM 0 H ARG A 92 117.011 -2.963 2.154 1.00 1.00 H new ATOM 0 HA ARG A 92 116.764 -1.633 -0.339 1.00 1.00 H new ATOM 0 HB2 ARG A 92 116.296 -4.454 0.691 1.00 1.00 H new ATOM 0 HB3 ARG A 92 115.876 -4.040 -0.959 1.00 1.00 H new ATOM 0 HG2 ARG A 92 118.609 -3.238 0.078 1.00 1.00 H new ATOM 0 HG3 ARG A 92 118.340 -4.915 -0.352 1.00 1.00 H new ATOM 0 HD2 ARG A 92 117.507 -4.179 -2.618 1.00 1.00 H new ATOM 0 HD3 ARG A 92 117.841 -2.514 -2.184 1.00 1.00 H new ATOM 0 HE ARG A 92 119.878 -4.645 -2.677 1.00 1.00 H new ATOM 0 HH11 ARG A 92 119.056 -1.329 -1.816 1.00 1.00 H new ATOM 0 HH12 ARG A 92 120.661 -0.703 -2.207 1.00 1.00 H new ATOM 0 HH21 ARG A 92 121.914 -3.806 -3.194 1.00 1.00 H new ATOM 0 HH22 ARG A 92 122.256 -2.087 -2.976 1.00 1.00 H new ATOM 1473 N GLN A 93 113.939 -2.471 1.150 1.00 1.00 N ATOM 1474 CA GLN A 93 112.497 -2.234 1.091 1.00 1.00 C ATOM 1475 C GLN A 93 112.201 -0.746 1.117 1.00 1.00 C ATOM 1476 O GLN A 93 111.386 -0.245 0.342 1.00 1.00 O ATOM 1477 CB GLN A 93 111.808 -2.896 2.283 1.00 1.00 C ATOM 1478 CG GLN A 93 111.957 -4.409 2.179 1.00 1.00 C ATOM 1479 CD GLN A 93 111.274 -5.085 3.362 1.00 1.00 C ATOM 1480 OE1 GLN A 93 111.207 -4.514 4.450 1.00 1.00 O ATOM 1481 NE2 GLN A 93 110.765 -6.277 3.215 1.00 1.00 N ATOM 0 H GLN A 93 114.257 -2.985 1.972 1.00 1.00 H new ATOM 0 HA GLN A 93 112.120 -2.661 0.162 1.00 1.00 H new ATOM 0 HB2 GLN A 93 112.247 -2.540 3.215 1.00 1.00 H new ATOM 0 HB3 GLN A 93 110.753 -2.624 2.304 1.00 1.00 H new ATOM 0 HG2 GLN A 93 111.519 -4.762 1.246 1.00 1.00 H new ATOM 0 HG3 GLN A 93 113.013 -4.678 2.157 1.00 1.00 H new ATOM 0 HE21 GLN A 93 110.822 -6.748 2.312 1.00 1.00 H new ATOM 0 HE22 GLN A 93 110.310 -6.738 4.003 1.00 1.00 H new ATOM 1490 N LYS A 94 112.865 -0.048 2.018 1.00 1.00 N ATOM 1491 CA LYS A 94 112.680 1.381 2.164 1.00 1.00 C ATOM 1492 C LYS A 94 113.060 2.109 0.875 1.00 1.00 C ATOM 1493 O LYS A 94 112.337 2.987 0.404 1.00 1.00 O ATOM 1494 CB LYS A 94 113.561 1.848 3.312 1.00 1.00 C ATOM 1495 CG LYS A 94 113.359 3.331 3.565 1.00 1.00 C ATOM 1496 CD LYS A 94 114.277 3.750 4.705 1.00 1.00 C ATOM 1497 CE LYS A 94 114.159 5.248 4.908 1.00 1.00 C ATOM 1498 NZ LYS A 94 112.785 5.584 5.370 1.00 1.00 N ATOM 0 H LYS A 94 113.543 -0.452 2.664 1.00 1.00 H new ATOM 0 HA LYS A 94 111.633 1.604 2.371 1.00 1.00 H new ATOM 0 HB2 LYS A 94 113.324 1.283 4.214 1.00 1.00 H new ATOM 0 HB3 LYS A 94 114.608 1.652 3.079 1.00 1.00 H new ATOM 0 HG2 LYS A 94 113.584 3.904 2.666 1.00 1.00 H new ATOM 0 HG3 LYS A 94 112.319 3.535 3.820 1.00 1.00 H new ATOM 0 HD2 LYS A 94 114.006 3.223 5.620 1.00 1.00 H new ATOM 0 HD3 LYS A 94 115.308 3.481 4.476 1.00 1.00 H new ATOM 0 HE2 LYS A 94 114.892 5.584 5.641 1.00 1.00 H new ATOM 0 HE3 LYS A 94 114.378 5.769 3.976 1.00 1.00 H new ATOM 0 HZ1 LYS A 94 112.707 6.612 5.508 1.00 1.00 H new ATOM 0 HZ2 LYS A 94 112.094 5.277 4.656 1.00 1.00 H new ATOM 0 HZ3 LYS A 94 112.593 5.098 6.269 1.00 1.00 H new ATOM 1512 N ASN A 95 114.207 1.738 0.319 1.00 1.00 N ATOM 1513 CA ASN A 95 114.692 2.356 -0.913 1.00 1.00 C ATOM 1514 C ASN A 95 113.697 2.168 -2.053 1.00 1.00 C ATOM 1515 O ASN A 95 113.458 3.097 -2.823 1.00 1.00 O ATOM 1516 CB ASN A 95 116.027 1.735 -1.323 1.00 1.00 C ATOM 1517 CG ASN A 95 117.159 2.296 -0.472 1.00 1.00 C ATOM 1518 OD1 ASN A 95 116.999 3.331 0.175 1.00 1.00 O ATOM 1519 ND2 ASN A 95 118.303 1.669 -0.436 1.00 1.00 N ATOM 0 H ASN A 95 114.818 1.015 0.699 1.00 1.00 H new ATOM 0 HA ASN A 95 114.816 3.422 -0.720 1.00 1.00 H new ATOM 0 HB2 ASN A 95 115.981 0.652 -1.210 1.00 1.00 H new ATOM 0 HB3 ASN A 95 116.221 1.937 -2.376 1.00 1.00 H new ATOM 0 HD21 ASN A 95 119.068 2.036 0.130 1.00 1.00 H new ATOM 0 HD22 ASN A 95 118.432 0.812 -0.973 1.00 1.00 H new ATOM 1526 N GLN A 96 113.111 0.980 -2.168 1.00 1.00 N ATOM 1527 CA GLN A 96 112.153 0.727 -3.228 1.00 1.00 C ATOM 1528 C GLN A 96 110.921 1.593 -3.022 1.00 1.00 C ATOM 1529 O GLN A 96 110.357 2.123 -3.978 1.00 1.00 O ATOM 1530 CB GLN A 96 111.775 -0.759 -3.249 1.00 1.00 C ATOM 1531 CG GLN A 96 112.969 -1.572 -3.764 1.00 1.00 C ATOM 1532 CD GLN A 96 112.691 -3.067 -3.646 1.00 1.00 C ATOM 1533 OE1 GLN A 96 111.611 -3.471 -3.215 1.00 1.00 O ATOM 1534 NE2 GLN A 96 113.612 -3.919 -4.009 1.00 1.00 N ATOM 0 H GLN A 96 113.282 0.189 -1.547 1.00 1.00 H new ATOM 0 HA GLN A 96 112.600 0.981 -4.189 1.00 1.00 H new ATOM 0 HB2 GLN A 96 111.497 -1.091 -2.249 1.00 1.00 H new ATOM 0 HB3 GLN A 96 110.907 -0.918 -3.890 1.00 1.00 H new ATOM 0 HG2 GLN A 96 113.170 -1.315 -4.804 1.00 1.00 H new ATOM 0 HG3 GLN A 96 113.863 -1.317 -3.194 1.00 1.00 H new ATOM 0 HE21 GLN A 96 114.506 -3.582 -4.366 1.00 1.00 H new ATOM 0 HE22 GLN A 96 113.437 -4.921 -3.936 1.00 1.00 H new ATOM 1543 N GLU A 97 110.519 1.744 -1.765 1.00 1.00 N ATOM 1544 CA GLU A 97 109.359 2.559 -1.449 1.00 1.00 C ATOM 1545 C GLU A 97 109.619 4.018 -1.814 1.00 1.00 C ATOM 1546 O GLU A 97 108.761 4.701 -2.371 1.00 1.00 O ATOM 1547 CB GLU A 97 109.051 2.459 0.045 1.00 1.00 C ATOM 1548 CG GLU A 97 107.736 3.179 0.352 1.00 1.00 C ATOM 1549 CD GLU A 97 107.402 3.040 1.835 1.00 1.00 C ATOM 1550 OE1 GLU A 97 108.292 2.686 2.592 1.00 1.00 O ATOM 1551 OE2 GLU A 97 106.265 3.302 2.193 1.00 1.00 O ATOM 0 H GLU A 97 110.975 1.317 -0.959 1.00 1.00 H new ATOM 0 HA GLU A 97 108.509 2.194 -2.026 1.00 1.00 H new ATOM 0 HB2 GLU A 97 108.981 1.413 0.342 1.00 1.00 H new ATOM 0 HB3 GLU A 97 109.862 2.901 0.623 1.00 1.00 H new ATOM 0 HG2 GLU A 97 107.817 4.233 0.086 1.00 1.00 H new ATOM 0 HG3 GLU A 97 106.932 2.759 -0.252 1.00 1.00 H new ATOM 1558 N LEU A 98 110.820 4.485 -1.489 1.00 1.00 N ATOM 1559 CA LEU A 98 111.228 5.855 -1.764 1.00 1.00 C ATOM 1560 C LEU A 98 111.307 6.110 -3.269 1.00 1.00 C ATOM 1561 O LEU A 98 110.910 7.170 -3.753 1.00 1.00 O ATOM 1562 CB LEU A 98 112.586 6.083 -1.100 1.00 1.00 C ATOM 1563 CG LEU A 98 112.884 7.577 -0.942 1.00 1.00 C ATOM 1564 CD1 LEU A 98 111.880 8.235 0.010 1.00 1.00 C ATOM 1565 CD2 LEU A 98 114.296 7.724 -0.375 1.00 1.00 C ATOM 0 H LEU A 98 111.536 3.924 -1.028 1.00 1.00 H new ATOM 0 HA LEU A 98 110.493 6.552 -1.361 1.00 1.00 H new ATOM 0 HB2 LEU A 98 112.601 5.602 -0.122 1.00 1.00 H new ATOM 0 HB3 LEU A 98 113.368 5.615 -1.697 1.00 1.00 H new ATOM 0 HG LEU A 98 112.803 8.068 -1.912 1.00 1.00 H new ATOM 0 HD11 LEU A 98 112.112 9.296 0.107 1.00 1.00 H new ATOM 0 HD12 LEU A 98 110.872 8.118 -0.387 1.00 1.00 H new ATOM 0 HD13 LEU A 98 111.941 7.760 0.989 1.00 1.00 H new ATOM 0 HD21 LEU A 98 114.531 8.781 -0.254 1.00 1.00 H new ATOM 0 HD22 LEU A 98 114.353 7.226 0.593 1.00 1.00 H new ATOM 0 HD23 LEU A 98 115.012 7.269 -1.060 1.00 1.00 H new ATOM 1577 N LYS A 99 111.839 5.134 -3.997 1.00 1.00 N ATOM 1578 CA LYS A 99 111.982 5.264 -5.437 1.00 1.00 C ATOM 1579 C LYS A 99 110.620 5.490 -6.058 1.00 1.00 C ATOM 1580 O LYS A 99 110.485 6.238 -7.027 1.00 1.00 O ATOM 1581 CB LYS A 99 112.594 3.982 -6.019 1.00 1.00 C ATOM 1582 CG LYS A 99 112.829 4.159 -7.520 1.00 1.00 C ATOM 1583 CD LYS A 99 113.436 2.884 -8.105 1.00 1.00 C ATOM 1584 CE LYS A 99 113.680 3.086 -9.601 1.00 1.00 C ATOM 1585 NZ LYS A 99 112.370 3.249 -10.293 1.00 1.00 N ATOM 0 H LYS A 99 112.176 4.251 -3.614 1.00 1.00 H new ATOM 0 HA LYS A 99 112.635 6.109 -5.657 1.00 1.00 H new ATOM 0 HB2 LYS A 99 113.535 3.757 -5.518 1.00 1.00 H new ATOM 0 HB3 LYS A 99 111.929 3.137 -5.842 1.00 1.00 H new ATOM 0 HG2 LYS A 99 111.888 4.387 -8.020 1.00 1.00 H new ATOM 0 HG3 LYS A 99 113.496 5.003 -7.696 1.00 1.00 H new ATOM 0 HD2 LYS A 99 114.373 2.647 -7.600 1.00 1.00 H new ATOM 0 HD3 LYS A 99 112.765 2.040 -7.944 1.00 1.00 H new ATOM 0 HE2 LYS A 99 114.303 3.965 -9.765 1.00 1.00 H new ATOM 0 HE3 LYS A 99 114.219 2.232 -10.012 1.00 1.00 H new ATOM 0 HZ1 LYS A 99 112.408 2.783 -11.222 1.00 1.00 H new ATOM 0 HZ2 LYS A 99 111.618 2.816 -9.719 1.00 1.00 H new ATOM 0 HZ3 LYS A 99 112.169 4.261 -10.421 1.00 1.00 H new ATOM 1599 N ALA A 100 109.617 4.841 -5.504 1.00 1.00 N ATOM 1600 CA ALA A 100 108.276 4.979 -6.022 1.00 1.00 C ATOM 1601 C ALA A 100 107.605 6.249 -5.513 1.00 1.00 C ATOM 1602 O ALA A 100 106.813 6.869 -6.222 1.00 1.00 O ATOM 1603 CB ALA A 100 107.443 3.780 -5.609 1.00 1.00 C ATOM 0 H ALA A 100 109.705 4.218 -4.701 1.00 1.00 H new ATOM 0 HA ALA A 100 108.344 5.038 -7.108 1.00 1.00 H new ATOM 0 HB1 ALA A 100 106.432 3.887 -6.001 1.00 1.00 H new ATOM 0 HB2 ALA A 100 107.892 2.870 -6.007 1.00 1.00 H new ATOM 0 HB3 ALA A 100 107.406 3.720 -4.521 1.00 1.00 H new ATOM 1609 N GLN A 101 107.893 6.611 -4.269 1.00 1.00 N ATOM 1610 CA GLN A 101 107.277 7.771 -3.666 1.00 1.00 C ATOM 1611 C GLN A 101 107.536 9.037 -4.462 1.00 1.00 C ATOM 1612 O GLN A 101 106.616 9.818 -4.709 1.00 1.00 O ATOM 1613 CB GLN A 101 107.784 7.920 -2.226 1.00 1.00 C ATOM 1614 CG GLN A 101 107.064 9.075 -1.542 1.00 1.00 C ATOM 1615 CD GLN A 101 107.561 9.225 -0.107 1.00 1.00 C ATOM 1616 OE1 GLN A 101 108.750 9.442 0.118 1.00 1.00 O ATOM 1617 NE2 GLN A 101 106.714 9.128 0.885 1.00 1.00 N ATOM 0 H GLN A 101 108.548 6.115 -3.665 1.00 1.00 H new ATOM 0 HA GLN A 101 106.197 7.621 -3.663 1.00 1.00 H new ATOM 0 HB2 GLN A 101 107.615 6.996 -1.674 1.00 1.00 H new ATOM 0 HB3 GLN A 101 108.859 8.099 -2.226 1.00 1.00 H new ATOM 0 HG2 GLN A 101 107.236 9.999 -2.094 1.00 1.00 H new ATOM 0 HG3 GLN A 101 105.989 8.897 -1.546 1.00 1.00 H new ATOM 0 HE21 GLN A 101 105.728 8.948 0.698 1.00 1.00 H new ATOM 0 HE22 GLN A 101 107.040 9.232 1.846 1.00 1.00 H new ATOM 1626 N TYR A 102 108.788 9.255 -4.849 1.00 1.00 N ATOM 1627 CA TYR A 102 109.122 10.455 -5.597 1.00 1.00 C ATOM 1628 C TYR A 102 109.118 10.216 -7.095 1.00 1.00 C ATOM 1629 O TYR A 102 109.579 11.052 -7.873 1.00 1.00 O ATOM 1630 CB TYR A 102 110.485 11.029 -5.162 1.00 1.00 C ATOM 1631 CG TYR A 102 110.368 11.679 -3.790 1.00 1.00 C ATOM 1632 CD1 TYR A 102 109.425 12.702 -3.559 1.00 1.00 C ATOM 1633 CD2 TYR A 102 111.185 11.243 -2.734 1.00 1.00 C ATOM 1634 CE1 TYR A 102 109.310 13.276 -2.289 1.00 1.00 C ATOM 1635 CE2 TYR A 102 111.058 11.817 -1.465 1.00 1.00 C ATOM 1636 CZ TYR A 102 110.120 12.831 -1.242 1.00 1.00 C ATOM 1637 OH TYR A 102 109.998 13.395 0.010 1.00 1.00 O ATOM 0 H TYR A 102 109.572 8.630 -4.661 1.00 1.00 H new ATOM 0 HA TYR A 102 108.344 11.184 -5.370 1.00 1.00 H new ATOM 0 HB2 TYR A 102 111.230 10.234 -5.134 1.00 1.00 H new ATOM 0 HB3 TYR A 102 110.829 11.762 -5.892 1.00 1.00 H new ATOM 0 HD1 TYR A 102 108.791 13.043 -4.364 1.00 1.00 H new ATOM 0 HD2 TYR A 102 111.913 10.463 -2.902 1.00 1.00 H new ATOM 0 HE1 TYR A 102 108.593 14.065 -2.117 1.00 1.00 H new ATOM 0 HE2 TYR A 102 111.686 11.477 -0.655 1.00 1.00 H new ATOM 0 HH TYR A 102 109.286 14.068 -0.002 1.00 1.00 H new ATOM 1647 N LYS A 103 108.553 9.076 -7.496 1.00 1.00 N ATOM 1648 CA LYS A 103 108.433 8.724 -8.902 1.00 1.00 C ATOM 1649 C LYS A 103 109.758 8.860 -9.619 1.00 1.00 C ATOM 1650 O LYS A 103 109.852 9.533 -10.645 1.00 1.00 O ATOM 1651 CB LYS A 103 107.383 9.609 -9.576 1.00 1.00 C ATOM 1652 CG LYS A 103 105.993 9.245 -9.042 1.00 1.00 C ATOM 1653 CD LYS A 103 104.936 10.130 -9.706 1.00 1.00 C ATOM 1654 CE LYS A 103 103.555 9.791 -9.139 1.00 1.00 C ATOM 1655 NZ LYS A 103 103.287 8.335 -9.319 1.00 1.00 N ATOM 0 H LYS A 103 108.170 8.379 -6.857 1.00 1.00 H new ATOM 0 HA LYS A 103 108.121 7.681 -8.962 1.00 1.00 H new ATOM 0 HB2 LYS A 103 107.597 10.660 -9.380 1.00 1.00 H new ATOM 0 HB3 LYS A 103 107.417 9.473 -10.657 1.00 1.00 H new ATOM 0 HG2 LYS A 103 105.780 8.195 -9.242 1.00 1.00 H new ATOM 0 HG3 LYS A 103 105.963 9.376 -7.960 1.00 1.00 H new ATOM 0 HD2 LYS A 103 105.165 11.181 -9.531 1.00 1.00 H new ATOM 0 HD3 LYS A 103 104.945 9.978 -10.785 1.00 1.00 H new ATOM 0 HE2 LYS A 103 103.510 10.052 -8.082 1.00 1.00 H new ATOM 0 HE3 LYS A 103 102.788 10.378 -9.645 1.00 1.00 H new ATOM 0 HZ1 LYS A 103 102.279 8.191 -9.530 1.00 1.00 H new ATOM 0 HZ2 LYS A 103 103.861 7.971 -10.107 1.00 1.00 H new ATOM 0 HZ3 LYS A 103 103.535 7.826 -8.447 1.00 1.00 H new ATOM 1669 N VAL A 104 110.782 8.215 -9.084 1.00 1.00 N ATOM 1670 CA VAL A 104 112.092 8.276 -9.700 1.00 1.00 C ATOM 1671 C VAL A 104 112.234 7.149 -10.715 1.00 1.00 C ATOM 1672 O VAL A 104 112.018 5.983 -10.385 1.00 1.00 O ATOM 1673 CB VAL A 104 113.183 8.182 -8.638 1.00 1.00 C ATOM 1674 CG1 VAL A 104 114.541 8.463 -9.274 1.00 1.00 C ATOM 1675 CG2 VAL A 104 112.913 9.221 -7.552 1.00 1.00 C ATOM 0 H VAL A 104 110.731 7.651 -8.236 1.00 1.00 H new ATOM 0 HA VAL A 104 112.200 9.231 -10.215 1.00 1.00 H new ATOM 0 HB VAL A 104 113.185 7.182 -8.204 1.00 1.00 H new ATOM 0 HG11 VAL A 104 115.320 8.396 -8.514 1.00 1.00 H new ATOM 0 HG12 VAL A 104 114.734 7.730 -10.058 1.00 1.00 H new ATOM 0 HG13 VAL A 104 114.541 9.464 -9.705 1.00 1.00 H new ATOM 0 HG21 VAL A 104 113.689 9.160 -6.789 1.00 1.00 H new ATOM 0 HG22 VAL A 104 112.916 10.218 -7.993 1.00 1.00 H new ATOM 0 HG23 VAL A 104 111.941 9.028 -7.097 1.00 1.00 H new ATOM 1685 N THR A 105 112.577 7.506 -11.950 1.00 1.00 N ATOM 1686 CA THR A 105 112.720 6.524 -13.012 1.00 1.00 C ATOM 1687 C THR A 105 114.125 6.525 -13.598 1.00 1.00 C ATOM 1688 O THR A 105 114.749 5.475 -13.750 1.00 1.00 O ATOM 1689 CB THR A 105 111.713 6.822 -14.122 1.00 1.00 C ATOM 1690 OG1 THR A 105 111.571 8.228 -14.262 1.00 1.00 O ATOM 1691 CG2 THR A 105 110.361 6.203 -13.772 1.00 1.00 C ATOM 0 H THR A 105 112.760 8.468 -12.236 1.00 1.00 H new ATOM 0 HA THR A 105 112.533 5.540 -12.582 1.00 1.00 H new ATOM 0 HB THR A 105 112.070 6.395 -15.060 1.00 1.00 H new ATOM 0 HG1 THR A 105 110.927 8.422 -14.975 1.00 1.00 H new ATOM 0 HG21 THR A 105 109.646 6.418 -14.566 1.00 1.00 H new ATOM 0 HG22 THR A 105 110.472 5.124 -13.665 1.00 1.00 H new ATOM 0 HG23 THR A 105 109.999 6.625 -12.834 1.00 1.00 H new ATOM 1699 N GLY A 106 114.603 7.715 -13.944 1.00 1.00 N ATOM 1700 CA GLY A 106 115.925 7.853 -14.540 1.00 1.00 C ATOM 1701 C GLY A 106 116.958 8.324 -13.523 1.00 1.00 C ATOM 1702 O GLY A 106 116.643 9.058 -12.590 1.00 1.00 O ATOM 0 H GLY A 106 114.098 8.593 -13.823 1.00 1.00 H new ATOM 0 HA2 GLY A 106 116.237 6.896 -14.958 1.00 1.00 H new ATOM 0 HA3 GLY A 106 115.879 8.562 -15.366 1.00 1.00 H new ATOM 1706 N PHE A 107 118.195 7.894 -13.731 1.00 1.00 N ATOM 1707 CA PHE A 107 119.307 8.264 -12.856 1.00 1.00 C ATOM 1708 C PHE A 107 120.453 8.849 -13.696 1.00 1.00 C ATOM 1709 O PHE A 107 120.611 8.477 -14.859 1.00 1.00 O ATOM 1710 CB PHE A 107 119.809 7.025 -12.114 1.00 1.00 C ATOM 1711 CG PHE A 107 119.314 5.792 -12.827 1.00 1.00 C ATOM 1712 CD1 PHE A 107 119.854 5.443 -14.071 1.00 1.00 C ATOM 1713 CD2 PHE A 107 118.312 5.001 -12.253 1.00 1.00 C ATOM 1714 CE1 PHE A 107 119.393 4.302 -14.739 1.00 1.00 C ATOM 1715 CE2 PHE A 107 117.850 3.862 -12.921 1.00 1.00 C ATOM 1716 CZ PHE A 107 118.391 3.512 -14.164 1.00 1.00 C ATOM 0 H PHE A 107 118.458 7.283 -14.504 1.00 1.00 H new ATOM 0 HA PHE A 107 118.965 9.008 -12.137 1.00 1.00 H new ATOM 0 HB2 PHE A 107 120.898 7.025 -12.075 1.00 1.00 H new ATOM 0 HB3 PHE A 107 119.453 7.033 -11.084 1.00 1.00 H new ATOM 0 HD1 PHE A 107 120.626 6.054 -14.515 1.00 1.00 H new ATOM 0 HD2 PHE A 107 117.895 5.270 -11.294 1.00 1.00 H new ATOM 0 HE1 PHE A 107 119.811 4.032 -15.698 1.00 1.00 H new ATOM 0 HE2 PHE A 107 117.076 3.253 -12.478 1.00 1.00 H new ATOM 0 HZ PHE A 107 118.035 2.632 -14.679 1.00 1.00 H new ATOM 1726 N PRO A 108 121.261 9.731 -13.148 1.00 1.00 N ATOM 1727 CA PRO A 108 121.134 10.230 -11.747 1.00 1.00 C ATOM 1728 C PRO A 108 120.042 11.272 -11.597 1.00 1.00 C ATOM 1729 O PRO A 108 119.871 12.131 -12.462 1.00 1.00 O ATOM 1730 CB PRO A 108 122.490 10.863 -11.473 1.00 1.00 C ATOM 1731 CG PRO A 108 122.943 11.359 -12.803 1.00 1.00 C ATOM 1732 CD PRO A 108 122.409 10.357 -13.831 1.00 1.00 C ATOM 0 HA PRO A 108 120.866 9.428 -11.059 1.00 1.00 H new ATOM 0 HB2 PRO A 108 122.410 11.676 -10.752 1.00 1.00 H new ATOM 0 HB3 PRO A 108 123.191 10.138 -11.060 1.00 1.00 H new ATOM 0 HG2 PRO A 108 122.559 12.360 -12.998 1.00 1.00 H new ATOM 0 HG3 PRO A 108 124.030 11.421 -12.847 1.00 1.00 H new ATOM 0 HD2 PRO A 108 122.104 10.853 -14.752 1.00 1.00 H new ATOM 0 HD3 PRO A 108 123.165 9.619 -14.101 1.00 1.00 H new ATOM 1740 N GLU A 109 119.325 11.208 -10.486 1.00 1.00 N ATOM 1741 CA GLU A 109 118.272 12.170 -10.223 1.00 1.00 C ATOM 1742 C GLU A 109 118.394 12.646 -8.787 1.00 1.00 C ATOM 1743 O GLU A 109 118.417 11.836 -7.859 1.00 1.00 O ATOM 1744 CB GLU A 109 116.903 11.529 -10.447 1.00 1.00 C ATOM 1745 CG GLU A 109 115.814 12.603 -10.407 1.00 1.00 C ATOM 1746 CD GLU A 109 115.902 13.475 -11.656 1.00 1.00 C ATOM 1747 OE1 GLU A 109 116.669 13.132 -12.541 1.00 1.00 O ATOM 1748 OE2 GLU A 109 115.197 14.468 -11.713 1.00 1.00 O ATOM 0 H GLU A 109 119.453 10.505 -9.758 1.00 1.00 H new ATOM 0 HA GLU A 109 118.370 13.016 -10.903 1.00 1.00 H new ATOM 0 HB2 GLU A 109 116.885 11.016 -11.408 1.00 1.00 H new ATOM 0 HB3 GLU A 109 116.714 10.777 -9.681 1.00 1.00 H new ATOM 0 HG2 GLU A 109 114.831 12.135 -10.347 1.00 1.00 H new ATOM 0 HG3 GLU A 109 115.929 13.218 -9.514 1.00 1.00 H new ATOM 1755 N LEU A 110 118.472 13.953 -8.600 1.00 1.00 N ATOM 1756 CA LEU A 110 118.587 14.531 -7.273 1.00 1.00 C ATOM 1757 C LEU A 110 117.311 15.310 -7.005 1.00 1.00 C ATOM 1758 O LEU A 110 116.945 16.212 -7.760 1.00 1.00 O ATOM 1759 CB LEU A 110 119.826 15.440 -7.232 1.00 1.00 C ATOM 1760 CG LEU A 110 120.634 15.254 -5.933 1.00 1.00 C ATOM 1761 CD1 LEU A 110 122.016 15.892 -6.103 1.00 1.00 C ATOM 1762 CD2 LEU A 110 119.935 15.936 -4.754 1.00 1.00 C ATOM 0 H LEU A 110 118.458 14.637 -9.356 1.00 1.00 H new ATOM 0 HA LEU A 110 118.710 13.768 -6.505 1.00 1.00 H new ATOM 0 HB2 LEU A 110 120.463 15.224 -8.090 1.00 1.00 H new ATOM 0 HB3 LEU A 110 119.515 16.481 -7.320 1.00 1.00 H new ATOM 0 HG LEU A 110 120.719 14.186 -5.733 1.00 1.00 H new ATOM 0 HD11 LEU A 110 122.592 15.763 -5.186 1.00 1.00 H new ATOM 0 HD12 LEU A 110 122.539 15.412 -6.930 1.00 1.00 H new ATOM 0 HD13 LEU A 110 121.902 16.955 -6.313 1.00 1.00 H new ATOM 0 HD21 LEU A 110 120.524 15.791 -3.848 1.00 1.00 H new ATOM 0 HD22 LEU A 110 119.837 17.003 -4.956 1.00 1.00 H new ATOM 0 HD23 LEU A 110 118.945 15.501 -4.617 1.00 1.00 H new ATOM 1774 N VAL A 111 116.623 14.917 -5.948 1.00 1.00 N ATOM 1775 CA VAL A 111 115.354 15.532 -5.591 1.00 1.00 C ATOM 1776 C VAL A 111 115.438 16.245 -4.261 1.00 1.00 C ATOM 1777 O VAL A 111 115.908 15.680 -3.276 1.00 1.00 O ATOM 1778 CB VAL A 111 114.271 14.459 -5.526 1.00 1.00 C ATOM 1779 CG1 VAL A 111 113.831 14.099 -6.942 1.00 1.00 C ATOM 1780 CG2 VAL A 111 114.842 13.229 -4.850 1.00 1.00 C ATOM 0 H VAL A 111 116.922 14.172 -5.319 1.00 1.00 H new ATOM 0 HA VAL A 111 115.108 16.270 -6.355 1.00 1.00 H new ATOM 0 HB VAL A 111 113.414 14.829 -4.963 1.00 1.00 H new ATOM 0 HG11 VAL A 111 113.057 13.333 -6.899 1.00 1.00 H new ATOM 0 HG12 VAL A 111 113.436 14.986 -7.437 1.00 1.00 H new ATOM 0 HG13 VAL A 111 114.685 13.721 -7.503 1.00 1.00 H new ATOM 0 HG21 VAL A 111 114.077 12.454 -4.798 1.00 1.00 H new ATOM 0 HG22 VAL A 111 115.693 12.861 -5.423 1.00 1.00 H new ATOM 0 HG23 VAL A 111 115.168 13.486 -3.842 1.00 1.00 H new ATOM 1790 N PHE A 112 114.988 17.480 -4.237 1.00 1.00 N ATOM 1791 CA PHE A 112 115.022 18.270 -3.026 1.00 1.00 C ATOM 1792 C PHE A 112 113.664 18.248 -2.341 1.00 1.00 C ATOM 1793 O PHE A 112 112.645 18.592 -2.940 1.00 1.00 O ATOM 1794 CB PHE A 112 115.436 19.697 -3.385 1.00 1.00 C ATOM 1795 CG PHE A 112 116.803 19.640 -4.027 1.00 1.00 C ATOM 1796 CD1 PHE A 112 117.947 19.597 -3.224 1.00 1.00 C ATOM 1797 CD2 PHE A 112 116.927 19.605 -5.423 1.00 1.00 C ATOM 1798 CE1 PHE A 112 119.215 19.523 -3.813 1.00 1.00 C ATOM 1799 CE2 PHE A 112 118.195 19.525 -6.012 1.00 1.00 C ATOM 1800 CZ PHE A 112 119.339 19.485 -5.207 1.00 1.00 C ATOM 0 H PHE A 112 114.593 17.960 -5.045 1.00 1.00 H new ATOM 0 HA PHE A 112 115.747 17.851 -2.328 1.00 1.00 H new ATOM 0 HB2 PHE A 112 114.713 20.143 -4.068 1.00 1.00 H new ATOM 0 HB3 PHE A 112 115.460 20.323 -2.493 1.00 1.00 H new ATOM 0 HD1 PHE A 112 117.852 19.621 -2.148 1.00 1.00 H new ATOM 0 HD2 PHE A 112 116.044 19.640 -6.044 1.00 1.00 H new ATOM 0 HE1 PHE A 112 120.098 19.495 -3.192 1.00 1.00 H new ATOM 0 HE2 PHE A 112 118.290 19.494 -7.087 1.00 1.00 H new ATOM 0 HZ PHE A 112 120.317 19.425 -5.661 1.00 1.00 H new ATOM 1810 N ILE A 113 113.666 17.834 -1.072 1.00 1.00 N ATOM 1811 CA ILE A 113 112.445 17.765 -0.281 1.00 1.00 C ATOM 1812 C ILE A 113 112.651 18.438 1.063 1.00 1.00 C ATOM 1813 O ILE A 113 113.764 18.501 1.581 1.00 1.00 O ATOM 1814 CB ILE A 113 111.994 16.309 -0.078 1.00 1.00 C ATOM 1815 CG1 ILE A 113 113.090 15.518 0.635 1.00 1.00 C ATOM 1816 CG2 ILE A 113 111.699 15.658 -1.431 1.00 1.00 C ATOM 1817 CD1 ILE A 113 112.576 14.116 0.965 1.00 1.00 C ATOM 0 H ILE A 113 114.506 17.541 -0.572 1.00 1.00 H new ATOM 0 HA ILE A 113 111.661 18.290 -0.828 1.00 1.00 H new ATOM 0 HB ILE A 113 111.089 16.305 0.530 1.00 1.00 H new ATOM 0 HG12 ILE A 113 113.976 15.453 0.003 1.00 1.00 H new ATOM 0 HG13 ILE A 113 113.388 16.032 1.549 1.00 1.00 H new ATOM 0 HG21 ILE A 113 111.380 14.627 -1.277 1.00 1.00 H new ATOM 0 HG22 ILE A 113 110.907 16.211 -1.936 1.00 1.00 H new ATOM 0 HG23 ILE A 113 112.599 15.672 -2.045 1.00 1.00 H new ATOM 0 HD11 ILE A 113 113.358 13.552 1.474 1.00 1.00 H new ATOM 0 HD12 ILE A 113 111.703 14.192 1.613 1.00 1.00 H new ATOM 0 HD13 ILE A 113 112.300 13.603 0.043 1.00 1.00 H new ATOM 1829 N ASP A 114 111.550 18.888 1.636 1.00 1.00 N ATOM 1830 CA ASP A 114 111.579 19.502 2.942 1.00 1.00 C ATOM 1831 C ASP A 114 111.358 18.403 3.964 1.00 1.00 C ATOM 1832 O ASP A 114 111.289 17.225 3.616 1.00 1.00 O ATOM 1833 CB ASP A 114 110.480 20.559 3.060 1.00 1.00 C ATOM 1834 CG ASP A 114 109.111 19.886 3.083 1.00 1.00 C ATOM 1835 OD1 ASP A 114 109.049 18.700 2.808 1.00 1.00 O ATOM 1836 OD2 ASP A 114 108.143 20.569 3.375 1.00 1.00 O ATOM 0 H ASP A 114 110.624 18.838 1.212 1.00 1.00 H new ATOM 0 HA ASP A 114 112.535 19.998 3.108 1.00 1.00 H new ATOM 0 HB2 ASP A 114 110.622 21.144 3.969 1.00 1.00 H new ATOM 0 HB3 ASP A 114 110.540 21.253 2.222 1.00 1.00 H new ATOM 1841 N ALA A 115 111.268 18.782 5.219 1.00 1.00 N ATOM 1842 CA ALA A 115 111.078 17.828 6.304 1.00 1.00 C ATOM 1843 C ALA A 115 109.678 17.213 6.279 1.00 1.00 C ATOM 1844 O ALA A 115 109.431 16.210 6.950 1.00 1.00 O ATOM 1845 CB ALA A 115 111.268 18.548 7.635 1.00 1.00 C ATOM 0 H ALA A 115 111.323 19.754 5.522 1.00 1.00 H new ATOM 0 HA ALA A 115 111.808 17.028 6.181 1.00 1.00 H new ATOM 0 HB1 ALA A 115 111.128 17.842 8.454 1.00 1.00 H new ATOM 0 HB2 ALA A 115 112.274 18.964 7.683 1.00 1.00 H new ATOM 0 HB3 ALA A 115 110.538 19.353 7.721 1.00 1.00 H new ATOM 1851 N GLU A 116 108.769 17.798 5.505 1.00 1.00 N ATOM 1852 CA GLU A 116 107.408 17.280 5.402 1.00 1.00 C ATOM 1853 C GLU A 116 107.281 16.430 4.144 1.00 1.00 C ATOM 1854 O GLU A 116 106.224 15.863 3.871 1.00 1.00 O ATOM 1855 CB GLU A 116 106.408 18.436 5.351 1.00 1.00 C ATOM 1856 CG GLU A 116 106.396 19.157 6.699 1.00 1.00 C ATOM 1857 CD GLU A 116 105.471 20.368 6.633 1.00 1.00 C ATOM 1858 OE1 GLU A 116 104.872 20.573 5.590 1.00 1.00 O ATOM 1859 OE2 GLU A 116 105.376 21.070 7.627 1.00 1.00 O ATOM 0 H GLU A 116 108.949 18.629 4.941 1.00 1.00 H new ATOM 0 HA GLU A 116 107.192 16.667 6.277 1.00 1.00 H new ATOM 0 HB2 GLU A 116 106.679 19.131 4.557 1.00 1.00 H new ATOM 0 HB3 GLU A 116 105.412 18.060 5.119 1.00 1.00 H new ATOM 0 HG2 GLU A 116 106.062 18.476 7.482 1.00 1.00 H new ATOM 0 HG3 GLU A 116 107.406 19.474 6.961 1.00 1.00 H new ATOM 1866 N GLY A 117 108.369 16.323 3.396 1.00 1.00 N ATOM 1867 CA GLY A 117 108.359 15.511 2.191 1.00 1.00 C ATOM 1868 C GLY A 117 107.860 16.283 0.976 1.00 1.00 C ATOM 1869 O GLY A 117 107.564 15.681 -0.058 1.00 1.00 O ATOM 0 H GLY A 117 109.257 16.781 3.599 1.00 1.00 H new ATOM 0 HA2 GLY A 117 109.366 15.143 1.996 1.00 1.00 H new ATOM 0 HA3 GLY A 117 107.725 14.638 2.349 1.00 1.00 H new ATOM 1873 N LYS A 118 107.775 17.608 1.074 1.00 1.00 N ATOM 1874 CA LYS A 118 107.325 18.396 -0.066 1.00 1.00 C ATOM 1875 C LYS A 118 108.500 18.667 -0.985 1.00 1.00 C ATOM 1876 O LYS A 118 109.575 19.021 -0.521 1.00 1.00 O ATOM 1877 CB LYS A 118 106.695 19.710 0.390 1.00 1.00 C ATOM 1878 CG LYS A 118 105.196 19.492 0.614 1.00 1.00 C ATOM 1879 CD LYS A 118 104.575 20.730 1.270 1.00 1.00 C ATOM 1880 CE LYS A 118 104.479 21.876 0.258 1.00 1.00 C ATOM 1881 NZ LYS A 118 103.638 22.966 0.828 1.00 1.00 N ATOM 0 H LYS A 118 108.006 18.146 1.909 1.00 1.00 H new ATOM 0 HA LYS A 118 106.564 17.831 -0.604 1.00 1.00 H new ATOM 0 HB2 LYS A 118 107.167 20.055 1.310 1.00 1.00 H new ATOM 0 HB3 LYS A 118 106.855 20.485 -0.360 1.00 1.00 H new ATOM 0 HG2 LYS A 118 104.704 19.290 -0.337 1.00 1.00 H new ATOM 0 HG3 LYS A 118 105.038 18.618 1.246 1.00 1.00 H new ATOM 0 HD2 LYS A 118 103.583 20.489 1.652 1.00 1.00 H new ATOM 0 HD3 LYS A 118 105.178 21.039 2.124 1.00 1.00 H new ATOM 0 HE2 LYS A 118 105.474 22.254 0.023 1.00 1.00 H new ATOM 0 HE3 LYS A 118 104.046 21.517 -0.676 1.00 1.00 H new ATOM 0 HZ1 LYS A 118 103.570 23.746 0.144 1.00 1.00 H new ATOM 0 HZ2 LYS A 118 102.686 22.600 1.031 1.00 1.00 H new ATOM 0 HZ3 LYS A 118 104.070 23.314 1.708 1.00 1.00 H new ATOM 1895 N GLN A 119 108.294 18.492 -2.282 1.00 1.00 N ATOM 1896 CA GLN A 119 109.344 18.694 -3.265 1.00 1.00 C ATOM 1897 C GLN A 119 109.585 20.171 -3.556 1.00 1.00 C ATOM 1898 O GLN A 119 108.670 20.895 -3.949 1.00 1.00 O ATOM 1899 CB GLN A 119 108.947 17.947 -4.541 1.00 1.00 C ATOM 1900 CG GLN A 119 109.470 18.673 -5.776 1.00 1.00 C ATOM 1901 CD GLN A 119 109.300 17.788 -7.004 1.00 1.00 C ATOM 1902 OE1 GLN A 119 108.175 17.457 -7.381 1.00 1.00 O ATOM 1903 NE2 GLN A 119 110.355 17.375 -7.649 1.00 1.00 N ATOM 0 H GLN A 119 107.399 18.208 -2.679 1.00 1.00 H new ATOM 0 HA GLN A 119 110.282 18.305 -2.869 1.00 1.00 H new ATOM 0 HB2 GLN A 119 109.345 16.933 -4.513 1.00 1.00 H new ATOM 0 HB3 GLN A 119 107.862 17.862 -4.596 1.00 1.00 H new ATOM 0 HG2 GLN A 119 108.931 19.610 -5.914 1.00 1.00 H new ATOM 0 HG3 GLN A 119 110.521 18.927 -5.642 1.00 1.00 H new ATOM 0 HE21 GLN A 119 111.285 17.651 -7.335 1.00 1.00 H new ATOM 0 HE22 GLN A 119 110.250 16.776 -8.468 1.00 1.00 H new ATOM 1912 N LEU A 120 110.832 20.608 -3.378 1.00 1.00 N ATOM 1913 CA LEU A 120 111.180 21.997 -3.645 1.00 1.00 C ATOM 1914 C LEU A 120 111.763 22.143 -5.046 1.00 1.00 C ATOM 1915 O LEU A 120 111.601 23.181 -5.684 1.00 1.00 O ATOM 1916 CB LEU A 120 112.209 22.517 -2.627 1.00 1.00 C ATOM 1917 CG LEU A 120 111.676 22.316 -1.203 1.00 1.00 C ATOM 1918 CD1 LEU A 120 112.125 20.972 -0.644 1.00 1.00 C ATOM 1919 CD2 LEU A 120 112.196 23.417 -0.286 1.00 1.00 C ATOM 0 H LEU A 120 111.606 20.027 -3.055 1.00 1.00 H new ATOM 0 HA LEU A 120 110.264 22.583 -3.562 1.00 1.00 H new ATOM 0 HB2 LEU A 120 113.155 21.989 -2.749 1.00 1.00 H new ATOM 0 HB3 LEU A 120 112.409 23.574 -2.805 1.00 1.00 H new ATOM 0 HG LEU A 120 110.587 22.348 -1.247 1.00 1.00 H new ATOM 0 HD11 LEU A 120 111.736 20.850 0.367 1.00 1.00 H new ATOM 0 HD12 LEU A 120 111.747 20.170 -1.278 1.00 1.00 H new ATOM 0 HD13 LEU A 120 113.214 20.933 -0.621 1.00 1.00 H new ATOM 0 HD21 LEU A 120 111.811 23.263 0.722 1.00 1.00 H new ATOM 0 HD22 LEU A 120 113.285 23.390 -0.266 1.00 1.00 H new ATOM 0 HD23 LEU A 120 111.864 24.387 -0.657 1.00 1.00 H new ATOM 1931 N ALA A 121 112.419 21.081 -5.526 1.00 1.00 N ATOM 1932 CA ALA A 121 113.006 21.078 -6.865 1.00 1.00 C ATOM 1933 C ALA A 121 113.649 19.725 -7.172 1.00 1.00 C ATOM 1934 O ALA A 121 113.837 18.904 -6.275 1.00 1.00 O ATOM 1935 CB ALA A 121 114.078 22.163 -6.990 1.00 1.00 C ATOM 0 H ALA A 121 112.555 20.214 -5.006 1.00 1.00 H new ATOM 0 HA ALA A 121 112.201 21.272 -7.574 1.00 1.00 H new ATOM 0 HB1 ALA A 121 114.501 22.142 -7.994 1.00 1.00 H new ATOM 0 HB2 ALA A 121 113.631 23.140 -6.805 1.00 1.00 H new ATOM 0 HB3 ALA A 121 114.867 21.981 -6.260 1.00 1.00 H new ATOM 1941 N ARG A 122 113.996 19.507 -8.433 1.00 1.00 N ATOM 1942 CA ARG A 122 114.637 18.257 -8.829 1.00 1.00 C ATOM 1943 C ARG A 122 115.581 18.497 -9.998 1.00 1.00 C ATOM 1944 O ARG A 122 115.290 19.291 -10.893 1.00 1.00 O ATOM 1945 CB ARG A 122 113.587 17.205 -9.207 1.00 1.00 C ATOM 1946 CG ARG A 122 112.736 17.701 -10.378 1.00 1.00 C ATOM 1947 CD ARG A 122 111.760 16.599 -10.796 1.00 1.00 C ATOM 1948 NE ARG A 122 110.915 17.060 -11.889 1.00 1.00 N ATOM 1949 CZ ARG A 122 110.216 16.204 -12.625 1.00 1.00 C ATOM 1950 NH1 ARG A 122 110.311 14.921 -12.403 1.00 1.00 N ATOM 1951 NH2 ARG A 122 109.444 16.649 -13.578 1.00 1.00 N ATOM 0 H ARG A 122 113.847 20.170 -9.193 1.00 1.00 H new ATOM 0 HA ARG A 122 115.211 17.883 -7.981 1.00 1.00 H new ATOM 0 HB2 ARG A 122 114.079 16.271 -9.476 1.00 1.00 H new ATOM 0 HB3 ARG A 122 112.949 16.993 -8.349 1.00 1.00 H new ATOM 0 HG2 ARG A 122 112.188 18.598 -10.090 1.00 1.00 H new ATOM 0 HG3 ARG A 122 113.376 17.974 -11.217 1.00 1.00 H new ATOM 0 HD2 ARG A 122 112.313 15.712 -11.104 1.00 1.00 H new ATOM 0 HD3 ARG A 122 111.142 16.310 -9.946 1.00 1.00 H new ATOM 0 HE ARG A 122 110.859 18.058 -12.093 1.00 1.00 H new ATOM 0 HH11 ARG A 122 110.923 14.575 -11.664 1.00 1.00 H new ATOM 0 HH12 ARG A 122 109.774 14.264 -12.969 1.00 1.00 H new ATOM 0 HH21 ARG A 122 109.379 17.651 -13.756 1.00 1.00 H new ATOM 0 HH22 ARG A 122 108.905 15.995 -14.146 1.00 1.00 H new ATOM 1965 N MET A 123 116.713 17.793 -9.988 1.00 1.00 N ATOM 1966 CA MET A 123 117.680 17.930 -11.059 1.00 1.00 C ATOM 1967 C MET A 123 118.366 16.601 -11.360 1.00 1.00 C ATOM 1968 O MET A 123 118.410 15.702 -10.520 1.00 1.00 O ATOM 1969 CB MET A 123 118.755 18.942 -10.679 1.00 1.00 C ATOM 1970 CG MET A 123 118.115 20.276 -10.290 1.00 1.00 C ATOM 1971 SD MET A 123 119.374 21.570 -10.337 1.00 1.00 S ATOM 1972 CE MET A 123 120.078 21.268 -8.702 1.00 1.00 C ATOM 0 H MET A 123 116.974 17.132 -9.257 1.00 1.00 H new ATOM 0 HA MET A 123 117.136 18.267 -11.941 1.00 1.00 H new ATOM 0 HB2 MET A 123 119.347 18.559 -9.848 1.00 1.00 H new ATOM 0 HB3 MET A 123 119.438 19.089 -11.516 1.00 1.00 H new ATOM 0 HG2 MET A 123 117.302 20.517 -10.975 1.00 1.00 H new ATOM 0 HG3 MET A 123 117.682 20.209 -9.292 1.00 1.00 H new ATOM 0 HE1 MET A 123 121.130 21.554 -8.700 1.00 1.00 H new ATOM 0 HE2 MET A 123 119.541 21.858 -7.960 1.00 1.00 H new ATOM 0 HE3 MET A 123 119.989 20.210 -8.457 1.00 1.00 H new ATOM 1982 N GLY A 124 118.910 16.502 -12.563 1.00 1.00 N ATOM 1983 CA GLY A 124 119.615 15.297 -12.988 1.00 1.00 C ATOM 1984 C GLY A 124 121.047 15.652 -13.345 1.00 1.00 C ATOM 1985 O GLY A 124 121.627 16.564 -12.754 1.00 1.00 O ATOM 0 H GLY A 124 118.878 17.241 -13.265 1.00 1.00 H new ATOM 0 HA2 GLY A 124 119.601 14.553 -12.191 1.00 1.00 H new ATOM 0 HA3 GLY A 124 119.113 14.853 -13.848 1.00 1.00 H new ATOM 1989 N PHE A 125 121.612 14.971 -14.332 1.00 1.00 N ATOM 1990 CA PHE A 125 122.966 15.292 -14.751 1.00 1.00 C ATOM 1991 C PHE A 125 122.921 16.538 -15.621 1.00 1.00 C ATOM 1992 O PHE A 125 122.102 16.632 -16.537 1.00 1.00 O ATOM 1993 CB PHE A 125 123.584 14.133 -15.539 1.00 1.00 C ATOM 1994 CG PHE A 125 124.851 14.614 -16.207 1.00 1.00 C ATOM 1995 CD1 PHE A 125 125.988 14.889 -15.438 1.00 1.00 C ATOM 1996 CD2 PHE A 125 124.887 14.794 -17.596 1.00 1.00 C ATOM 1997 CE1 PHE A 125 127.159 15.342 -16.056 1.00 1.00 C ATOM 1998 CE2 PHE A 125 126.058 15.248 -18.214 1.00 1.00 C ATOM 1999 CZ PHE A 125 127.194 15.521 -17.443 1.00 1.00 C ATOM 0 H PHE A 125 121.166 14.211 -14.846 1.00 1.00 H new ATOM 0 HA PHE A 125 123.582 15.467 -13.869 1.00 1.00 H new ATOM 0 HB2 PHE A 125 123.803 13.299 -14.872 1.00 1.00 H new ATOM 0 HB3 PHE A 125 122.880 13.768 -16.286 1.00 1.00 H new ATOM 0 HD1 PHE A 125 125.961 14.751 -14.367 1.00 1.00 H new ATOM 0 HD2 PHE A 125 124.010 14.582 -18.190 1.00 1.00 H new ATOM 0 HE1 PHE A 125 128.036 15.553 -15.462 1.00 1.00 H new ATOM 0 HE2 PHE A 125 126.085 15.388 -19.285 1.00 1.00 H new ATOM 0 HZ PHE A 125 128.098 15.870 -17.919 1.00 1.00 H new ATOM 2009 N GLU A 126 123.780 17.507 -15.328 1.00 1.00 N ATOM 2010 CA GLU A 126 123.804 18.750 -16.080 1.00 1.00 C ATOM 2011 C GLU A 126 125.240 19.274 -16.194 1.00 1.00 C ATOM 2012 O GLU A 126 125.817 19.679 -15.186 1.00 1.00 O ATOM 2013 CB GLU A 126 122.960 19.798 -15.349 1.00 1.00 C ATOM 2014 CG GLU A 126 121.646 20.024 -16.100 1.00 1.00 C ATOM 2015 CD GLU A 126 121.902 20.839 -17.364 1.00 1.00 C ATOM 2016 OE1 GLU A 126 123.060 21.041 -17.691 1.00 1.00 O ATOM 2017 OE2 GLU A 126 120.936 21.249 -17.985 1.00 1.00 O ATOM 0 H GLU A 126 124.467 17.454 -14.576 1.00 1.00 H new ATOM 0 HA GLU A 126 123.404 18.565 -17.077 1.00 1.00 H new ATOM 0 HB2 GLU A 126 122.755 19.467 -14.331 1.00 1.00 H new ATOM 0 HB3 GLU A 126 123.512 20.735 -15.274 1.00 1.00 H new ATOM 0 HG2 GLU A 126 121.196 19.066 -16.360 1.00 1.00 H new ATOM 0 HG3 GLU A 126 120.936 20.546 -15.458 1.00 1.00 H new ATOM 2024 N PRO A 127 125.832 19.303 -17.367 1.00 1.00 N ATOM 2025 CA PRO A 127 127.218 19.825 -17.518 1.00 1.00 C ATOM 2026 C PRO A 127 127.375 21.225 -16.926 1.00 1.00 C ATOM 2027 O PRO A 127 126.402 21.962 -16.772 1.00 1.00 O ATOM 2028 CB PRO A 127 127.453 19.861 -19.031 1.00 1.00 C ATOM 2029 CG PRO A 127 126.458 18.922 -19.624 1.00 1.00 C ATOM 2030 CD PRO A 127 125.280 18.839 -18.654 1.00 1.00 C ATOM 0 HA PRO A 127 127.935 19.199 -16.988 1.00 1.00 H new ATOM 0 HB2 PRO A 127 127.319 20.869 -19.423 1.00 1.00 H new ATOM 0 HB3 PRO A 127 128.471 19.556 -19.275 1.00 1.00 H new ATOM 0 HG2 PRO A 127 126.128 19.277 -20.600 1.00 1.00 H new ATOM 0 HG3 PRO A 127 126.901 17.938 -19.776 1.00 1.00 H new ATOM 0 HD2 PRO A 127 124.451 19.467 -18.981 1.00 1.00 H new ATOM 0 HD3 PRO A 127 124.898 17.821 -18.579 1.00 1.00 H new ATOM 2038 N GLY A 128 128.617 21.575 -16.603 1.00 1.00 N ATOM 2039 CA GLY A 128 128.899 22.888 -16.027 1.00 1.00 C ATOM 2040 C GLY A 128 129.742 22.785 -14.768 1.00 1.00 C ATOM 2041 O GLY A 128 130.422 23.750 -14.419 1.00 1.00 O ATOM 0 H GLY A 128 129.434 20.978 -16.728 1.00 1.00 H new ATOM 0 HA2 GLY A 128 129.418 23.503 -16.762 1.00 1.00 H new ATOM 0 HA3 GLY A 128 127.961 23.392 -15.795 1.00 1.00 H new ATOM 2045 N GLY A 129 129.752 21.644 -14.092 1.00 1.00 N ATOM 2046 CA GLY A 129 130.581 21.505 -12.907 1.00 1.00 C ATOM 2047 C GLY A 129 129.839 21.814 -11.602 1.00 1.00 C ATOM 2048 O GLY A 129 128.647 22.119 -11.594 1.00 1.00 O ATOM 0 H GLY A 129 129.207 20.818 -14.338 1.00 1.00 H new ATOM 0 HA2 GLY A 129 130.970 20.488 -12.863 1.00 1.00 H new ATOM 0 HA3 GLY A 129 131.440 22.171 -12.994 1.00 1.00 H new ATOM 2052 N GLY A 130 130.564 21.649 -10.497 1.00 1.00 N ATOM 2053 CA GLY A 130 129.990 21.820 -9.162 1.00 1.00 C ATOM 2054 C GLY A 130 129.517 23.237 -8.849 1.00 1.00 C ATOM 2055 O GLY A 130 128.446 23.416 -8.269 1.00 1.00 O ATOM 0 H GLY A 130 131.552 21.397 -10.499 1.00 1.00 H new ATOM 0 HA2 GLY A 130 129.147 21.138 -9.054 1.00 1.00 H new ATOM 0 HA3 GLY A 130 130.734 21.528 -8.421 1.00 1.00 H new ATOM 2059 N ALA A 131 130.303 24.243 -9.209 1.00 1.00 N ATOM 2060 CA ALA A 131 129.922 25.618 -8.928 1.00 1.00 C ATOM 2061 C ALA A 131 128.616 25.949 -9.629 1.00 1.00 C ATOM 2062 O ALA A 131 127.714 26.554 -9.050 1.00 1.00 O ATOM 2063 CB ALA A 131 131.006 26.568 -9.436 1.00 1.00 C ATOM 0 H ALA A 131 131.196 24.135 -9.690 1.00 1.00 H new ATOM 0 HA ALA A 131 129.800 25.734 -7.851 1.00 1.00 H new ATOM 0 HB1 ALA A 131 130.717 27.597 -9.224 1.00 1.00 H new ATOM 0 HB2 ALA A 131 131.948 26.345 -8.936 1.00 1.00 H new ATOM 0 HB3 ALA A 131 131.127 26.440 -10.512 1.00 1.00 H new ATOM 2069 N ALA A 132 128.531 25.579 -10.890 1.00 1.00 N ATOM 2070 CA ALA A 132 127.347 25.866 -11.674 1.00 1.00 C ATOM 2071 C ALA A 132 126.105 25.135 -11.141 1.00 1.00 C ATOM 2072 O ALA A 132 125.005 25.692 -11.141 1.00 1.00 O ATOM 2073 CB ALA A 132 127.612 25.475 -13.125 1.00 1.00 C ATOM 0 H ALA A 132 129.265 25.080 -11.393 1.00 1.00 H new ATOM 0 HA ALA A 132 127.137 26.933 -11.602 1.00 1.00 H new ATOM 0 HB1 ALA A 132 126.728 25.686 -13.726 1.00 1.00 H new ATOM 0 HB2 ALA A 132 128.456 26.048 -13.508 1.00 1.00 H new ATOM 0 HB3 ALA A 132 127.842 24.411 -13.179 1.00 1.00 H new ATOM 2079 N TYR A 133 126.276 23.888 -10.710 1.00 1.00 N ATOM 2080 CA TYR A 133 125.160 23.085 -10.204 1.00 1.00 C ATOM 2081 C TYR A 133 124.551 23.708 -8.955 1.00 1.00 C ATOM 2082 O TYR A 133 123.330 23.724 -8.792 1.00 1.00 O ATOM 2083 CB TYR A 133 125.659 21.681 -9.874 1.00 1.00 C ATOM 2084 CG TYR A 133 124.494 20.779 -9.533 1.00 1.00 C ATOM 2085 CD1 TYR A 133 124.051 20.668 -8.210 1.00 1.00 C ATOM 2086 CD2 TYR A 133 123.866 20.042 -10.545 1.00 1.00 C ATOM 2087 CE1 TYR A 133 122.979 19.821 -7.898 1.00 1.00 C ATOM 2088 CE2 TYR A 133 122.797 19.194 -10.233 1.00 1.00 C ATOM 2089 CZ TYR A 133 122.354 19.082 -8.913 1.00 1.00 C ATOM 2090 OH TYR A 133 121.302 18.241 -8.609 1.00 1.00 O ATOM 0 H TYR A 133 127.176 23.409 -10.700 1.00 1.00 H new ATOM 0 HA TYR A 133 124.391 23.043 -10.975 1.00 1.00 H new ATOM 0 HB2 TYR A 133 126.208 21.273 -10.723 1.00 1.00 H new ATOM 0 HB3 TYR A 133 126.354 21.722 -9.035 1.00 1.00 H new ATOM 0 HD1 TYR A 133 124.536 21.235 -7.429 1.00 1.00 H new ATOM 0 HD2 TYR A 133 124.207 20.128 -11.566 1.00 1.00 H new ATOM 0 HE1 TYR A 133 122.635 19.737 -6.878 1.00 1.00 H new ATOM 0 HE2 TYR A 133 122.314 18.625 -11.014 1.00 1.00 H new ATOM 0 HH TYR A 133 120.976 18.438 -7.706 1.00 1.00 H new ATOM 2100 N VAL A 134 125.397 24.194 -8.064 1.00 1.00 N ATOM 2101 CA VAL A 134 124.893 24.777 -6.841 1.00 1.00 C ATOM 2102 C VAL A 134 124.116 26.061 -7.124 1.00 1.00 C ATOM 2103 O VAL A 134 123.144 26.358 -6.455 1.00 1.00 O ATOM 2104 CB VAL A 134 126.021 25.002 -5.848 1.00 1.00 C ATOM 2105 CG1 VAL A 134 126.651 23.658 -5.488 1.00 1.00 C ATOM 2106 CG2 VAL A 134 127.083 25.904 -6.443 1.00 1.00 C ATOM 0 H VAL A 134 126.412 24.196 -8.163 1.00 1.00 H new ATOM 0 HA VAL A 134 124.194 24.074 -6.387 1.00 1.00 H new ATOM 0 HB VAL A 134 125.613 25.478 -4.956 1.00 1.00 H new ATOM 0 HG11 VAL A 134 127.461 23.815 -4.776 1.00 1.00 H new ATOM 0 HG12 VAL A 134 125.896 23.010 -5.042 1.00 1.00 H new ATOM 0 HG13 VAL A 134 127.046 23.188 -6.389 1.00 1.00 H new ATOM 0 HG21 VAL A 134 127.882 26.053 -5.717 1.00 1.00 H new ATOM 0 HG22 VAL A 134 127.491 25.442 -7.342 1.00 1.00 H new ATOM 0 HG23 VAL A 134 126.641 26.867 -6.699 1.00 1.00 H new ATOM 2116 N SER A 135 124.529 26.834 -8.110 1.00 1.00 N ATOM 2117 CA SER A 135 123.803 28.055 -8.416 1.00 1.00 C ATOM 2118 C SER A 135 122.357 27.713 -8.770 1.00 1.00 C ATOM 2119 O SER A 135 121.417 28.399 -8.367 1.00 1.00 O ATOM 2120 CB SER A 135 124.457 28.772 -9.596 1.00 1.00 C ATOM 2121 OG SER A 135 123.736 29.963 -9.881 1.00 1.00 O ATOM 0 H SER A 135 125.340 26.648 -8.699 1.00 1.00 H new ATOM 0 HA SER A 135 123.824 28.709 -7.544 1.00 1.00 H new ATOM 0 HB2 SER A 135 125.495 29.009 -9.362 1.00 1.00 H new ATOM 0 HB3 SER A 135 124.468 28.122 -10.471 1.00 1.00 H new ATOM 0 HG SER A 135 124.154 30.426 -10.637 1.00 1.00 H new ATOM 2127 N LYS A 136 122.210 26.655 -9.561 1.00 1.00 N ATOM 2128 CA LYS A 136 120.911 26.207 -10.028 1.00 1.00 C ATOM 2129 C LYS A 136 120.014 25.721 -8.881 1.00 1.00 C ATOM 2130 O LYS A 136 118.820 26.019 -8.856 1.00 1.00 O ATOM 2131 CB LYS A 136 121.131 25.089 -11.044 1.00 1.00 C ATOM 2132 CG LYS A 136 119.807 24.715 -11.689 1.00 1.00 C ATOM 2133 CD LYS A 136 120.054 23.671 -12.783 1.00 1.00 C ATOM 2134 CE LYS A 136 118.719 23.214 -13.374 1.00 1.00 C ATOM 2135 NZ LYS A 136 118.199 24.254 -14.305 1.00 1.00 N ATOM 0 H LYS A 136 122.989 26.087 -9.894 1.00 1.00 H new ATOM 0 HA LYS A 136 120.393 27.049 -10.487 1.00 1.00 H new ATOM 0 HB2 LYS A 136 121.840 25.412 -11.807 1.00 1.00 H new ATOM 0 HB3 LYS A 136 121.566 24.219 -10.553 1.00 1.00 H new ATOM 0 HG2 LYS A 136 119.123 24.318 -10.939 1.00 1.00 H new ATOM 0 HG3 LYS A 136 119.334 25.600 -12.115 1.00 1.00 H new ATOM 0 HD2 LYS A 136 120.683 24.094 -13.566 1.00 1.00 H new ATOM 0 HD3 LYS A 136 120.590 22.817 -12.369 1.00 1.00 H new ATOM 0 HE2 LYS A 136 118.849 22.270 -13.904 1.00 1.00 H new ATOM 0 HE3 LYS A 136 117.999 23.035 -12.575 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 117.309 23.925 -14.730 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 118.027 25.135 -13.780 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 118.898 24.429 -15.055 1.00 1.00 H new ATOM 2149 N VAL A 137 120.583 24.967 -7.942 1.00 1.00 N ATOM 2150 CA VAL A 137 119.789 24.455 -6.825 1.00 1.00 C ATOM 2151 C VAL A 137 119.305 25.603 -5.940 1.00 1.00 C ATOM 2152 O VAL A 137 118.183 25.581 -5.435 1.00 1.00 O ATOM 2153 CB VAL A 137 120.583 23.417 -6.014 1.00 1.00 C ATOM 2154 CG1 VAL A 137 121.557 24.099 -5.090 1.00 1.00 C ATOM 2155 CG2 VAL A 137 119.623 22.579 -5.165 1.00 1.00 C ATOM 0 H VAL A 137 121.568 24.701 -7.930 1.00 1.00 H new ATOM 0 HA VAL A 137 118.912 23.951 -7.230 1.00 1.00 H new ATOM 0 HB VAL A 137 121.126 22.782 -6.715 1.00 1.00 H new ATOM 0 HG11 VAL A 137 122.109 23.348 -4.525 1.00 1.00 H new ATOM 0 HG12 VAL A 137 122.255 24.699 -5.675 1.00 1.00 H new ATOM 0 HG13 VAL A 137 121.013 24.745 -4.400 1.00 1.00 H new ATOM 0 HG21 VAL A 137 120.190 21.845 -4.592 1.00 1.00 H new ATOM 0 HG22 VAL A 137 119.078 23.230 -4.482 1.00 1.00 H new ATOM 0 HG23 VAL A 137 118.916 22.064 -5.816 1.00 1.00 H new ATOM 2165 N LYS A 138 120.169 26.594 -5.746 1.00 1.00 N ATOM 2166 CA LYS A 138 119.829 27.733 -4.904 1.00 1.00 C ATOM 2167 C LYS A 138 118.613 28.454 -5.462 1.00 1.00 C ATOM 2168 O LYS A 138 117.713 28.841 -4.716 1.00 1.00 O ATOM 2169 CB LYS A 138 121.015 28.697 -4.807 1.00 1.00 C ATOM 2170 CG LYS A 138 122.118 28.056 -3.959 1.00 1.00 C ATOM 2171 CD LYS A 138 123.344 28.972 -3.920 1.00 1.00 C ATOM 2172 CE LYS A 138 124.439 28.312 -3.081 1.00 1.00 C ATOM 2173 NZ LYS A 138 125.652 29.177 -3.068 1.00 1.00 N ATOM 0 H LYS A 138 121.102 26.631 -6.157 1.00 1.00 H new ATOM 0 HA LYS A 138 119.593 27.368 -3.904 1.00 1.00 H new ATOM 0 HB2 LYS A 138 121.393 28.928 -5.803 1.00 1.00 H new ATOM 0 HB3 LYS A 138 120.697 29.639 -4.360 1.00 1.00 H new ATOM 0 HG2 LYS A 138 121.754 27.878 -2.947 1.00 1.00 H new ATOM 0 HG3 LYS A 138 122.391 27.086 -4.375 1.00 1.00 H new ATOM 0 HD2 LYS A 138 123.706 29.158 -4.931 1.00 1.00 H new ATOM 0 HD3 LYS A 138 123.077 29.939 -3.495 1.00 1.00 H new ATOM 0 HE2 LYS A 138 124.084 28.152 -2.063 1.00 1.00 H new ATOM 0 HE3 LYS A 138 124.684 27.332 -3.491 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 126.394 28.725 -2.497 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 125.995 29.308 -4.041 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 125.414 30.102 -2.657 1.00 1.00 H new ATOM 2187 N SER A 139 118.586 28.629 -6.773 1.00 1.00 N ATOM 2188 CA SER A 139 117.476 29.300 -7.418 1.00 1.00 C ATOM 2189 C SER A 139 116.207 28.473 -7.284 1.00 1.00 C ATOM 2190 O SER A 139 115.122 29.006 -7.061 1.00 1.00 O ATOM 2191 CB SER A 139 117.801 29.529 -8.895 1.00 1.00 C ATOM 2192 OG SER A 139 116.724 30.219 -9.514 1.00 1.00 O ATOM 0 H SER A 139 119.320 28.315 -7.408 1.00 1.00 H new ATOM 0 HA SER A 139 117.314 30.263 -6.933 1.00 1.00 H new ATOM 0 HB2 SER A 139 118.720 30.107 -8.991 1.00 1.00 H new ATOM 0 HB3 SER A 139 117.970 28.575 -9.394 1.00 1.00 H new ATOM 0 HG SER A 139 116.932 30.368 -10.460 1.00 1.00 H new ATOM 2198 N ALA A 140 116.354 27.164 -7.438 1.00 1.00 N ATOM 2199 CA ALA A 140 115.218 26.258 -7.363 1.00 1.00 C ATOM 2200 C ALA A 140 114.630 26.196 -5.955 1.00 1.00 C ATOM 2201 O ALA A 140 113.412 26.127 -5.790 1.00 1.00 O ATOM 2202 CB ALA A 140 115.658 24.864 -7.809 1.00 1.00 C ATOM 0 H ALA A 140 117.248 26.707 -7.615 1.00 1.00 H new ATOM 0 HA ALA A 140 114.437 26.635 -8.024 1.00 1.00 H new ATOM 0 HB1 ALA A 140 114.811 24.180 -7.755 1.00 1.00 H new ATOM 0 HB2 ALA A 140 116.023 24.909 -8.835 1.00 1.00 H new ATOM 0 HB3 ALA A 140 116.454 24.507 -7.156 1.00 1.00 H new ATOM 2208 N LEU A 141 115.486 26.194 -4.947 1.00 1.00 N ATOM 2209 CA LEU A 141 115.015 26.107 -3.570 1.00 1.00 C ATOM 2210 C LEU A 141 114.750 27.487 -2.961 1.00 1.00 C ATOM 2211 O LEU A 141 114.304 27.581 -1.818 1.00 1.00 O ATOM 2212 CB LEU A 141 116.037 25.350 -2.720 1.00 1.00 C ATOM 2213 CG LEU A 141 115.789 23.842 -2.827 1.00 1.00 C ATOM 2214 CD1 LEU A 141 115.883 23.398 -4.284 1.00 1.00 C ATOM 2215 CD2 LEU A 141 116.841 23.091 -2.006 1.00 1.00 C ATOM 0 H LEU A 141 116.499 26.251 -5.051 1.00 1.00 H new ATOM 0 HA LEU A 141 114.068 25.568 -3.580 1.00 1.00 H new ATOM 0 HB2 LEU A 141 117.047 25.586 -3.054 1.00 1.00 H new ATOM 0 HB3 LEU A 141 115.964 25.667 -1.680 1.00 1.00 H new ATOM 0 HG LEU A 141 114.792 23.620 -2.445 1.00 1.00 H new ATOM 0 HD11 LEU A 141 115.705 22.325 -4.349 1.00 1.00 H new ATOM 0 HD12 LEU A 141 115.134 23.926 -4.874 1.00 1.00 H new ATOM 0 HD13 LEU A 141 116.877 23.625 -4.670 1.00 1.00 H new ATOM 0 HD21 LEU A 141 116.664 22.018 -2.082 1.00 1.00 H new ATOM 0 HD22 LEU A 141 117.835 23.323 -2.389 1.00 1.00 H new ATOM 0 HD23 LEU A 141 116.774 23.396 -0.962 1.00 1.00 H new ATOM 2227 N LYS A 142 115.025 28.558 -3.713 1.00 1.00 N ATOM 2228 CA LYS A 142 114.807 29.921 -3.221 1.00 1.00 C ATOM 2229 C LYS A 142 115.679 30.208 -2.002 1.00 1.00 C ATOM 2230 O LYS A 142 115.203 30.739 -0.998 1.00 1.00 O ATOM 2231 CB LYS A 142 113.334 30.133 -2.852 1.00 1.00 C ATOM 2232 CG LYS A 142 112.407 29.616 -3.965 1.00 1.00 C ATOM 2233 CD LYS A 142 112.551 30.462 -5.237 1.00 1.00 C ATOM 2234 CE LYS A 142 111.587 29.935 -6.300 1.00 1.00 C ATOM 2235 NZ LYS A 142 111.734 30.739 -7.546 1.00 1.00 N ATOM 0 H LYS A 142 115.398 28.507 -4.661 1.00 1.00 H new ATOM 0 HA LYS A 142 115.081 30.608 -4.022 1.00 1.00 H new ATOM 0 HB2 LYS A 142 113.111 29.616 -1.919 1.00 1.00 H new ATOM 0 HB3 LYS A 142 113.147 31.193 -2.681 1.00 1.00 H new ATOM 0 HG2 LYS A 142 112.644 28.576 -4.187 1.00 1.00 H new ATOM 0 HG3 LYS A 142 111.373 29.641 -3.623 1.00 1.00 H new ATOM 0 HD2 LYS A 142 112.335 31.508 -5.019 1.00 1.00 H new ATOM 0 HD3 LYS A 142 113.576 30.418 -5.604 1.00 1.00 H new ATOM 0 HE2 LYS A 142 111.794 28.885 -6.506 1.00 1.00 H new ATOM 0 HE3 LYS A 142 110.561 29.992 -5.936 1.00 1.00 H new ATOM 0 HZ1 LYS A 142 111.078 30.381 -8.270 1.00 1.00 H new ATOM 0 HZ2 LYS A 142 111.516 31.736 -7.344 1.00 1.00 H new ATOM 0 HZ3 LYS A 142 112.711 30.662 -7.895 1.00 1.00 H new ATOM 2249 N LEU A 143 116.962 29.892 -2.111 1.00 1.00 N ATOM 2250 CA LEU A 143 117.908 30.154 -1.036 1.00 1.00 C ATOM 2251 C LEU A 143 118.633 31.462 -1.340 1.00 1.00 C ATOM 2252 O LEU A 143 119.292 31.593 -2.374 1.00 1.00 O ATOM 2253 CB LEU A 143 118.934 29.015 -0.952 1.00 1.00 C ATOM 2254 CG LEU A 143 118.453 27.835 -0.075 1.00 1.00 C ATOM 2255 CD1 LEU A 143 116.924 27.679 -0.072 1.00 1.00 C ATOM 2256 CD2 LEU A 143 119.066 26.547 -0.629 1.00 1.00 C ATOM 0 H LEU A 143 117.372 29.453 -2.935 1.00 1.00 H new ATOM 0 HA LEU A 143 117.377 30.224 -0.086 1.00 1.00 H new ATOM 0 HB2 LEU A 143 119.148 28.651 -1.957 1.00 1.00 H new ATOM 0 HB3 LEU A 143 119.869 29.404 -0.548 1.00 1.00 H new ATOM 0 HG LEU A 143 118.766 28.034 0.950 1.00 1.00 H new ATOM 0 HD11 LEU A 143 116.646 26.836 0.560 1.00 1.00 H new ATOM 0 HD12 LEU A 143 116.466 28.589 0.315 1.00 1.00 H new ATOM 0 HD13 LEU A 143 116.574 27.501 -1.089 1.00 1.00 H new ATOM 0 HD21 LEU A 143 118.740 25.700 -0.025 1.00 1.00 H new ATOM 0 HD22 LEU A 143 118.742 26.404 -1.660 1.00 1.00 H new ATOM 0 HD23 LEU A 143 120.153 26.618 -0.597 1.00 1.00 H new ATOM 2268 N ARG A 144 118.510 32.431 -0.435 1.00 1.00 N ATOM 2269 CA ARG A 144 119.159 33.724 -0.621 1.00 1.00 C ATOM 2270 C ARG A 144 120.496 33.755 0.109 1.00 1.00 C ATOM 2271 O ARG A 144 121.464 33.267 -0.448 1.00 1.00 O ATOM 2272 CB ARG A 144 118.256 34.847 -0.094 1.00 1.00 C ATOM 2273 CG ARG A 144 118.903 36.206 -0.381 1.00 1.00 C ATOM 2274 CD ARG A 144 117.980 37.326 0.106 1.00 1.00 C ATOM 2275 NE ARG A 144 116.756 37.358 -0.688 1.00 1.00 N ATOM 2276 CZ ARG A 144 115.778 38.213 -0.404 1.00 1.00 C ATOM 2277 NH1 ARG A 144 115.895 39.016 0.620 1.00 1.00 N ATOM 2278 NH2 ARG A 144 114.699 38.244 -1.140 1.00 1.00 N ATOM 2279 OXT ARG A 144 120.534 34.268 1.216 1.00 1.00 O ATOM 0 H ARG A 144 117.971 32.346 0.427 1.00 1.00 H new ATOM 0 HA ARG A 144 119.334 33.874 -1.686 1.00 1.00 H new ATOM 0 HB2 ARG A 144 117.276 34.792 -0.569 1.00 1.00 H new ATOM 0 HB3 ARG A 144 118.098 34.727 0.978 1.00 1.00 H new ATOM 0 HG2 ARG A 144 119.869 36.273 0.119 1.00 1.00 H new ATOM 0 HG3 ARG A 144 119.089 36.313 -1.450 1.00 1.00 H new ATOM 0 HD2 ARG A 144 117.735 37.173 1.157 1.00 1.00 H new ATOM 0 HD3 ARG A 144 118.493 38.285 0.034 1.00 1.00 H new ATOM 0 HE ARG A 144 116.649 36.715 -1.473 1.00 1.00 H new ATOM 0 HH11 ARG A 144 116.735 38.986 1.199 1.00 1.00 H new ATOM 0 HH12 ARG A 144 115.147 39.673 0.841 1.00 1.00 H new ATOM 0 HH21 ARG A 144 114.605 37.611 -1.935 1.00 1.00 H new ATOM 0 HH22 ARG A 144 113.950 38.901 -0.920 1.00 1.00 H new TER 2293 ARG A 144